A0A096MN68_PAPAN Loading...

Solute carrier family 23 member 3

AlphaFold DB , UniProt , Accession A0A096MN68, Species PAPAN (Papio anubis, Olive baboon), Gene SLC23A3, Length 618 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
1M31.6Very low29.6Very low242 Ų242160.4 Ų160.4100%1.19285%0.853SS**  0123.50-88.1163.8146.200109.4
2S29.2Very low29.1Very low110 Ų110163.7 Ų163.777%0.76986%0.86SS**  trans43.7106.416265.90000120.2
3R30.5Very low29.1Very low252 Ų252159.3 Ų159.395%0.95185%0.852SS**  65.9116.684.9-86.4-170179.7176.80.7114.6
4S26.4Very low28.8Very low120 Ų120158.9 Ų158.984%0.83986%0.857SS**  trans-142.4144.2138.948.10000110.2
5P39.7Very low28.4Very low113 Ų113152.9 Ų152.973%0.73485%0.848SS**  trans-115.1164.6-165.135.6-18.6000114.8
6L29.8Very low28.5Very low156 Ų156150.8 Ų150.882%0.81785%0.846SS**  trans27.1130.5143.8-75139000120.1
7N25.3Very low28.4Very low161 Ų161152.8 Ų152.886%0.86185%0.847SS**  -149.6146.3117.6-118-5.5000112.7
8P37Very low28.6Very low91 Ų91153.7 Ų153.759%0.59185%0.851SS**  trans-94.5164-169.939-32.9000111.3
9N24Very low28.5Very low173 Ų173150.4 Ų150.493%0.92585%0.845SS**  trans-140.6129.8155.6-103.1-19.1000111.6
10Q26.3Very low28.6Very low183 Ų183151.9 Ų151.986%0.85585%0.85SS**  trans-75.4161.5-176.3-74.2-157.5-10.500113.2
11L25.8Very low28.6Very low163 Ų163148.6 Ų148.685%0.85384%0.843SS**  trans-43141.7169.8-78.777.5000114.9
12Q24.2Very low28.4Very low200 Ų200143.1 Ų143.194%0.93583%0.825SS**  trans-129.7126.1141.2-88.3-177.7-13.900109.2
13S28Very low28.7Very low107 Ų107145.6 Ų145.675%0.74883%0.829SS**  trans-91.7132.4169.761.10000110.1
14V25.2Very low28.8Very low154 Ų154138.8 Ų138.893%0.93382%0.817SS**  trans-160.7134.1145.1175.40000108.3
15G23.7Very low29Very low69 Ų69138.6 Ų138.671%0.71181%0.813SS**  trans119.997.4139.500000117.4
16S28.7Very low28.6Very low118 Ų118139.1 Ų139.183%0.82582%0.817SS**  trans-57.1125.1157.71680000111.1
17Q26.9Very low28.6Very low185 Ų185135.6 Ų135.686%0.86481%0.81SS**  trans-145.3123.2152.8-74.2-167.6-5.700109.2A19Q17-A19 PolarHBondContact O-N 3.22Å
18D32.5Very low28.6Very low170 Ų170133.7 Ų133.791%0.90981%0.806SS**  trans-55.2113.2166-71.7-52.4000110.3
19A27Very low28Very low90 Ų90138.5 Ų138.574%0.74482%0.821SS**  trans-136.9114.7166.600000108.8Q17 A21Q17-A19 PolarHBondContact O-N 3.22Å; A19-A21 PolarHBondContact O-N 3.06Å; A19-A21 VanDerWaalsContact O-N 3.14Å
20L30.6Very low28Very low180 Ų180136.1 Ų136.194%0.94281%0.808SS**  trans-45.8114.2172.7-137.388.7000109.9
21A28.3Very low27.8Very low84 Ų84133.6 Ų133.669%0.69481%0.808SS**PPolyproline II helixtrans-63.3135.2173.700000109.6A19 L23A19-A21 PolarHBondContact O-N 3.06Å; A19-A21 VanDerWaalsContact O-N 3.14Å; A21-L23 PolarHBondContact O-N 3.23Å
22P28.2Very low27.8Very low126 Ų126130.2 Ų130.282%0.81880%0.798SS**PPolyproline II helixtrans-65.2129.1176.2-6.619.9000109
23L34Very low27.9Very low163 Ų163126.9 Ų126.985%0.85379%0.791SS**PPolyproline II helixtrans-48.4134.5168.4-79.6154000109.6A21A21-L23 PolarHBondContact O-N 3.23Å
24P34.3Very low28Very low108 Ų108128.2 Ų128.270%0.70179%0.785SS**PPolyproline II helixtrans-58.9141.317324.3-31.1000109
25P30.3Very low28Very low116 Ų116125.8 Ų125.875%0.75378%0.775SS**PPolyproline II helixtrans-58.6141.4179.724.5-32.3000109.4A27P25-A27 PolarHBondContact O-N 3.33Å
26P30.8Very low28.6Very low125 Ų125129.2 Ų129.281%0.81277%0.766SS**PPolyproline II helixtrans-57.2129.717623.4-31.4000108.7
27A29.7Very low29.1Very low82 Ų82130.1 Ų130.168%0.67876%0.762SS**PPolyproline II helixtrans-51.4139.2175.600000109.7P25 Q29P25-A27 PolarHBondContact O-N 3.33Å; A27-Q29 PolarHBondContact O-N 3.14Å
28P25.5Very low30Very low121 Ų121123.3 Ų123.379%0.78673%0.734SS**PPolyproline II helixtrans-55.9119.6178.921.1-30.7000109.2N30P28-N30 PolarHBondContact O-N 3.34Å
29Q24.9Very low30.7Very low191 Ų191119.1 Ų119.189%0.89371%0.711SS**  trans-63.7102.5172.9-69.4-178.3-6.100107.9A27 P31A27-Q29 PolarHBondContact O-N 3.14Å; Q29-P31 WeakPolarHBondContact O-CD 3.38Å
30N22.5Very low31.6Very low124 Ų124119.4 Ų119.466%0.66371%0.707SS**  trans-66.8120.2171.6-105.2-17.7000108.8P28 S32P28-N30 PolarHBondContact O-N 3.34Å; N30-S32 PolarHBondContact O-N 3.26Å
31P23.6Very low32.6Very low130 Ų130113 Ų11384%0.84468%0.684SS**THydrogen-bonded Turntrans-80.336.6-175.432.3-33.9000113.8Q29Q29-P31 WeakPolarHBondContact O-CD 3.38Å
32S25.7Very low34.1Very low92 Ų92114.5 Ų114.564%0.64369%0.689SS**THydrogen-bonded Turntrans-13411.2-175.7700000116.2N30 H34N30-S32 PolarHBondContact O-N 3.26Å; S32-H34 PolarHBondContact O-N 3.46Å
33T26.3Very low36.2Very low129 Ų129109 Ų10979%0.79165%0.653SS**  trans-81.666.3169.340.20000110.6S35T33-S35 PolarHBondContact O-N 3.07Å; T33-S35 VanDerWaalsContact O-N 3.12Å
34H28.5Very low38.6Very low136 Ų136105 Ų10563%0.6364%0.636SS**  trans-67.2107.4153.4-80.8-71.8000106.8S32 W36S32-H34 PolarHBondContact O-N 3.46Å; H34-W36 HydrophobicContact CB-CD2 4.27Å; H34-W36 VanDerWaalsContact CB-CE2 3.49Å; H34-W36 HydrophobicContact CB-CG 4.48Å; H34-W36 HydrophobicContact CB-CZ2 3.76Å; H34-W36 AromaticContact CG-CZ2 3.93Å; H34-W36 PolarHBondContact O-N 3.04Å
35S26.3Very low41Very low103 Ų103108.2 Ų108.272%0.7264%0.635SS**  trans-62.888167.653.90000108.3T33 D37T33-S35 PolarHBondContact O-N 3.07Å; T33-S35 VanDerWaalsContact O-N 3.12Å; S35-D37 PolarHBondContact O-N 3.01Å
36W35.2Very low43.7Very low140 Ų140105.1 Ų105.153%0.5362%0.624SS.*  trans-80.297.4171.6-61.1104.8000106.9H34 P38H34-W36 HydrophobicContact CB-CD2 4.27Å; H34-W36 VanDerWaalsContact CB-CE2 3.49Å; H34-W36 HydrophobicContact CB-CG 4.48Å; H34-W36 HydrophobicContact CB-CZ2 3.76Å; H34-W36 AromaticContact CG-CZ2 3.93Å; H34-W36 PolarHBondContact O-N 3.04Å; W36-P38 WeakPolarHBondContact O-CD 3.34Å
37D39.4Very low46.3Very low138 Ų138100.4 Ų100.474%0.73859%0.592SS**  trans-52.9123165.9-76.9-33.6000107.4S35 L39S35-D37 PolarHBondContact O-N 3.01Å; D37-L39 PolarHBondContact O-N 2.95Å; D37-L39 VanDerWaalsContact O-N 3.09Å
38P46.1Very low49.2Very low41 Ų4196.5 Ų96.527%0.26656%0.559SS.*  trans-52.9125.6174.416.1-25.5000107.4W36 C40W36-P38 WeakPolarHBondContact O-CD 3.34Å; P38-C40 PolarHBondContact O-N 2.96Å
39L48.5Very low52.4Low82 Ų8293.7 Ų93.743%0.42954%0.542SS..  trans-63.381.1177.7-92.597.8000109.1D37 L43D37-L39 PolarHBondContact O-N 2.95Å; D37-L39 VanDerWaalsContact O-N 3.09Å; L39-L43 HydrophobicContact CB-CD1 4.22Å; L39-L43 HydrophobicContact CD2-CD1 4.17Å
40C45.1Very low55.6Low97 Ų9788 Ų8866%0.65552%0.518SS*.  trans-91.411.8176.6-139.80000110.6P38P38-C40 PolarHBondContact O-N 2.96Å
41G51.7Low58.9Low45 Ų4582.4 Ų82.446%0.46449%0.488SS..SBendtrans-87165.9175.300000113L43G41-L43 WeakPolarHBondContact O-CD1 3.31Å; G41-L43 PolarHBondContact O-N 3.11Å
42S59.2Low62.3Low115 Ų11576.3 Ų76.380%0.80445%0.448SS*.  trans-63.8103.8174.4550000110.3
43L73.4Confident65.5Low11 Ų1175.2 Ų75.26%0.05844%0.435CS..  trans-68.4148.5174-95.369.1000110.3L39 G41 W45 L47 S48 L51L39-L43 HydrophobicContact CB-CD1 4.22Å; L39-L43 HydrophobicContact CD2-CD1 4.17Å; G41-L43 WeakPolarHBondContact O-CD1 3.31Å; G41-L43 PolarHBondContact O-N 3.11Å; L43-W45 PolarHBondContact O-N 3.19Å; L43-L47 HydrophobicContact CD2-CD2 3.59Å; L43-L47 HydrophobicContact CD2-CG 3.96Å; L43-L47 HydrophobicContact CG-CD2 4.01Å; L43-S48 VanDerWaalsContact CB-OG 3.27Å; L43-S48 WeakPolarHBondContact CB-OG 3.45Å; L43-L51 HydrophobicContact CD2-CD1 3.37Å
44P84.1Confident68.7Low78 Ų7869 Ų6951%0.50640%0.397SS..  trans-52.4134.5169.8-23.732.6000110.7G46 L47 S48P44-G46 PolarHBondContact O-N 3.29Å; P44-G46 VanDerWaalsContact O-N 3.1Å; P44-L47 PolarHBondContact O-N 3.07Å; P44-S48 PolarHBondContact O-N 2.87Å; P44-S48 PolarHBondContact O-OG 3.17Å
45W84.4Confident71.8Confident177 Ų17763.1 Ų63.167%0.6737%0.37SS*.Hα-helixtrans-50.8-40.8-175.6-80.4100000113.8L43 L47 S48 C49 L406L43-W45 PolarHBondContact O-N 3.19Å; W45-L47 PolarHBondContact O-N 3.19Å; W45-S48 PolarHBondContact O-N 3.25Å; W45-C49 PolarHBondContact O-N 3.39Å; W45-C49 PolarHBondContact O-SG 2.9Å; W45-L406 HydrophobicContact CE3-CD1 4.29Å; W45-L406 HydrophobicContact CZ3-CD1 4.22Å; W45-L406 HydrophobicContact CZ3-CD2 4.14Å; W45-L406 HydrophobicContact CZ3-CG 4.44Å
46G86.7Confident75Confident51 Ų5158.3 Ų58.353%0.52634%0.336SS..Hα-helixtrans-60.9-43.5177.500000113.3P44 C49 L50P44-G46 PolarHBondContact O-N 3.29Å; P44-G46 VanDerWaalsContact O-N 3.1Å; G46-C49 PolarHBondContact O-N 3.19Å; G46-L50 WeakPolarHBondContact O-CG 3.28Å; G46-L50 PolarHBondContact O-N 3.19Å; G46-L50 VanDerWaalsContact O-N 3.13Å
47L86.8Confident77.6Confident25 Ų2552.4 Ų52.413%0.13132%0.315CS..Hα-helixtrans-68.3-40.7177-177.965.7000111.1L43 P44 W45 C49 L50 L51 L267 L272L43-L47 HydrophobicContact CD2-CD2 3.59Å; L43-L47 HydrophobicContact CD2-CG 3.96Å; L43-L47 HydrophobicContact CG-CD2 4.01Å; P44-L47 PolarHBondContact O-N 3.07Å; W45-L47 PolarHBondContact O-N 3.19Å; L47-C49 VanDerWaalsContact C-N 3.29Å; L47-C49 PolarHBondContact O-N 3.35Å; L47-L50 PolarHBondContact O-N 3.26Å; L47-L51 HydrophobicContact CG-CD1 4.18Å; L47-L51 WeakPolarHBondContact O-CG 3.49Å; L47-L51 PolarHBondContact O-N 3.18Å; L47-L267 HydrophobicContact CD2-CD2 3.91Å; L47-L272 HydrophobicContact CD1-CD1 4.38Å; L47-L272 HydrophobicContact CD2-CD1 4.1Å
48S89.8Confident80.1Confident0 Ų045.9 Ų45.90%028%0.279CS..Hα-helixtrans-59.7-39.8175.4-60.10000111.9L43 P44 W45 A52L43-S48 VanDerWaalsContact CB-OG 3.27Å; L43-S48 WeakPolarHBondContact CB-OG 3.45Å; P44-S48 PolarHBondContact O-N 2.87Å; P44-S48 PolarHBondContact O-OG 3.17Å; W45-S48 PolarHBondContact O-N 3.25Å; S48-A52 VanDerWaalsContact O-CB 3.3Å; S48-A52 WeakPolarHBondContact O-CB 3.3Å; S48-A52 PolarHBondContact O-N 3.12Å
49C91.8Very high82.3Confident63 Ų6344 Ų4443%0.42627%0.267SS..Hα-helixtrans-64.4-41.9174-71.10000112.6W45 G46 L47 A52 L53W45-C49 PolarHBondContact O-N 3.39Å; W45-C49 PolarHBondContact O-SG 2.9Å; G46-C49 PolarHBondContact O-N 3.19Å; L47-C49 VanDerWaalsContact C-N 3.29Å; L47-C49 PolarHBondContact O-N 3.35Å; C49-A52 PolarHBondContact O-N 2.81Å; C49-L53 PolarHBondContact O-N 3.35Å
50L92.6Very high84.1Confident72 Ų7240.1 Ų40.138%0.37725%0.247SC..Hα-helixtrans-65.5-42.6176.9-68.1172.9000111.9G46 L47 A52 L53 Q54 L273 L276G46-L50 WeakPolarHBondContact O-CG 3.28Å; G46-L50 PolarHBondContact O-N 3.19Å; G46-L50 VanDerWaalsContact O-N 3.13Å; L47-L50 PolarHBondContact O-N 3.26Å; L50-A52 VanDerWaalsContact C-N 3.3Å; L50-A52 PolarHBondContact O-N 3.17Å; L50-L53 WeakPolarHBondContact O-CB 3.17Å; L50-L53 PolarHBondContact O-N 2.92Å; L50-Q54 PolarHBondContact O-N 3.4Å; L50-L273 HydrophobicContact CB-CD2 3.81Å; L50-L273 HydrophobicContact CD1-CD1 4.16Å; L50-L276 HydrophobicContact CB-CD2 4.19Å; L50-L276 HydrophobicContact CD2-CD2 3.95Å
51L92.3Very high85.9Confident6 Ų635.7 Ų35.73%0.03122%0.217CC..Hα-helixtrans-64.1-37.4175.2-71.5171.2000111.9L43 L47 Q54 H55 L272 L273 K392 I396 V403L43-L51 HydrophobicContact CD2-CD1 3.37Å; L47-L51 HydrophobicContact CG-CD1 4.18Å; L47-L51 WeakPolarHBondContact O-CG 3.49Å; L47-L51 PolarHBondContact O-N 3.18Å; L51-Q54 WeakPolarHBondContact O-CB 3.35Å; L51-Q54 PolarHBondContact O-N 3Å; L51-H55 PolarHBondContact O-CD2 3.01Å; L51-H55 VanDerWaalsContact O-CD2 3.3Å; L51-H55 PolarHBondContact O-N 3.34Å; L51-H55 VanDerWaalsContact O-N 3.08Å; L51-L272 HydrophobicContact CD2-CB 4.3Å; L51-L272 WeakPolarHBondContact CD2-O 3.27Å; L51-L273 HydrophobicContact CD2-CD2 4.47Å; L51-K392 PolarHBondContact O-NZ 3.16Å; L51-I396 HydrophobicContact CD2-CD1 4.09Å; L51-V403 HydrophobicContact CB-CG1 3.79Å; L51-V403 HydrophobicContact CB-CG2 4.1Å; L51-V403 HydrophobicContact CD1-CG2 4.14Å
52A93.9Very high87.4Confident2 Ų234.1 Ų34.12%0.01720%0.198CC..Hα-helixtrans-64.8-46.6174.500000111.1S48 C49 L50 Q54 H55 V56 V403 L406 V407S48-A52 VanDerWaalsContact O-CB 3.3Å; S48-A52 WeakPolarHBondContact O-CB 3.3Å; S48-A52 PolarHBondContact O-N 3.12Å; C49-A52 PolarHBondContact O-N 2.81Å; L50-A52 VanDerWaalsContact C-N 3.3Å; L50-A52 PolarHBondContact O-N 3.17Å; A52-Q54 PolarHBondContact O-N 3.28Å; A52-H55 WeakPolarHBondContact O-CB 3.46Å; A52-H55 PolarHBondContact O-N 2.9Å; A52-H55 VanDerWaalsContact O-N 3.09Å; A52-V56 WeakPolarHBondContact O-CG2 2.96Å; A52-V56 PolarHBondContact O-N 3.08Å; A52-V403 HydrophobicContact CB-CG1 4.3Å; A52-L406 HydrophobicContact CB-CB 3.71Å; A52-V407 HydrophobicContact CB-CG2 3.75Å
53L93.3Very high88.6Confident68 Ų6828.6 Ų28.636%0.35616%0.16SC..Hα-helixtrans-55.7-40.7174.4-177.164.7000111.5C49 L50 V56 L57 L276 L410C49-L53 PolarHBondContact O-N 3.35Å; L50-L53 WeakPolarHBondContact O-CB 3.17Å; L50-L53 PolarHBondContact O-N 2.92Å; L53-V56 PolarHBondContact O-N 3.06Å; L53-L57 WeakPolarHBondContact O-CG 3.08Å; L53-L57 PolarHBondContact O-N 3.01Å; L53-L276 HydrophobicContact CD2-CD1 3.89Å; L53-L276 HydrophobicContact CD2-CD2 4.44Å; L53-L276 HydrophobicContact CG-CD1 4.16Å; L53-L410 HydrophobicContact CD1-CD2 4.18Å
54Q92.9Very high88.8Confident0 Ų028.6 Ų28.60%016%0.16CC..Hα-helixtrans-65.6-38.6177.3-166.7177.6-30.300113.3L50 L51 A52 V56 L57 V58 L272 V275 L276 K392L50-Q54 PolarHBondContact O-N 3.4Å; L51-Q54 WeakPolarHBondContact O-CB 3.35Å; L51-Q54 PolarHBondContact O-N 3Å; A52-Q54 PolarHBondContact O-N 3.28Å; Q54-V56 VanDerWaalsContact C-N 3.34Å; Q54-L57 PolarHBondContact O-N 3.49Å; Q54-V58 WeakPolarHBondContact O-CG2 3.44Å; Q54-V58 PolarHBondContact O-N 3.09Å; Q54-L272 PolarHBondContact OE1-O 3.43Å; Q54-L272 VanDerWaalsContact OE1-O 3.07Å; Q54-V275 HydrophobicContact CG-CB 3.65Å; Q54-V275 HydrophobicContact CG-CG1 4.28Å; Q54-V275 HydrophobicContact CG-CG2 4.47Å; Q54-V275 VanDerWaalsContact NE2-CB 3.25Å; Q54-V275 VanDerWaalsContact NE2-N 3.13Å; Q54-L276 HydrophobicContact CB-CB 4.16Å; Q54-L276 HydrophobicContact CG-CB 4.03Å; Q54-K392 HydrophobicContact CG-CD 3.91Å
55H93.4Very high88.4Confident12 Ų1225 Ų256%0.05614%0.137CC..Hα-helixtrans-63-42.2170.6-83.5-67.8000111.6L51 A52 L57 V58 M59 V111 N389 K392 V407L51-H55 PolarHBondContact O-CD2 3.01Å; L51-H55 VanDerWaalsContact O-CD2 3.3Å; L51-H55 PolarHBondContact O-N 3.34Å; L51-H55 VanDerWaalsContact O-N 3.08Å; A52-H55 WeakPolarHBondContact O-CB 3.46Å; A52-H55 PolarHBondContact O-N 2.9Å; A52-H55 VanDerWaalsContact O-N 3.09Å; H55-L57 VanDerWaalsContact C-N 3.33Å; H55-L57 PolarHBondContact O-N 3.13Å; H55-V58 PolarHBondContact O-N 3.23Å; H55-M59 PolarHBondContact O-N 2.83Å; H55-V111 HydrophobicContact CB-CG2 4.26Å; H55-N389 PolarHBondContact ND1-OD1 3.37Å; H55-N389 PolarHBondContact O-OD1 2.82Å; H55-K392 PolarHBondContact CD2-NZ 2.84Å; H55-K392 WeakPolarHBondContact CE1-CE 3.43Å; H55-K392 PolarHBondContact CE1-NZ 3.04Å; H55-K392 VanDerWaalsContact ND1-CE 3.27Å; H55-K392 WeakPolarHBondContact ND1-CE 3.28Å; H55-K392 PolarHBondContact ND1-NZ 3.49Å; H55-K392 VanDerWaalsContact ND1-NZ 3.13Å; H55-K392 WeakPolarHBondContact NE2-CE 3.46Å; H55-K392 PolarHBondContact NE2-NZ 3.49Å; H55-V407 HydrophobicContact CB-CB 4.47Å; H55-V407 HydrophobicContact CB-CG1 4.17Å; H55-V407 HydrophobicContact CB-CG2 3.41Å; H55-V407 VanDerWaalsContact CB-CG2 3.41Å
56V93.6Very high88.1Confident2 Ų216.6 Ų16.61%0.01211%0.105CC..Hα-helixtrans-62.8-39.3177.6172.30000111.4A52 L53 Q54 M59 A60 V407 L410 L414A52-V56 WeakPolarHBondContact O-CG2 2.96Å; A52-V56 PolarHBondContact O-N 3.08Å; L53-V56 PolarHBondContact O-N 3.06Å; Q54-V56 VanDerWaalsContact C-N 3.34Å; V56-M59 PolarHBondContact O-N 3.29Å; V56-A60 WeakPolarHBondContact O-CB 3.35Å; V56-A60 PolarHBondContact O-N 3.49Å; V56-V407 HydrophobicContact CG2-CG1 4.04Å; V56-L410 HydrophobicContact CB-CD2 4.24Å; V56-L410 HydrophobicContact CG2-CB 4.25Å; V56-L410 HydrophobicContact CG2-CD2 3.73Å; V56-L410 HydrophobicContact CG2-CG 4.09Å; V56-L414 HydrophobicContact CG1-CD1 3.43Å; V56-L414 VanDerWaalsContact CG1-CD1 3.43Å
57L91.4Very high87.7Confident16 Ų1614.3 Ų14.38%0.0848%0.081CC..Hα-helixtrans-62.6-44.2175-72.5171.7000112.3L53 Q54 H55 A60 S61 L276 V279 L424 I427L53-L57 WeakPolarHBondContact O-CG 3.08Å; L53-L57 PolarHBondContact O-N 3.01Å; Q54-L57 PolarHBondContact O-N 3.49Å; H55-L57 VanDerWaalsContact C-N 3.33Å; H55-L57 PolarHBondContact O-N 3.13Å; L57-A60 PolarHBondContact O-N 2.92Å; L57-S61 PolarHBondContact O-N 3.16Å; L57-L276 HydrophobicContact CD1-CD1 3.4Å; L57-V279 HydrophobicContact CD1-CG1 4.22Å; L57-L424 HydrophobicContact CD2-CD2 4.44Å; L57-I427 HydrophobicContact CD2-CD1 3.72Å
58V91.9Very high87.1Confident0 Ų013.9 Ų13.90%08%0.079CC..Hα-helixtrans-63.8-42.7175.4175.70000110.6Q54 H55 S61 L62 V275 P388 K392 V435Q54-V58 WeakPolarHBondContact O-CG2 3.44Å; Q54-V58 PolarHBondContact O-N 3.09Å; H55-V58 PolarHBondContact O-N 3.23Å; V58-S61 PolarHBondContact O-N 2.88Å; V58-S61 PolarHBondContact O-OG 3.44Å; V58-L62 PolarHBondContact O-N 2.81Å; V58-V275 HydrophobicContact CG2-CG1 4.07Å; V58-P388 HydrophobicContact CG1-CB 3.69Å; V58-K392 HydrophobicContact CG2-CD 4.13Å; V58-V435 HydrophobicContact CG2-CG1 3.86Å
59M91.2Very high86.3Confident1 Ų115.5 Ų15.51%0.0059%0.087CC..Hα-helixtrans-62.3-44.9172.9-81.2-149.3-74.100113.5H55 V56 S61 L62 L63 V111 A113 N389 V407 C411H55-M59 PolarHBondContact O-N 2.83Å; V56-M59 PolarHBondContact O-N 3.29Å; M59-S61 PolarHBondContact O-N 2.9Å; M59-L62 PolarHBondContact O-N 3.42Å; M59-L62 VanDerWaalsContact O-N 3.08Å; M59-L63 WeakPolarHBondContact O-CB 3.38Å; M59-L63 PolarHBondContact O-N 3.12Å; M59-V111 HydrophobicContact CE-CG1 3.33Å; M59-V111 HydrophobicContact CG-CG1 3.47Å; M59-V111 VanDerWaalsContact CG-CG1 3.47Å; M59-V111 HydrophobicContact SD-CG1 3.1Å; M59-V111 WeakPolarHBondContact SD-CG1 3.44Å; M59-A113 HydrophobicContact CG-CB 3.9Å; M59-A113 HydrophobicContact SD-CB 3.73Å; M59-N389 WeakPolarHBondContact CG-ND2 3.43Å; M59-V407 HydrophobicContact CE-CG1 3.47Å; M59-V407 VanDerWaalsContact CE-CG1 3.47Å; M59-C411 WeakPolarHBondContact CE-SG 3.47Å
60A87.1Confident85.6Confident1 Ų112.6 Ų12.61%0.0087%0.067CC..Hα-helixtrans-59.9-38.5-179.500000110.9V56 L57 L62 L63 C64 F91 L424V56-A60 WeakPolarHBondContact O-CB 3.35Å; V56-A60 PolarHBondContact O-N 3.49Å; L57-A60 PolarHBondContact O-N 2.92Å; A60-L62 PolarHBondContact O-N 3.5Å; A60-L63 PolarHBondContact O-N 3.47Å; A60-C64 WeakPolarHBondContact O-CB 3.27Å; A60-C64 PolarHBondContact O-N 3.19Å; A60-C64 PolarHBondContact O-SG 3.47Å; A60-F91 HydrophobicContact CB-CE1 4.14Å; A60-F91 HydrophobicContact CB-CZ 3.75Å; A60-L424 HydrophobicContact CB-CB 4.39Å; A60-L424 HydrophobicContact CB-CD1 4.07Å
61S83.3Confident84.6Confident5 Ų510.2 Ų10.24%0.0356%0.055CC..Hα-helixtrans-58.5-47.1173.265.20000112.2L57 V58 M59 L63 V65 V432L57-S61 PolarHBondContact O-N 3.16Å; V58-S61 PolarHBondContact O-N 2.88Å; V58-S61 PolarHBondContact O-OG 3.44Å; M59-S61 PolarHBondContact O-N 2.9Å; S61-L63 PolarHBondContact O-N 2.94Å; S61-V65 WeakPolarHBondContact O-CB 3.43Å; S61-V65 WeakPolarHBondContact O-CG2 3.34Å; S61-V65 PolarHBondContact O-N 3.35Å; S61-V432 VanDerWaalsContact CB-CG1 3.47Å
62L82.5Confident83.5Confident11 Ų1114.3 Ų14.36%0.0588%0.083CC..Hα-helixtrans-66.9-38.5-179.8-167.661.6000112.4V58 M59 A60 V65 S66 A113 P114 L436V58-L62 PolarHBondContact O-N 2.81Å; M59-L62 PolarHBondContact O-N 3.42Å; M59-L62 VanDerWaalsContact O-N 3.08Å; A60-L62 PolarHBondContact O-N 3.5Å; L62-V65 PolarHBondContact O-N 3Å; L62-S66 WeakPolarHBondContact O-CB 3.29Å; L62-S66 PolarHBondContact O-N 3.1Å; L62-S66 PolarHBondContact O-OG 3.31Å; L62-S66 VanDerWaalsContact O-OG 3.14Å; L62-A113 HydrophobicContact CD2-CB 4.17Å; L62-P114 WeakPolarHBondContact CD2-O 3.08Å; L62-P114 WeakPolarHBondContact CG-O 3.29Å; L62-L436 HydrophobicContact CD1-CD2 4.38Å
63L84.3Confident82Confident0 Ų016.5 Ų16.50%010%0.098CC..Hα-helixtrans-72.3-41.6-178.9-158.3146.9000111.5M59 A60 S61 V65 S66 H67 L87 F91 P114M59-L63 WeakPolarHBondContact O-CB 3.38Å; M59-L63 PolarHBondContact O-N 3.12Å; A60-L63 PolarHBondContact O-N 3.47Å; S61-L63 PolarHBondContact O-N 2.94Å; L63-V65 VanDerWaalsContact C-N 3.34Å; L63-S66 PolarHBondContact O-OG 3.31Å; L63-S66 VanDerWaalsContact O-OG 3.12Å; L63-H67 WeakPolarHBondContact O-CB 3.4Å; L63-H67 PolarHBondContact O-CD2 3.44Å; L63-H67 VanDerWaalsContact O-CD2 3.24Å; L63-H67 PolarHBondContact O-N 3.04Å; L63-L87 HydrophobicContact CD2-CB 4.45Å; L63-L87 HydrophobicContact CD2-CD1 3.17Å; L63-L87 HydrophobicContact CD2-CG 3.52Å; L63-F91 HydrophobicContact CD1-CD1 4.04Å; L63-F91 HydrophobicContact CD1-CE1 4.12Å; L63-F91 HydrophobicContact CD1-CG 4.28Å; L63-F91 HydrophobicContact CD1-CZ 4.44Å; L63-F91 HydrophobicContact CD2-CD2 4.27Å; L63-F91 HydrophobicContact CD2-CE2 4.03Å; L63-F91 HydrophobicContact CD2-CZ 4.27Å; L63-P114 HydrophobicContact CB-CG 3.77Å; L63-P114 HydrophobicContact CD1-CG 3.87Å; L63-P114 HydrophobicContact CG-CG 3.71Å
64C77.3Confident80.7Confident10 Ų1013.9 Ų13.97%0.0689%0.085CC..Hα-helixtrans-62.6-43.4171.9-67.70000110.8A60 L68A60-C64 WeakPolarHBondContact O-CB 3.27Å; A60-C64 PolarHBondContact O-N 3.19Å; A60-C64 PolarHBondContact O-SG 3.47Å; C64-L68 WeakPolarHBondContact O-CB 3.47Å; C64-L68 WeakPolarHBondContact O-CD1 3.29Å; C64-L68 WeakPolarHBondContact O-CG 3.44Å; C64-L68 PolarHBondContact O-N 3.01Å
65V75.6Confident78.7Confident3 Ų316.6 Ų16.62%0.01810%0.103CC..Hα-helixtrans-61.8-48.9178.1161.20000111.9S61 L62 L63 L68 L69 F223 V432 L436S61-V65 WeakPolarHBondContact O-CB 3.43Å; S61-V65 WeakPolarHBondContact O-CG2 3.34Å; S61-V65 PolarHBondContact O-N 3.35Å; L62-V65 PolarHBondContact O-N 3Å; L63-V65 VanDerWaalsContact C-N 3.34Å; V65-L68 PolarHBondContact O-N 3.17Å; V65-L69 HydrophobicContact CG1-CD1 3.81Å; V65-L69 HydrophobicContact CG1-CG 4.45Å; V65-L69 WeakPolarHBondContact O-CB 3.27Å; V65-L69 VanDerWaalsContact O-CG 3.27Å; V65-L69 WeakPolarHBondContact O-CG 3.37Å; V65-L69 PolarHBondContact O-N 2.92Å; V65-F223 HydrophobicContact CB-CE2 3.93Å; V65-F223 HydrophobicContact CB-CZ 3.95Å; V65-F223 HydrophobicContact CG1-CE2 3.4Å; V65-F223 HydrophobicContact CG1-CZ 3.54Å; V65-F223 HydrophobicContact CG2-CD2 3.8Å; V65-F223 HydrophobicContact CG2-CE1 4.12Å; V65-F223 HydrophobicContact CG2-CE2 3.28Å; V65-F223 HydrophobicContact CG2-CG 4.45Å; V65-F223 HydrophobicContact CG2-CZ 3.49Å; V65-F223 VanDerWaalsContact CG2-CZ 3.49Å; V65-V432 HydrophobicContact CG2-CG1 3.57Å; V65-L436 HydrophobicContact CG2-CD1 4Å
66S77.6Confident76.4Confident1 Ų122.2 Ų22.21%0.00714%0.141CC..Hα-helixtrans-66.6-42.8-177.361.10000112L62 L63 L70L62-S66 WeakPolarHBondContact O-CB 3.29Å; L62-S66 PolarHBondContact O-N 3.1Å; L62-S66 PolarHBondContact O-OG 3.31Å; L62-S66 VanDerWaalsContact O-OG 3.14Å; L63-S66 PolarHBondContact O-OG 3.31Å; L63-S66 VanDerWaalsContact O-OG 3.12Å; S66-L70 VanDerWaalsContact O-CB 3.29Å; S66-L70 WeakPolarHBondContact O-CB 3.49Å; S66-L70 PolarHBondContact O-N 3.36Å
67H79.7Confident74.3Confident3 Ų324.2 Ų24.21%0.01416%0.162CC..Hα-helixtrans-65.8-42.8173.8-82.8-96.2000111.8L63 L70 L71 L87 S90L63-H67 WeakPolarHBondContact O-CB 3.4Å; L63-H67 PolarHBondContact O-CD2 3.44Å; L63-H67 VanDerWaalsContact O-CD2 3.24Å; L63-H67 PolarHBondContact O-N 3.04Å; H67-L70 PolarHBondContact O-N 3.4Å; H67-L71 WeakPolarHBondContact O-CB 3.39Å; H67-L71 WeakPolarHBondContact O-CD1 3.43Å; H67-L71 WeakPolarHBondContact O-CG 3.48Å; H67-L71 PolarHBondContact O-N 3.39Å; H67-L87 HydrophobicContact CB-CD1 4.34Å; H67-S90 PolarHBondContact CE1-OG 3Å; H67-S90 PolarHBondContact NE2-OG 3.42Å
68L73.9Confident72.5Confident15 Ų1526.7 Ų26.78%0.07919%0.192CC..Hα-helixtrans-58.6-50.4175.4-85.3168.5000112.3C64 V65 L70 L71 C72 P295 L298C64-L68 WeakPolarHBondContact O-CB 3.47Å; C64-L68 WeakPolarHBondContact O-CD1 3.29Å; C64-L68 WeakPolarHBondContact O-CG 3.44Å; C64-L68 PolarHBondContact O-N 3.01Å; V65-L68 PolarHBondContact O-N 3.17Å; L68-L70 VanDerWaalsContact C-N 3.33Å; L68-L70 PolarHBondContact O-N 3.39Å; L68-L71 PolarHBondContact O-N 3.38Å; L68-C72 VanDerWaalsContact O-CB 3.3Å; L68-C72 WeakPolarHBondContact O-CB 3.39Å; L68-C72 PolarHBondContact O-N 3.34Å; L68-C72 PolarHBondContact O-SG 3.21Å; L68-P295 HydrophobicContact CD1-CB 4.31Å; L68-P295 HydrophobicContact CD1-CG 4.24Å; L68-P295 HydrophobicContact CD2-CB 3.65Å; L68-P295 HydrophobicContact CD2-CG 4.26Å; L68-L298 HydrophobicContact CD1-CD1 4.29Å; L68-L298 HydrophobicContact CD2-CD1 3.1Å; L68-L298 HydrophobicContact CG-CD1 3.43Å; L68-L298 VanDerWaalsContact CG-CD1 3.43Å
69L73.8Confident71Confident34 Ų3428.8 Ų28.818%0.17820%0.203CC..Hα-helixtrans-65.3-39.2-178.1-71.3174.5000111.5V65 S73 L119 E219 F223V65-L69 HydrophobicContact CG1-CD1 3.81Å; V65-L69 HydrophobicContact CG1-CG 4.45Å; V65-L69 WeakPolarHBondContact O-CB 3.27Å; V65-L69 VanDerWaalsContact O-CG 3.27Å; V65-L69 WeakPolarHBondContact O-CG 3.37Å; V65-L69 PolarHBondContact O-N 2.92Å; L69-S73 PolarHBondContact O-N 2.98Å; L69-L119 HydrophobicContact CB-CD1 4.45Å; L69-L119 HydrophobicContact CB-CD2 3.9Å; L69-L119 HydrophobicContact CD1-CD2 3.76Å; L69-L119 HydrophobicContact CG-CD2 4.5Å; L69-E219 HydrophobicContact CD1-CG 4.3Å; L69-F223 HydrophobicContact CD1-CZ 4.34Å; L69-F223 HydrophobicContact CD2-CZ 4.43Å; L69-F223 HydrophobicContact CG-CZ 4.31Å
70L76.3Confident69.4Low3 Ų332.5 Ų32.52%0.01623%0.228CC..Hα-helixtrans-65.2-48.2173.5-174.972.2000111.2S66 H67 L68 C72 S73 L74 L119 A122 L123 L170 P380S66-L70 VanDerWaalsContact O-CB 3.29Å; S66-L70 WeakPolarHBondContact O-CB 3.49Å; S66-L70 PolarHBondContact O-N 3.36Å; H67-L70 PolarHBondContact O-N 3.4Å; L68-L70 VanDerWaalsContact C-N 3.33Å; L68-L70 PolarHBondContact O-N 3.39Å; L70-C72 PolarHBondContact O-N 3.16Å; L70-S73 WeakPolarHBondContact O-CB 3.19Å; L70-S73 PolarHBondContact O-N 3.13Å; L70-S73 VanDerWaalsContact O-N 3.11Å; L70-S73 PolarHBondContact O-OG 2.96Å; L70-L74 WeakPolarHBondContact O-CG 3.32Å; L70-L74 PolarHBondContact O-N 3.13Å; L70-L119 HydrophobicContact CB-CD1 3.94Å; L70-L119 HydrophobicContact CD1-CD1 4.41Å; L70-A122 HydrophobicContact CD1-CB 4.21Å; L70-L123 HydrophobicContact CD1-CD2 4.44Å; L70-L170 HydrophobicContact CD2-CD2 4.16Å; L70-P380 HydrophobicContact CD2-CB 3.31Å; L70-P380 HydrophobicContact CD2-CG 3.43Å; L70-P380 VanDerWaalsContact CD2-CG 3.43Å
71L72.4Confident68.5Low21 Ų2133.1 Ų33.111%0.1123%0.231CC..Hα-helixtrans-63.6-41.7-179.6-71.5170.4000111.9H67 L68 S73 L74 L79 P83H67-L71 WeakPolarHBondContact O-CB 3.39Å; H67-L71 WeakPolarHBondContact O-CD1 3.43Å; H67-L71 WeakPolarHBondContact O-CG 3.48Å; H67-L71 PolarHBondContact O-N 3.39Å; L68-L71 PolarHBondContact O-N 3.38Å; L71-S73 PolarHBondContact O-N 2.64Å; L71-L74 CarbonylContact O-C 3.34Å; L71-L74 WeakPolarHBondContact O-CA 3.33Å; L71-L74 WeakPolarHBondContact O-CB 3.32Å; L71-L74 PolarHBondContact O-N 2.94Å; L71-L79 HydrophobicContact CD2-CD1 3.37Å; L71-P83 HydrophobicContact CD1-CB 4.23Å
72C67.6Low68.1Low92 Ų9234.1 Ų34.162%0.62224%0.238SC*.Hα-helixtrans-63.7-25.4174.5-72.60000113.1L68 L70 L74L68-C72 VanDerWaalsContact O-CB 3.3Å; L68-C72 WeakPolarHBondContact O-CB 3.39Å; L68-C72 PolarHBondContact O-N 3.34Å; L68-C72 PolarHBondContact O-SG 3.21Å; L70-C72 PolarHBondContact O-N 3.16Å; C72-L74 VanDerWaalsContact C-N 3.28Å
73S64.1Low67.9Low49 Ų4934.6 Ų34.634%0.34324%0.242SC..Hα-helixtrans-78.2-15.817479.10000113L69 L70 L71 L123L69-S73 PolarHBondContact O-N 2.98Å; L70-S73 WeakPolarHBondContact O-CB 3.19Å; L70-S73 PolarHBondContact O-N 3.13Å; L70-S73 VanDerWaalsContact O-N 3.11Å; L70-S73 PolarHBondContact O-OG 2.96Å; L71-S73 PolarHBondContact O-N 2.64Å; S73-L123 VanDerWaalsContact CB-CD2 3.45Å; S73-L123 VanDerWaalsContact OG-CD2 3.23Å; S73-L123 WeakPolarHBondContact OG-CD2 3.47Å
74L65Low67.7Low13 Ų1335 Ų357%0.06825%0.245CC..SBendtrans-93.5128.7174.1-58.8169.8000108L70 L71 C72 W166 L170L70-L74 WeakPolarHBondContact O-CG 3.32Å; L70-L74 PolarHBondContact O-N 3.13Å; L71-L74 CarbonylContact O-C 3.34Å; L71-L74 WeakPolarHBondContact O-CA 3.33Å; L71-L74 WeakPolarHBondContact O-CB 3.32Å; L71-L74 PolarHBondContact O-N 2.94Å; C72-L74 VanDerWaalsContact C-N 3.28Å; L74-W166 HydrophobicContact CD2-CE3 3.84Å; L74-W166 HydrophobicContact CD2-CZ3 4.16Å; L74-L170 HydrophobicContact CD1-CD1 4.29Å; L74-L170 HydrophobicContact CD1-CD2 4.08Å; L74-L170 HydrophobicContact CD1-CG 4.15Å
75S51.8Low68.2Low56 Ų5636.3 Ų36.339%0.39225%0.249SC..  trans-62.1149.8-177.562.40000112G77 W166S75-G77 PolarHBondContact O-N 3.3Å; S75-W166 VanDerWaalsContact OG-CZ2 3.29Å; S75-W166 WeakPolarHBondContact OG-CZ2 3.42Å
76P45.3Very low68.6Low131 Ų13136.4 Ų36.485%0.85125%0.25SS*.SBendtrans-64.894.4179.125.6-33000110.8
77G49.4Very low69.1Low44 Ų4436.4 Ų36.445%0.45425%0.25SC..SBendtrans-148.2130.6171.900000106.1S75 L79S75-G77 PolarHBondContact O-N 3.3Å; G77-L79 PolarHBondContact O-N 3.06Å
78G53.1Low69.6Low68 Ų6836.2 Ų36.270%0.70125%0.249SC*.  trans-52.3104-169.700000111.7S80G78-S80 PolarHBondContact O-N 3.11Å
79L59.1Low70.4Confident44 Ų4435.5 Ų35.523%0.2325%0.245CC..  trans-52.9139164.1-72.4169000107.1L71 G77 Y81 L170L71-L79 HydrophobicContact CD2-CD1 3.37Å; G77-L79 PolarHBondContact O-N 3.06Å; L79-Y81 HydrophobicContact CB-CD2 4.36Å; L79-Y81 HydrophobicContact CD2-CD2 4.28Å; L79-Y81 PolarHBondContact O-N 3.41Å; L79-L170 HydrophobicContact CD2-CD1 3.5Å
80S58.3Low71.3Confident78 Ų7834 Ų3455%0.54524%0.237SC..SBendtrans-66.5-2.1169.751.40000112.7G78 N167G78-S80 PolarHBondContact O-N 3.11Å; S80-N167 PolarHBondContact OG-ND2 3.42Å; S80-N167 PolarHBondContact OG-OD1 3.26Å
81Y68Low72.1Confident14 Ų1433.9 Ų33.96%0.05524%0.237CC..SBendtrans-112.3136.1-171.8-41.9-52.2000109.8L79 L86 N167 L170 W315L79-Y81 HydrophobicContact CB-CD2 4.36Å; L79-Y81 HydrophobicContact CD2-CD2 4.28Å; L79-Y81 PolarHBondContact O-N 3.41Å; Y81-L86 HydrophobicContact CD2-CD1 4.4Å; Y81-L86 HydrophobicContact CG-CD1 4.46Å; Y81-N167 WeakPolarHBondContact CE2-OD1 3.47Å; Y81-L170 HydrophobicContact CD2-CD1 3.81Å; Y81-L170 HydrophobicContact CE2-CB 4.5Å; Y81-L170 HydrophobicContact CE2-CD1 3.75Å; Y81-W315 HydrophobicContact CD1-CB 3.89Å; Y81-W315 AromaticContact CD1-CD1 3.09Å; Y81-W315 HydrophobicContact CD1-CD2 4.46Å; Y81-W315 AromaticContact CD1-CG 3.53Å; Y81-W315 HydrophobicContact CD1-CG 3.53Å; Y81-W315 AromaticContact CD1-NE1 3.73Å; Y81-W315 HydrophobicContact CE1-CB 3.39Å; Y81-W315 AromaticContact CE1-CD1 3.38Å; Y81-W315 AromaticContact CE1-CG 3.58Å; Y81-W315 HydrophobicContact CE1-CG 3.58Å; Y81-W315 HydrophobicContact CG-CG 4.45Å; Y81-W315 PolarHBondContact OH-O 3.24Å; Y81-W315 VanDerWaalsContact OH-O 3.13Å
82S75.2Confident73.2Confident26 Ų2634.2 Ų34.218%0.18224%0.237CC..  trans-74.8129.216872.60000109.3S84 Q85 L86S82-S84 PolarHBondContact O-N 3.07Å; S82-S84 VanDerWaalsContact O-N 3.11Å; S82-S84 PolarHBondContact OG-OG 3.44Å; S82-Q85 PolarHBondContact O-N 2.78Å; S82-Q85 VanDerWaalsContact OG-CB 3.31Å; S82-Q85 WeakPolarHBondContact OG-CB 3.38Å; S82-Q85 WeakPolarHBondContact OG-CG 3.19Å; S82-Q85 PolarHBondContact OG-N 3.09Å; S82-Q85 PolarHBondContact OG-OE1 3.21Å; S82-L86 PolarHBondContact O-N 2.81Å
83P77.6Confident74.5Confident22 Ų2229.9 Ų29.914%0.14321%0.208CC..Hα-helixtrans-53.5-33.6176.8-28.635.5000112.8L71 L86 L87 L298L71-P83 HydrophobicContact CD1-CB 4.23Å; P83-L86 PolarHBondContact O-N 3.46Å; P83-L87 WeakPolarHBondContact O-CB 3.32Å; P83-L87 PolarHBondContact O-N 3.33Å; P83-L298 HydrophobicContact CB-CD2 4.22Å; P83-L298 HydrophobicContact CB-CG 4.17Å
84S81.6Confident76Confident9 Ų927.7 Ų27.76%0.06319%0.192CC..Hα-helixtrans-64.2-36.5176.150.20000114.1S82 A88S82-S84 PolarHBondContact O-N 3.07Å; S82-S84 VanDerWaalsContact O-N 3.11Å; S82-S84 PolarHBondContact OG-OG 3.44Å; S84-A88 VanDerWaalsContact O-CB 3.32Å; S84-A88 WeakPolarHBondContact O-CB 3.3Å; S84-A88 PolarHBondContact O-N 2.82Å
85Q86.8Confident77.5Confident36 Ų3627 Ų2717%0.16819%0.189CC..Hα-helixtrans-75.5-37177.4-75167.2-46.800111.7S82 L87 A88 S89 W308 W315 P418S82-Q85 PolarHBondContact O-N 2.78Å; S82-Q85 VanDerWaalsContact OG-CB 3.31Å; S82-Q85 WeakPolarHBondContact OG-CB 3.38Å; S82-Q85 WeakPolarHBondContact OG-CG 3.19Å; S82-Q85 PolarHBondContact OG-N 3.09Å; S82-Q85 PolarHBondContact OG-OE1 3.21Å; Q85-L87 VanDerWaalsContact C-N 3.31Å; Q85-A88 PolarHBondContact O-N 3.13Å; Q85-S89 PolarHBondContact O-N 3.08Å; Q85-W308 HydrophobicContact CB-CH2 4.4Å; Q85-W308 HydrophobicContact CB-CZ2 4.41Å; Q85-W308 HydrophobicContact CG-CD2 4.36Å; Q85-W315 HydrophobicContact CB-CH2 3.93Å; Q85-W315 HydrophobicContact CB-CZ2 3.59Å; Q85-W315 HydrophobicContact CG-CZ2 4.41Å; Q85-P418 HydrophobicContact CG-CB 4.06Å; Q85-P418 HydrophobicContact CG-CG 3.84Å
86L84.8Confident79.6Confident6 Ų625.9 Ų25.93%0.03118%0.18CC..Hα-helixtrans-62.4-40.7172.1-71.1173.4000111.3Y81 S82 P83 A88 S89 S90Y81-L86 HydrophobicContact CD2-CD1 4.4Å; Y81-L86 HydrophobicContact CG-CD1 4.46Å; S82-L86 PolarHBondContact O-N 2.81Å; P83-L86 PolarHBondContact O-N 3.46Å; L86-A88 VanDerWaalsContact C-N 3.35Å; L86-S89 PolarHBondContact O-N 3.25Å; L86-S89 PolarHBondContact O-OG 3.07Å; L86-S90 PolarHBondContact O-N 3.23Å; L86-S90 VanDerWaalsContact O-N 3.15Å; L86-S90 PolarHBondContact O-OG 3.35Å
87L87.4Confident82Confident0 Ų019.6 Ų19.60%014%0.139CC..Hα-helixtrans-61.3-45.3173.7-157.182.3000111.1L63 H67 P83 Q85 S90 F91 L298 A421 T425L63-L87 HydrophobicContact CD2-CB 4.45Å; L63-L87 HydrophobicContact CD2-CD1 3.17Å; L63-L87 HydrophobicContact CD2-CG 3.52Å; H67-L87 HydrophobicContact CB-CD1 4.34Å; P83-L87 WeakPolarHBondContact O-CB 3.32Å; P83-L87 PolarHBondContact O-N 3.33Å; Q85-L87 VanDerWaalsContact C-N 3.31Å; L87-S90 PolarHBondContact O-N 3.47Å; L87-F91 HydrophobicContact CD2-CE2 3.91Å; L87-F91 HydrophobicContact CG-CD2 4.2Å; L87-F91 HydrophobicContact CG-CE2 3.84Å; L87-F91 VanDerWaalsContact O-CD2 3.22Å; L87-F91 WeakPolarHBondContact O-CD2 3.27Å; L87-F91 PolarHBondContact O-N 2.84Å; L87-L298 HydrophobicContact CD1-CD2 4.31Å; L87-A421 HydrophobicContact CB-CB 4.46Å; L87-A421 HydrophobicContact CD2-CB 4.08Å; L87-A421 VanDerWaalsContact CD2-O 3.3Å; L87-A421 WeakPolarHBondContact CD2-O 3.46Å; L87-T425 HydrophobicContact CD2-CG2 3.47Å; L87-T425 VanDerWaalsContact CD2-CG2 3.47Å
88A90.7Very high84.2Confident0 Ų017.5 Ų17.50%012%0.117CC..Hα-helixtrans-64.5-42.1179.200000112.3S84 Q85 L86 S90 F91 F92 W308 G415 P418 A421S84-A88 VanDerWaalsContact O-CB 3.32Å; S84-A88 WeakPolarHBondContact O-CB 3.3Å; S84-A88 PolarHBondContact O-N 2.82Å; Q85-A88 PolarHBondContact O-N 3.13Å; L86-A88 VanDerWaalsContact C-N 3.35Å; A88-S90 VanDerWaalsContact C-N 3.33Å; A88-S90 PolarHBondContact O-N 3.39Å; A88-F91 PolarHBondContact O-N 3.22Å; A88-F92 PolarHBondContact O-N 3.46Å; A88-W308 HydrophobicContact CB-CE3 4.29Å; A88-W308 HydrophobicContact CB-CZ3 3.96Å; A88-G415 WeakPolarHBondContact CB-O 3.26Å; A88-G415 WeakPolarHBondContact O-CA 3.47Å; A88-P418 HydrophobicContact CB-CB 4.34Å; A88-P418 HydrophobicContact CB-CG 4.08Å; A88-A421 HydrophobicContact CB-CB 4.01Å
89S91.3Very high86.2Confident0 Ų016.4 Ų16.40%010%0.095CC..Hα-helixtrans-63-39.3176.672.20000112Q85 L86 F92 S93Q85-S89 PolarHBondContact O-N 3.08Å; L86-S89 PolarHBondContact O-N 3.25Å; L86-S89 PolarHBondContact O-OG 3.07Å; S89-F92 PolarHBondContact O-N 3.25Å; S89-S93 PolarHBondContact O-N 3.36Å; S89-S93 PolarHBondContact O-OG 3.26Å
90S92.1Very high87.9Confident1 Ų116 Ų161%0.0079%0.093CC..Hα-helixtrans-65.3-40.9172.6-60.50000112.6H67 L86 L87 A88 F92 S93 C94 S379H67-S90 PolarHBondContact CE1-OG 3Å; H67-S90 PolarHBondContact NE2-OG 3.42Å; L86-S90 PolarHBondContact O-N 3.23Å; L86-S90 VanDerWaalsContact O-N 3.15Å; L86-S90 PolarHBondContact O-OG 3.35Å; L87-S90 PolarHBondContact O-N 3.47Å; A88-S90 VanDerWaalsContact C-N 3.33Å; A88-S90 PolarHBondContact O-N 3.39Å; S90-F92 VanDerWaalsContact C-N 3.32Å; S90-F92 PolarHBondContact O-N 2.88Å; S90-S93 PolarHBondContact O-N 3.36Å; S90-S93 PolarHBondContact O-OG 3.22Å; S90-S93 VanDerWaalsContact O-OG 3.05Å; S90-C94 VanDerWaalsContact O-CB 3.28Å; S90-C94 WeakPolarHBondContact O-CB 3.42Å; S90-C94 PolarHBondContact O-N 2.9Å; S90-C94 PolarHBondContact O-SG 2.92Å; S90-S379 PolarHBondContact OG-OG 3.47Å
91F93.5Very high89.6Confident1 Ų112.3 Ų12.30%0.0047%0.067CC..Hα-helixtrans-61.9-41.5174.1-84.5-61.8000111.9A60 L63 L87 A88 C94 G95 C411 L414 A421 L424A60-F91 HydrophobicContact CB-CE1 4.14Å; A60-F91 HydrophobicContact CB-CZ 3.75Å; L63-F91 HydrophobicContact CD1-CD1 4.04Å; L63-F91 HydrophobicContact CD1-CE1 4.12Å; L63-F91 HydrophobicContact CD1-CG 4.28Å; L63-F91 HydrophobicContact CD1-CZ 4.44Å; L63-F91 HydrophobicContact CD2-CD2 4.27Å; L63-F91 HydrophobicContact CD2-CE2 4.03Å; L63-F91 HydrophobicContact CD2-CZ 4.27Å; L87-F91 HydrophobicContact CD2-CE2 3.91Å; L87-F91 HydrophobicContact CG-CD2 4.2Å; L87-F91 HydrophobicContact CG-CE2 3.84Å; L87-F91 VanDerWaalsContact O-CD2 3.22Å; L87-F91 WeakPolarHBondContact O-CD2 3.27Å; L87-F91 PolarHBondContact O-N 2.84Å; A88-F91 PolarHBondContact O-N 3.22Å; F91-C94 PolarHBondContact O-N 2.96Å; F91-G95 PolarHBondContact O-N 2.72Å; F91-C411 CarbonylContact C-O 3.54Å; F91-L414 HydrophobicContact CB-CB 4.45Å; F91-L414 HydrophobicContact CG-CB 4.44Å; F91-A421 HydrophobicContact CD2-CB 4.13Å; F91-A421 HydrophobicContact CE2-CB 4.34Å; F91-L424 HydrophobicContact CE1-CD1 4.28Å; F91-L424 HydrophobicContact CE2-CD1 3.95Å; F91-L424 HydrophobicContact CZ-CD1 3.61Å
92F94.7Very high90.7Very high29 Ų2911.7 Ų11.713%0.1276%0.064CC..Hα-helixtrans-62-50.4178.2-171.4-96.1000111.4A88 S89 S90 C94 G95 V96 P310 L377 M412 L416A88-F92 PolarHBondContact O-N 3.46Å; S89-F92 PolarHBondContact O-N 3.25Å; S90-F92 VanDerWaalsContact C-N 3.32Å; S90-F92 PolarHBondContact O-N 2.88Å; F92-C94 PolarHBondContact O-N 3.2Å; F92-G95 PolarHBondContact O-N 3.42Å; F92-V96 HydrophobicContact CD1-CG2 4.29Å; F92-V96 HydrophobicContact CE1-CG2 3.98Å; F92-V96 HydrophobicContact CZ-CG2 4.3Å; F92-V96 WeakPolarHBondContact O-CG2 3.2Å; F92-V96 PolarHBondContact O-N 3.32Å; F92-P310 HydrophobicContact CB-CG 3.76Å; F92-P310 HydrophobicContact CD1-CG 3.64Å; F92-P310 HydrophobicContact CD2-CG 3.91Å; F92-P310 HydrophobicContact CE1-CG 4.17Å; F92-P310 HydrophobicContact CE2-CG 4.42Å; F92-P310 HydrophobicContact CG-CG 3.48Å; F92-P310 VanDerWaalsContact CG-CG 3.48Å; F92-L377 HydrophobicContact CD1-CD1 3.76Å; F92-L377 HydrophobicContact CE1-CD1 4.41Å; F92-M412 HydrophobicContact CD2-CB 4.43Å; F92-M412 HydrophobicContact CE2-CE 4.11Å; F92-M412 HydrophobicContact CZ-CE 4.26Å; F92-L416 HydrophobicContact CD2-CD2 4.2Å; F92-L416 HydrophobicContact CD2-CG 4.31Å; F92-L416 HydrophobicContact CE2-CD2 3.91Å; F92-L416 HydrophobicContact CE2-CG 4.24Å
93S94.9Very high91.2Very high1 Ų115.9 Ų15.91%0.0078%0.076CC..Hα-helixtrans-64.3-40179.265.10000112.4S89 S90 G95 V96 S97 A374S89-S93 PolarHBondContact O-N 3.36Å; S89-S93 PolarHBondContact O-OG 3.26Å; S90-S93 PolarHBondContact O-N 3.36Å; S90-S93 PolarHBondContact O-OG 3.22Å; S90-S93 VanDerWaalsContact O-OG 3.05Å; S93-G95 VanDerWaalsContact C-N 3.33Å; S93-G95 PolarHBondContact O-N 3.19Å; S93-V96 PolarHBondContact O-N 3.37Å; S93-S97 WeakPolarHBondContact O-CB 3.37Å; S93-S97 PolarHBondContact O-N 3.4Å; S93-A374 WeakPolarHBondContact OG-CB 3.25Å
94C95.1Very high91.7Very high2 Ų217.3 Ų17.31%0.0148%0.082CC..Hα-helixtrans-62.7-38.9173.8-69.50000112.2S90 F91 F92 T98 Q112 P114S90-C94 VanDerWaalsContact O-CB 3.28Å; S90-C94 WeakPolarHBondContact O-CB 3.42Å; S90-C94 PolarHBondContact O-N 2.9Å; S90-C94 PolarHBondContact O-SG 2.92Å; F91-C94 PolarHBondContact O-N 2.96Å; F92-C94 PolarHBondContact O-N 3.2Å; C94-T98 VanDerWaalsContact O-CB 3.29Å; C94-T98 WeakPolarHBondContact O-CB 3.3Å; C94-T98 PolarHBondContact O-N 2.9Å; C94-T98 PolarHBondContact O-OG1 3.34Å; C94-Q112 WeakPolarHBondContact CB-O 3.24Å; C94-P114 VanDerWaalsContact SG-CD 3.59Å
95G96.1Very high92.1Very high0 Ų016.9 Ų16.90%08%0.079CC..Hα-helixtrans-63.1-50.6176.300000112.1F91 F92 S93 S97 T98 I99 G408F91-G95 PolarHBondContact O-N 2.72Å; F92-G95 PolarHBondContact O-N 3.42Å; S93-G95 VanDerWaalsContact C-N 3.33Å; S93-G95 PolarHBondContact O-N 3.19Å; G95-S97 PolarHBondContact O-N 3.02Å; G95-T98 PolarHBondContact O-N 3.42Å; G95-I99 WeakPolarHBondContact O-CG1 3.47Å; G95-I99 PolarHBondContact O-N 3.08Å; G95-I99 VanDerWaalsContact O-N 3.07Å; G95-G408 WeakPolarHBondContact CA-O 3.4Å
96V95.8Very high92.2Very high31 Ų3115.2 Ų15.219%0.1887%0.071CC..Hα-helixtrans-59.9-47.6175.8175.50000110.9F92 S93 T98 I99 L100 L373 M412F92-V96 HydrophobicContact CD1-CG2 4.29Å; F92-V96 HydrophobicContact CE1-CG2 3.98Å; F92-V96 HydrophobicContact CZ-CG2 4.3Å; F92-V96 WeakPolarHBondContact O-CG2 3.2Å; F92-V96 PolarHBondContact O-N 3.32Å; S93-V96 PolarHBondContact O-N 3.37Å; V96-T98 VanDerWaalsContact C-N 3.34Å; V96-T98 PolarHBondContact O-N 2.75Å; V96-I99 PolarHBondContact O-N 3.35Å; V96-L100 HydrophobicContact CG1-CD1 3.96Å; V96-L100 HydrophobicContact CG1-CG 4.41Å; V96-L100 WeakPolarHBondContact O-CG 3.37Å; V96-L100 PolarHBondContact O-N 3.01Å; V96-L373 HydrophobicContact CB-CD2 3.89Å; V96-L373 HydrophobicContact CG1-CD2 3.75Å; V96-L373 HydrophobicContact CG2-CD2 4.14Å; V96-M412 HydrophobicContact CG2-CE 4Å; V96-M412 HydrophobicContact CG2-CG 4.06Å; V96-M412 HydrophobicContact CG2-SD 3.95Å
97S95.8Very high92.4Very high0 Ų016.6 Ų16.60%08%0.076CC..Hα-helixtrans-61.1-40.9178.9-170.10000111.9S93 G95 I99 L100 Q101 Q112 T383S93-S97 WeakPolarHBondContact O-CB 3.37Å; S93-S97 PolarHBondContact O-N 3.4Å; G95-S97 PolarHBondContact O-N 3.02Å; S97-I99 PolarHBondContact O-N 3.3Å; S97-L100 PolarHBondContact O-N 2.95Å; S97-Q101 VanDerWaalsContact O-CB 3.26Å; S97-Q101 WeakPolarHBondContact O-CB 3.38Å; S97-Q101 PolarHBondContact O-N 3.31Å; S97-Q112 WeakPolarHBondContact OG-CG 3.45Å; S97-T383 PolarHBondContact OG-OG1 3.18Å
98T96.6Very high92.6Very high0 Ų016.6 Ų16.60%08%0.076CC..Hα-helixtrans-62.9-43.4176.3-61.40000111.9C94 G95 V96 Q101 T102 Q112 A404 V407C94-T98 VanDerWaalsContact O-CB 3.29Å; C94-T98 WeakPolarHBondContact O-CB 3.3Å; C94-T98 PolarHBondContact O-N 2.9Å; C94-T98 PolarHBondContact O-OG1 3.34Å; G95-T98 PolarHBondContact O-N 3.42Å; V96-T98 VanDerWaalsContact C-N 3.34Å; V96-T98 PolarHBondContact O-N 2.75Å; T98-Q101 PolarHBondContact O-N 3.38Å; T98-T102 HydrophobicContact CG2-CG2 4.47Å; T98-T102 WeakPolarHBondContact O-CB 3.24Å; T98-T102 VanDerWaalsContact O-CG2 3.32Å; T98-T102 WeakPolarHBondContact O-CG2 3.27Å; T98-T102 PolarHBondContact O-N 3.41Å; T98-T102 PolarHBondContact O-OG1 2.9Å; T98-Q112 WeakPolarHBondContact OG1-CB 3.5Å; T98-Q112 PolarHBondContact OG1-N 3.4Å; T98-Q112 PolarHBondContact OG1-O 3.47Å; T98-A404 WeakPolarHBondContact CG2-O 3.22Å; T98-V407 HydrophobicContact CG2-CG1 4.49Å
99I95.6Very high92.6Very high44 Ų4417.2 Ų17.223%0.2268%0.08CC..Hα-helixtrans-64-47.2176.5-65.4172.1000110.2G95 V96 S97 Q101 T102 W103 L409 M412G95-I99 WeakPolarHBondContact O-CG1 3.47Å; G95-I99 PolarHBondContact O-N 3.08Å; G95-I99 VanDerWaalsContact O-N 3.07Å; V96-I99 PolarHBondContact O-N 3.35Å; S97-I99 PolarHBondContact O-N 3.3Å; I99-Q101 VanDerWaalsContact C-N 3.3Å; I99-Q101 PolarHBondContact O-N 3.43Å; I99-T102 PolarHBondContact O-N 3.01Å; I99-T102 PolarHBondContact O-OG1 3.32Å; I99-T102 VanDerWaalsContact O-OG1 3.11Å; I99-W103 WeakPolarHBondContact O-CB 3.31Å; I99-W103 PolarHBondContact O-N 2.94Å; I99-L409 HydrophobicContact CD1-CD2 3.95Å; I99-L409 HydrophobicContact CD1-CG 4.28Å; I99-M412 HydrophobicContact CD1-SD 3.47Å; I99-M412 WeakPolarHBondContact CD1-SD 3.5Å
100L93.8Very high92.7Very high37 Ų3717.2 Ų17.219%0.1948%0.08CC..Hα-helixtrans-58.2-45.8177.6-72.1172000111V96 S97 T102 M104 G105 L366 L369V96-L100 HydrophobicContact CG1-CD1 3.96Å; V96-L100 HydrophobicContact CG1-CG 4.41Å; V96-L100 WeakPolarHBondContact O-CG 3.37Å; V96-L100 PolarHBondContact O-N 3.01Å; S97-L100 PolarHBondContact O-N 2.95Å; L100-T102 VanDerWaalsContact C-N 3.34Å; L100-T102 PolarHBondContact O-N 3.41Å; L100-M104 CarbonylContact O-C 3.38Å; L100-M104 PolarHBondContact O-N 3.28Å; L100-G105 PolarHBondContact O-N 3.13Å; L100-L366 HydrophobicContact CB-CB 4.28Å; L100-L366 HydrophobicContact CB-CD1 4.23Å; L100-L366 WeakPolarHBondContact O-CD1 3.43Å; L100-L369 HydrophobicContact CD1-CD2 4.09Å
101Q94.1Very high92.8Very high0 Ų017.3 Ų17.30%08%0.081CC..Hα-helixtrans-62.2-40.8-177.9-17867.4-14.400113.4S97 T98 I99 G105 S106 R107 L110 Q112 Y343 G363S97-Q101 VanDerWaalsContact O-CB 3.26Å; S97-Q101 WeakPolarHBondContact O-CB 3.38Å; S97-Q101 PolarHBondContact O-N 3.31Å; T98-Q101 PolarHBondContact O-N 3.38Å; I99-Q101 VanDerWaalsContact C-N 3.3Å; I99-Q101 PolarHBondContact O-N 3.43Å; Q101-G105 CarbonylContact O-C 3.45Å; Q101-G105 WeakPolarHBondContact O-CA 3.46Å; Q101-G105 PolarHBondContact O-N 3.02Å; Q101-G105 VanDerWaalsContact O-N 3.08Å; Q101-S106 PolarHBondContact NE2-OG 3.45Å; Q101-S106 PolarHBondContact O-N 3.23Å; Q101-R107 PolarHBondContact O-N 3.45Å; Q101-L110 HydrophobicContact CG-CB 4.28Å; Q101-Q112 HydrophobicContact CB-CG 3.99Å; Q101-Q112 HydrophobicContact CG-CG 4.37Å; Q101-Y343 VanDerWaalsContact NE2-CE1 3.34Å; Q101-Y343 VanDerWaalsContact NE2-CZ 3.3Å; Q101-Y343 PolarHBondContact NE2-OH 2.98Å; Q101-G363 VanDerWaalsContact OE1-CA 3.23Å; Q101-G363 PolarHBondContact OE1-O 3.41Å; Q101-G363 VanDerWaalsContact OE1-O 3.04Å
102T90.8Very high92.9Very high0 Ų017.2 Ų17.20%08%0.08CC..Hα-helixtrans-84.6-33.9-176.2490000112T98 I99 L100 R107 A404 H405T98-T102 HydrophobicContact CG2-CG2 4.47Å; T98-T102 WeakPolarHBondContact O-CB 3.24Å; T98-T102 VanDerWaalsContact O-CG2 3.32Å; T98-T102 WeakPolarHBondContact O-CG2 3.27Å; T98-T102 PolarHBondContact O-N 3.41Å; T98-T102 PolarHBondContact O-OG1 2.9Å; I99-T102 PolarHBondContact O-N 3.01Å; I99-T102 PolarHBondContact O-OG1 3.32Å; I99-T102 VanDerWaalsContact O-OG1 3.11Å; L100-T102 VanDerWaalsContact C-N 3.34Å; L100-T102 PolarHBondContact O-N 3.41Å; T102-R107 WeakPolarHBondContact O-CD 3.29Å; T102-A404 HydrophobicContact CG2-CB 3.5Å; T102-H405 PolarHBondContact OG1-CD2 2.82Å; T102-H405 PolarHBondContact OG1-NE2 3.2Å
103W87.1Confident92.7Very high114 Ų11415.9 Ų15.943%0.4327%0.074SC..Hα-helixtrans-79-50.2179.5-17558.3000112.5I99 R107 I561I99-W103 WeakPolarHBondContact O-CB 3.31Å; I99-W103 PolarHBondContact O-N 2.94Å; W103-R107 WeakPolarHBondContact O-CD 3.26Å; W103-R107 PolarHBondContact O-NH1 3.42Å; W103-I561 HydrophobicContact CH2-CD1 3.92Å; W103-I561 HydrophobicContact CZ2-CD1 4Å; W103-I561 HydrophobicContact CZ3-CD1 4.48Å
104M87.9Confident92.2Very high53 Ų5315.9 Ų15.926%0.2618%0.075SC..THydrogen-bonded Turntrans-121.6-18.6-175.6-81.4-17971.500114L100 R362 L366 L557 I561L100-M104 CarbonylContact O-C 3.38Å; L100-M104 PolarHBondContact O-N 3.28Å; M104-R362 WeakPolarHBondContact O-CD 3.28Å; M104-R362 WeakPolarHBondContact O-CG 3.42Å; M104-R362 PolarHBondContact O-NE 3.04Å; M104-L366 VanDerWaalsContact C-CD1 3.42Å; M104-L366 HydrophobicContact CB-CD1 3.49Å; M104-L366 VanDerWaalsContact CB-CD1 3.49Å; M104-L557 HydrophobicContact CG-CD2 4.49Å; M104-I561 HydrophobicContact CE-CD1 4.06Å; M104-I561 HydrophobicContact CE-CG2 4.47Å; M104-I561 HydrophobicContact CG-CD1 3.72Å; M104-I561 HydrophobicContact SD-CD1 3.69Å
105G90.1Very high91.6Very high0 Ų016.1 Ų16.10%08%0.076CC..SBendtrans-77.5-125.9-172.500000112.8L100 Q101 R107 R362L100-G105 PolarHBondContact O-N 3.13Å; Q101-G105 CarbonylContact O-C 3.45Å; Q101-G105 WeakPolarHBondContact O-CA 3.46Å; Q101-G105 PolarHBondContact O-N 3.02Å; Q101-G105 VanDerWaalsContact O-N 3.08Å; G105-R107 PolarHBondContact O-N 3.08Å; G105-R362 PolarHBondContact O-NE 2.94Å; G105-R362 PolarHBondContact O-NH2 3.42Å
106S89.3Confident91Very high1 Ų117.9 Ų17.91%0.0079%0.085CC..SBendtrans-66.1-16.917659.60000113.7Q101 L108 Y555Q101-S106 PolarHBondContact NE2-OG 3.45Å; Q101-S106 PolarHBondContact O-N 3.23Å; S106-L108 PolarHBondContact O-N 2.97Å; S106-L108 VanDerWaalsContact O-N 3.09Å; S106-Y555 WeakPolarHBondContact O-CD1 3.37Å
107R88.9Confident90.7Very high34 Ų3416.8 Ų16.813%0.1288%0.078CC..  trans65.5-2.2-174-54.4-82.9-95.6167.70.8114.2Q101 T102 W103 G105 Q401 V554 R556Q101-R107 PolarHBondContact O-N 3.45Å; T102-R107 WeakPolarHBondContact O-CD 3.29Å; W103-R107 WeakPolarHBondContact O-CD 3.26Å; W103-R107 PolarHBondContact O-NH1 3.42Å; G105-R107 PolarHBondContact O-N 3.08Å; R107-Q401 PolarHBondContact O-NE2 2.65Å; R107-V554 VanDerWaalsContact CB-O 3.31Å; R107-V554 WeakPolarHBondContact CB-O 3.1Å; R107-R556 PolarHBondContact NE-O 3.14Å; R107-R556 PolarHBondContact NH2-O 3.21Å
108L89.9Confident90.5Very high0 Ų016.8 Ų16.80%08%0.078CC..SBendtrans-69.4151.6168.7-68.8171.7000109.4S106 L110 C346 L352 Y555S106-L108 PolarHBondContact O-N 2.97Å; S106-L108 VanDerWaalsContact O-N 3.09Å; L108-L110 HydrophobicContact CB-CD1 3.72Å; L108-L110 HydrophobicContact CB-CG 3.68Å; L108-L110 HydrophobicContact CD1-CD1 4.04Å; L108-L110 PolarHBondContact O-N 3.15Å; L108-C346 HydrophobicContact CD1-CB 4.48Å; L108-L352 HydrophobicContact CD2-CD1 3.63Å; L108-Y555 HydrophobicContact CD1-CE1 4.21Å; L108-Y555 HydrophobicContact CD2-CE1 3.8Å; L108-Y555 HydrophobicContact CG-CE1 3.82Å
109P91.2Very high90.1Very high14 Ų1417.1 Ų17.19%0.0918%0.08CC..  trans-73.558.2174.933.2-36.3000110.9L350 A404P109-L350 HydrophobicContact CG-CD1 3.49Å; P109-L350 VanDerWaalsContact CG-CD1 3.49Å; P109-A404 HydrophobicContact CB-CB 4.05Å
110L93.2Very high89.8Confident0 Ų016.2 Ų16.20%08%0.075CC..PPolyproline II helixtrans-95.4123.5-177.5-71.1170.5000110.1Q101 L108 C342 Y343 C346 V390Q101-L110 HydrophobicContact CG-CB 4.28Å; L108-L110 HydrophobicContact CB-CD1 3.72Å; L108-L110 HydrophobicContact CB-CG 3.68Å; L108-L110 HydrophobicContact CD1-CD1 4.04Å; L108-L110 PolarHBondContact O-N 3.15Å; L110-C342 HydrophobicContact CD2-CB 4.46Å; L110-Y343 HydrophobicContact CD1-CD1 3.14Å; L110-Y343 HydrophobicContact CD1-CE1 3.42Å; L110-Y343 VanDerWaalsContact CD1-CE1 3.42Å; L110-Y343 HydrophobicContact CD1-CG 4.16Å; L110-C346 HydrophobicContact CD2-CB 3.61Å; L110-C346 HydrophobicContact CG-CB 4.42Å; L110-V390 HydrophobicContact CD2-CG2 3.59Å
111V94.3Very high89.7Confident2 Ų214.4 Ų14.41%0.0127%0.066CC..PPolyproline II helixtrans-89.1124177.4173.60000108.9H55 M59 S386 N389 V407H55-V111 HydrophobicContact CB-CG2 4.26Å; M59-V111 HydrophobicContact CE-CG1 3.33Å; M59-V111 HydrophobicContact CG-CG1 3.47Å; M59-V111 VanDerWaalsContact CG-CG1 3.47Å; M59-V111 HydrophobicContact SD-CG1 3.1Å; M59-V111 WeakPolarHBondContact SD-CG1 3.44Å; V111-S386 WeakPolarHBondContact O-CB 3.5Å; V111-S386 PolarHBondContact O-N 3.04Å; V111-N389 HydrophobicContact CB-CB 4.06Å; V111-V407 HydrophobicContact CG1-CG1 3.93Å; V111-V407 HydrophobicContact CG2-CB 4.47Å; V111-V407 HydrophobicContact CG2-CG1 4.02Å; V111-V407 HydrophobicContact CG2-CG2 4.45Å
112Q94.9Very high89.5Confident0 Ų014.4 Ų14.40%07%0.066CC..EExtended strand (participates in β ladder)trans-87.1125.1179.1-61.4-59.3-48.600109.7C94 S97 T98 Q101 E367 A384 S385C94-Q112 WeakPolarHBondContact CB-O 3.24Å; S97-Q112 WeakPolarHBondContact OG-CG 3.45Å; T98-Q112 WeakPolarHBondContact OG1-CB 3.5Å; T98-Q112 PolarHBondContact OG1-N 3.4Å; T98-Q112 PolarHBondContact OG1-O 3.47Å; Q101-Q112 HydrophobicContact CB-CG 3.99Å; Q101-Q112 HydrophobicContact CG-CG 4.37Å; Q112-E367 PolarHBondContact OE1-OE2 3.07Å; Q112-A384 CarbonylContact C-O 3.5Å; Q112-A384 WeakPolarHBondContact CA-O 3.36Å; Q112-A384 PolarHBondContact OE1-O 3.36Å; Q112-S385 PolarHBondContact NE2-OG 3.03Å
113A91.1Very high89.3Confident0 Ų017 Ų170%08%0.08CC..EExtended strand (participates in β ladder)trans-137.5162.8-176.800000110M59 L62 A384M59-A113 HydrophobicContact CG-CB 3.9Å; M59-A113 HydrophobicContact SD-CB 3.73Å; L62-A113 HydrophobicContact CD2-CB 4.17Å; A113-A384 PolarHBondContact N-O 3.14Å; A113-A384 PolarHBondContact O-N 2.9Å
114P83.8Confident89.2Confident2 Ų212 Ų121%0.0136%0.061CC..  trans-61.7143.4164.930.8-38000109.3L62 L63 C94 M381 G382L62-P114 WeakPolarHBondContact CD2-O 3.08Å; L62-P114 WeakPolarHBondContact CG-O 3.29Å; L63-P114 HydrophobicContact CB-CG 3.77Å; L63-P114 HydrophobicContact CD1-CG 3.87Å; L63-P114 HydrophobicContact CG-CG 3.71Å; C94-P114 VanDerWaalsContact SG-CD 3.59Å; P114-M381 HydrophobicContact CB-CB 3.61Å; P114-M381 HydrophobicContact CB-CG 4.06Å; P114-G382 WeakPolarHBondContact CA-O 3.49Å
115S84.4Confident89.2Confident7 Ų79.6 Ų9.65%0.0495%0.049CC..  trans-121.6154.1-173.486.10000110.9E117 F118 L119S115-E117 WeakPolarHBondContact CB-OE2 3.16Å; S115-E117 PolarHBondContact O-N 3.49Å; S115-E117 PolarHBondContact OG-OE2 3.48Å; S115-F118 PolarHBondContact O-N 3.49Å; S115-F118 WeakPolarHBondContact OG-CD2 3.32Å; S115-L119 PolarHBondContact O-N 3.4Å
116L82.6Confident88.7Confident36 Ų3610.2 Ų10.219%0.1885%0.054CC..Hα-helixtrans-64.6-22.2-177.7-69.9174.4000111.7L119 I120L116-L119 HydrophobicContact CD2-CD2 4.02Å; L116-L119 WeakPolarHBondContact O-CB 3.34Å; L116-L119 PolarHBondContact O-N 2.94Å; L116-L119 VanDerWaalsContact O-N 3.16Å; L116-I120 WeakPolarHBondContact O-CG1 3.31Å; L116-I120 PolarHBondContact O-N 2.98Å
117E89.4Confident87.8Confident8 Ų813.2 Ų13.24%0.0377%0.074CC..Hα-helixtrans-62.9-41.3176.5-58.981.6174.400111.3S115 L119 A334 A335 S338 Q503 I505S115-E117 WeakPolarHBondContact CB-OE2 3.16Å; S115-E117 PolarHBondContact O-N 3.49Å; S115-E117 PolarHBondContact OG-OE2 3.48Å; E117-L119 VanDerWaalsContact C-N 3.35Å; E117-A334 HydrophobicContact CB-CB 3.92Å; E117-A334 HydrophobicContact CG-CB 4.1Å; E117-A335 HydrophobicContact CB-CB 4.5Å; E117-S338 WeakPolarHBondContact OE1-CB 3.28Å; E117-S338 PolarHBondContact OE1-OG 3.04Å; E117-Q503 VanDerWaalsContact CA-OE1 3.28Å; E117-Q503 PolarHBondContact O-NE2 2.94Å; E117-I505 VanDerWaalsContact OE1-CD1 3.29Å; E117-I505 WeakPolarHBondContact OE1-CD1 3.36Å
118F91.8Very high86.3Confident0 Ų014.5 Ų14.50%08%0.082CC..Hα-helixtrans-66.7-39.3172.4-68.6-81.3000111.5S115 A122 V177 S180 M331 A335 M381 A384S115-F118 PolarHBondContact O-N 3.49Å; S115-F118 WeakPolarHBondContact OG-CD2 3.32Å; F118-A122 VanDerWaalsContact O-CB 3.25Å; F118-A122 WeakPolarHBondContact O-CB 3.05Å; F118-A122 PolarHBondContact O-N 2.87Å; F118-V177 HydrophobicContact CD1-CG2 4.36Å; F118-S180 WeakPolarHBondContact CE1-OG 3.42Å; F118-M331 HydrophobicContact CD1-CB 3.8Å; F118-M331 HydrophobicContact CD1-CG 3.93Å; F118-M331 HydrophobicContact CD1-SD 3.79Å; F118-M331 HydrophobicContact CE1-CB 3.94Å; F118-A335 HydrophobicContact CE2-CB 3.74Å; F118-A335 HydrophobicContact CZ-CB 3.85Å; F118-M381 HydrophobicContact CB-CE 4.17Å; F118-M381 HydrophobicContact CB-SD 4.17Å; F118-A384 HydrophobicContact CE2-CB 3.95Å
119L88.9Confident84.3Confident7 Ų717.2 Ų17.24%0.0379%0.094CC..Hα-helixtrans-63.2-46.7-179.3-177.764.8000112.5L69 L70 S115 L116 E117 S121 A122 L123 M381L69-L119 HydrophobicContact CB-CD1 4.45Å; L69-L119 HydrophobicContact CB-CD2 3.9Å; L69-L119 HydrophobicContact CD1-CD2 3.76Å; L69-L119 HydrophobicContact CG-CD2 4.5Å; L70-L119 HydrophobicContact CB-CD1 3.94Å; L70-L119 HydrophobicContact CD1-CD1 4.41Å; S115-L119 PolarHBondContact O-N 3.4Å; L116-L119 HydrophobicContact CD2-CD2 4.02Å; L116-L119 WeakPolarHBondContact O-CB 3.34Å; L116-L119 PolarHBondContact O-N 2.94Å; L116-L119 VanDerWaalsContact O-N 3.16Å; E117-L119 VanDerWaalsContact C-N 3.35Å; L119-S121 PolarHBondContact O-N 3.35Å; L119-A122 PolarHBondContact O-N 3.43Å; L119-L123 HydrophobicContact CD1-CD1 4.17Å; L119-L123 HydrophobicContact CD1-CG 4.11Å; L119-L123 HydrophobicContact CG-CD1 3.96Å; L119-L123 HydrophobicContact CG-CG 4.31Å; L119-L123 WeakPolarHBondContact O-CB 3.46Å; L119-L123 VanDerWaalsContact O-CG 3.28Å; L119-L123 WeakPolarHBondContact O-CG 3.46Å; L119-L123 PolarHBondContact O-N 3.23Å; L119-M381 HydrophobicContact CB-CE 4.34Å; L119-M381 HydrophobicContact CB-SD 3.91Å; L119-M381 HydrophobicContact CD1-CE 4.29Å; L119-M381 HydrophobicContact CD1-SD 4.25Å
120I88.9Confident81.7Confident25 Ų2521.3 Ų21.313%0.12811%0.114CC..Hα-helixtrans-58.2-50.8-178.4-70.2163.4000110.6L116 A122 L123 V124 T502 Q503L116-I120 WeakPolarHBondContact O-CG1 3.31Å; L116-I120 PolarHBondContact O-N 2.98Å; I120-A122 VanDerWaalsContact C-N 3.34Å; I120-A122 PolarHBondContact O-N 3.11Å; I120-L123 PolarHBondContact O-N 3.32Å; I120-V124 WeakPolarHBondContact O-CG2 3.32Å; I120-V124 PolarHBondContact O-N 3.44Å; I120-T502 HydrophobicContact CG2-CG2 3.68Å; I120-Q503 HydrophobicContact CG2-CG 4.49Å
121S91.3Very high78.6Confident0 Ų026.4 Ų26.40%015%0.147CC..Hα-helixtrans-68.9-33.3-179.6-56.40000112.3L119 V124 L125 S330 Q503L119-S121 PolarHBondContact O-N 3.35Å; S121-V124 PolarHBondContact O-N 3.27Å; S121-L125 WeakPolarHBondContact O-CB 3.49Å; S121-L125 PolarHBondContact O-N 3.39Å; S121-S330 PolarHBondContact OG-OG 3.22Å; S121-Q503 PolarHBondContact OG-NE2 3.29Å
122A89.7Confident75.6Confident0 Ų033.8 Ų33.80%019%0.186CC..Hα-helixtrans-63.3-43.7173.300000111.5L70 F118 L119 I120 L125 T126 V173 M331 M381L70-A122 HydrophobicContact CD1-CB 4.21Å; F118-A122 VanDerWaalsContact O-CB 3.25Å; F118-A122 WeakPolarHBondContact O-CB 3.05Å; F118-A122 PolarHBondContact O-N 2.87Å; L119-A122 PolarHBondContact O-N 3.43Å; I120-A122 VanDerWaalsContact C-N 3.34Å; I120-A122 PolarHBondContact O-N 3.11Å; A122-L125 PolarHBondContact O-N 3.06Å; A122-T126 WeakPolarHBondContact O-CG2 2.95Å; A122-T126 PolarHBondContact O-N 3.04Å; A122-T126 PolarHBondContact O-OG1 3.39Å; A122-V173 HydrophobicContact CB-CG1 3.75Å; A122-V173 HydrophobicContact CB-CG2 4.2Å; A122-M331 HydrophobicContact CB-CE 3.94Å; A122-M381 HydrophobicContact CB-CE 3.92Å
123L86.1Confident72.3Confident55 Ų5537.9 Ų37.929%0.28822%0.22SC..Hα-helixtrans-65.3-37.4176.7-69.4173.7000112.3L70 S73 L119 I120 T126 S127L70-L123 HydrophobicContact CD1-CD2 4.44Å; S73-L123 VanDerWaalsContact CB-CD2 3.45Å; S73-L123 VanDerWaalsContact OG-CD2 3.23Å; S73-L123 WeakPolarHBondContact OG-CD2 3.47Å; L119-L123 HydrophobicContact CD1-CD1 4.17Å; L119-L123 HydrophobicContact CD1-CG 4.11Å; L119-L123 HydrophobicContact CG-CD1 3.96Å; L119-L123 HydrophobicContact CG-CG 4.31Å; L119-L123 WeakPolarHBondContact O-CB 3.46Å; L119-L123 VanDerWaalsContact O-CG 3.28Å; L119-L123 WeakPolarHBondContact O-CG 3.46Å; L119-L123 PolarHBondContact O-N 3.23Å; I120-L123 PolarHBondContact O-N 3.32Å; L123-T126 WeakPolarHBondContact CA-OG1 3.5Å; L123-T126 PolarHBondContact O-N 3.48Å; L123-T126 PolarHBondContact O-OG1 3.32Å; L123-S127 WeakPolarHBondContact O-CB 3.47Å; L123-S127 PolarHBondContact O-N 3.46Å; L123-S127 PolarHBondContact O-OG 2.94Å
124V86.6Confident69.4Low8 Ų844.5 Ų44.55%0.04825%0.254CS..Hα-helixtrans-63.8-43.5173.81710000110.8I120 S121 T126 S127 Q128 H498 S499I120-V124 WeakPolarHBondContact O-CG2 3.32Å; I120-V124 PolarHBondContact O-N 3.44Å; S121-V124 PolarHBondContact O-N 3.27Å; V124-T126 PolarHBondContact O-N 3.27Å; V124-S127 PolarHBondContact O-OG 3.37Å; V124-Q128 PolarHBondContact O-N 3.03Å; V124-H498 HydrophobicContact CG1-CB 4.12Å; V124-H498 WeakPolarHBondContact CG1-ND1 3.19Å; V124-S499 WeakPolarHBondContact CG1-OG 3.48Å
125L86.1Confident66.8Low2 Ų252 Ų521%0.0129%0.289CS..Hα-helixtrans-63.7-39.7178.5-178.262000112.5S121 A122 E172 V173 A176 R323 A327 V495S121-L125 WeakPolarHBondContact O-CB 3.49Å; S121-L125 PolarHBondContact O-N 3.39Å; A122-L125 PolarHBondContact O-N 3.06Å; L125-E172 HydrophobicContact CD2-CB 4.36Å; L125-V173 HydrophobicContact CD2-CG2 4.06Å; L125-A176 HydrophobicContact CD2-CB 4.26Å; L125-R323 HydrophobicContact CD1-CB 3.64Å; L125-A327 HydrophobicContact CB-CB 4.18Å; L125-A327 HydrophobicContact CD1-CB 4.37Å; L125-A327 HydrophobicContact CD2-CB 3.95Å; L125-A327 HydrophobicContact CG-CB 4.41Å; L125-V495 HydrophobicContact CD1-CG1 4.41Å
126T80.1Confident64Low14 Ų1457.1 Ų57.19%0.08632%0.319CS..Hα-helixtrans-81.1-37.3-179.257.10000113.1A122 L123 V124 Q128 K129 V173A122-T126 WeakPolarHBondContact O-CG2 2.95Å; A122-T126 PolarHBondContact O-N 3.04Å; A122-T126 PolarHBondContact O-OG1 3.39Å; L123-T126 WeakPolarHBondContact CA-OG1 3.5Å; L123-T126 PolarHBondContact O-N 3.48Å; L123-T126 PolarHBondContact O-OG1 3.32Å; V124-T126 PolarHBondContact O-N 3.27Å; T126-Q128 PolarHBondContact O-N 3.14Å; T126-K129 WeakPolarHBondContact O-CB 3.31Å; T126-K129 PolarHBondContact O-N 3.01Å; T126-K129 VanDerWaalsContact O-N 3.14Å; T126-V173 HydrophobicContact CG2-CG2 3.81Å
127S71.1Confident61.6Low64 Ų6462 Ų6245%0.44835%0.353SS..Hα-helixtrans-66.1-33.6-178.157.20000113.6L123 V124 K129 L130L123-S127 WeakPolarHBondContact O-CB 3.47Å; L123-S127 PolarHBondContact O-N 3.46Å; L123-S127 PolarHBondContact O-OG 2.94Å; V124-S127 PolarHBondContact O-OG 3.37Å; S127-K129 PolarHBondContact O-N 3.1Å; S127-L130 WeakPolarHBondContact O-CB 3.42Å; S127-L130 PolarHBondContact O-N 3.42Å; S127-L130 VanDerWaalsContact O-N 3.09Å
128Q57.2Low58.6Low61 Ų6164.9 Ų64.929%0.28539%0.385SS..THydrogen-bonded Turntrans-68.9-11.2175-73.7-167.9-11.400114.2V124 T126 L485V124-Q128 PolarHBondContact O-N 3.03Å; T126-Q128 PolarHBondContact O-N 3.14Å; Q128-L485 HydrophobicContact CG-CD2 4.08Å
129K47.7Very low55.4Low56 Ų5673 Ų7324%0.24343%0.428CS..THydrogen-bonded Turntrans-89.7-11.9172.1-73.9179.3165.7-177.80113.2T126 S127 S169 E172 R323T126-K129 WeakPolarHBondContact O-CB 3.31Å; T126-K129 PolarHBondContact O-N 3.01Å; T126-K129 VanDerWaalsContact O-N 3.14Å; S127-K129 PolarHBondContact O-N 3.1Å; K129-S169 WeakPolarHBondContact CD-OG 3.04Å; K129-S169 PolarHBondContact NZ-OG 3.38Å; K129-E172 WeakPolarHBondContact CE-OE2 3.28Å; K129-E172 IonicContact NZ-OE1 3.08Å; K129-E172 PolarHBondContact NZ-OE1 2.92Å; K129-E172 IonicContact NZ-OE2 3.3Å; K129-E172 PolarHBondContact NZ-OE2 3.27Å; K129-R323 VanDerWaalsContact CE-NH2 3.29Å
130L37.4Very low52.8Low101 Ų10178 Ų7853%0.52946%0.463SS..SBendtrans-71.7123.7177-150.372.6000107.6S127 L132 W166S127-L130 WeakPolarHBondContact O-CB 3.42Å; S127-L130 PolarHBondContact O-N 3.42Å; S127-L130 VanDerWaalsContact O-N 3.09Å; L130-L132 PolarHBondContact O-N 2.93Å; L130-W166 HydrophobicContact CD1-CH2 3.87Å
131P28Very low49.9Very low107 Ų10785.6 Ų85.670%0.69550%0.498SS*.  trans-58.4122176.622.5-29.7000107.9A133P131-A133 PolarHBondContact O-N 3.34Å
132L31.5Very low46.9Very low157 Ų15793.2 Ų93.282%0.82253%0.533SS*.  trans-55.581.5160.2-92141.4000107.8L130 I134L130-L132 PolarHBondContact O-N 2.93Å; L132-I134 PolarHBondContact O-N 3.19Å; L132-I134 VanDerWaalsContact O-N 3.12Å
133A25.7Very low44.2Very low85 Ų85103 Ų10370%0.70257%0.57SS**  trans-78.299.5172.800000107.8P131P131-A133 PolarHBondContact O-N 3.34Å
134I30Very low41.6Very low140 Ų140107.2 Ų107.272%0.71860%0.599SS**  trans82.686.8156-47.1167.6000115L132 T136L132-I134 PolarHBondContact O-N 3.19Å; L132-I134 VanDerWaalsContact O-N 3.12Å; I134-T136 HydrophobicContact CG2-CG2 4.22Å
135Q28.5Very low38.7Very low160 Ų160116.5 Ų116.575%0.74863%0.633SS**  trans-76.1115.9139.6-78.3-179.5-200108.4
136T24.8Very low35.9Very low113 Ų113118.8 Ų118.869%0.69365%0.652SS**  trans-129.9136.8144.948.20000108I134 G138I134-T136 HydrophobicContact CG2-CG2 4.22Å; T136-G138 PolarHBondContact O-N 2.72Å
137P33.6Very low33.6Very low139 Ų139128.9 Ų128.990%0.90369%0.689SS**  trans-80113.6177.931-28.4000108.7
138G25.8Very low31.5Very low69 Ų69130.5 Ų130.571%0.71171%0.706SS**  trans-175.7110.1175.900000113.7T136T136-G138 PolarHBondContact O-N 2.72Å
139N25.1Very low30Very low169 Ų169131.3 Ų131.390%0.90472%0.718SS**  trans52.1105.8163.3-77.811.8000120.7
140C33.1Very low29.1Very low112 Ų112136.3 Ų136.376%0.75775%0.746SS**  trans-66.4118.5152.6-72.40000110.4
141E29.2Very low28.9Very low186 Ų186139.3 Ų139.387%0.86976%0.76SS**  trans-170.1-6.1144-111.2176.6167.600115.7
142H26.9Very low29Very low159 Ų159141.7 Ų141.774%0.73676%0.764SS**  trans-112.239.2-177.5-96.6-62.8000115.7
143R33.8Very low28.7Very low205 Ų205143.7 Ų143.777%0.77477%0.768SS**THydrogen-bonded Turntrans-90.8-0.1-167.5-167.1166.8-88.2179.5-4.2117.3
144T30.9Very low29Very low145 Ų145146.7 Ų146.789%0.8977%0.772SS**THydrogen-bonded Turntrans-103-5-177.834.10000116.1
145R26.6Very low29.3Very low202 Ų202145.5 Ų145.576%0.76278%0.775SS**SBendtrans-111.5-13-179.6-135.9175-74.1133.4-4.2115.1
146A28Very low29.3Very low51 Ų51150 Ų15042%0.42179%0.785SS.*THydrogen-bonded Turntrans-89.1-5.9-174.700000115.7A148 S149A146-A148 VanDerWaalsContact C-N 3.34Å; A146-S149 WeakPolarHBondContact CA-OG 3.2Å; A146-S149 PolarHBondContact O-OG 2.85Å
147R30.4Very low29.6Very low226 Ų226146.4 Ų146.485%0.85377%0.77SS**THydrogen-bonded Turntrans-76.2-20.8174.5-85.3-176.9175.8142.2-2.4113.3
148A27.4Very low29.3Very low97 Ų97146.6 Ų146.680%0.80277%0.772SS**SBendtrans-88.3-12.5175.700000113.3A146A146-A148 VanDerWaalsContact C-N 3.34Å
149S24.8Very low29.6Very low78 Ų78148.7 Ų148.755%0.54578%0.775SS.*SBendtrans-106.112.5-176.960.30000113.9A146 M151A146-S149 WeakPolarHBondContact CA-OG 3.2Å; A146-S149 PolarHBondContact O-OG 2.85Å; S149-M151 VanDerWaalsContact C-N 3.27Å; S149-M151 PolarHBondContact O-N 3.07Å
150L30.6Very low30.4Very low161 Ų161144.3 Ų144.384%0.84376%0.757SS**  trans-93.725176-132.6116.6000112.7
151M33Very low30.3Very low164 Ų164147 Ų14781%0.80876%0.758SS**SBendtrans-96.9128.8150.6-91.9-174.873.400107.5S149S149-M151 VanDerWaalsContact C-N 3.27Å; S149-M151 PolarHBondContact O-N 3.07Å
152M30.2Very low31Very low158 Ų158140 Ų14078%0.77874%0.736SS**  trans71.786.3177.1-73.1-158-90.200117.6
153H24.7Very low31.8Very low198 Ų198139.1 Ų139.192%0.91774%0.736SS**  -135.9100.5127.1-100-70.9000109.6C155H153-C155 PolarHBondContact O-N 3.15Å
154L31.7Very low32.4Very low149 Ų149139.7 Ų139.778%0.7874%0.738SS**  trans-58.3128.9168.7-10772.9000109.6R156L154-R156 PolarHBondContact O-N 3.02Å
155C35.9Very low33.6Very low115 Ų115138.2 Ų138.278%0.77772%0.721SS**  trans-63.7100.5163.3-113.20000108.8H153H153-C155 PolarHBondContact O-N 3.15Å
156R28.4Very low35.5Very low253 Ų253131.2 Ų131.296%0.95570%0.695SS**  trans-105.173177.8-163.2177.2-166.5165.13.1109.1L154L154-R156 PolarHBondContact O-N 3.02Å
157G31Very low37.7Very low38 Ų38130.5 Ų130.539%0.39268%0.684SS.*  trans-133.5146.2174.500000111.2S159G157-S159 PolarHBondContact O-N 3.45Å
158P29.1Very low40.1Very low144 Ų144121.7 Ų121.794%0.93566%0.655SS**THydrogen-bonded Turntrans-69.80.7-175.522-23.4000114.7
159S30.8Very low42.6Very low112 Ų112117.3 Ų117.378%0.78362%0.619SS**THydrogen-bonded Turntrans-113.228.4-177.1-39.60000113.4G157 H161G157-S159 PolarHBondContact O-N 3.45Å; S159-H161 PolarHBondContact O-N 3.47Å
160C41.9Very low45.4Very low77 Ų77114.4 Ų114.452%0.5260%0.597SS.*  trans-91.893.5174.6-81.50000111.4G162C160-G162 PolarHBondContact O-N 3.41Å
161H32Very low48.1Very low168 Ų168108.3 Ų108.378%0.77856%0.564SS**  trans-7265.4164.6-84.2-69.1000110.9S159 H165S159-H161 PolarHBondContact O-N 3.47Å; H161-H165 PolarHBondContact O-CE1 3.35Å; H161-H165 PolarHBondContact O-ND1 3.1Å
162G43.4Very low50.9Low40 Ų40101.1 Ų101.141%0.41253%0.529SS..  trans-84.9-21.4-161.500000118C160 W166C160-G162 PolarHBondContact O-N 3.41Å; G162-W166 PolarHBondContact O-NE1 3.47Å
163L42.6Very low53.8Low140 Ų14093.6 Ų93.673%0.73349%0.492SS*.SBendtrans-91-28.3-173-84.1106.5000115.1H165L163-H165 PolarHBondContact O-N 3.34Å
164R46.5Very low57Low218 Ų21884.5 Ų84.582%0.82345%0.45SS*.Hα-helixtrans-78.5-16.3-172.6-154.3174.8-176.1-172.81113.9T168R164-T168 WeakPolarHBondContact O-CG2 3.3Å; R164-T168 PolarHBondContact O-OG1 2.98Å
165H57.8Low60Low113 Ų11377.4 Ų77.452%0.52341%0.413SS..Hα-helixtrans-87.2-17.2-171-70.590.3000114.8H161 L163 T168 S169H161-H165 PolarHBondContact O-CE1 3.35Å; H161-H165 PolarHBondContact O-ND1 3.1Å; L163-H165 PolarHBondContact O-N 3.34Å; H165-T168 WeakPolarHBondContact CA-OG1 3.48Å; H165-T168 PolarHBondContact O-OG1 2.85Å; H165-S169 PolarHBondContact O-N 3.45Å; H165-S169 PolarHBondContact O-OG 2.83Å
166W65.9Low62.8Low55 Ų5571.9 Ų71.921%0.20838%0.376CS..Hα-helixtrans-98.2-38.1-173.1-58.4112.3000113.3L74 S75 L130 G162 T168 S169 L170L74-W166 HydrophobicContact CD2-CE3 3.84Å; L74-W166 HydrophobicContact CD2-CZ3 4.16Å; S75-W166 VanDerWaalsContact OG-CZ2 3.29Å; S75-W166 WeakPolarHBondContact OG-CZ2 3.42Å; L130-W166 HydrophobicContact CD1-CH2 3.87Å; G162-W166 PolarHBondContact O-NE1 3.47Å; W166-T168 PolarHBondContact O-N 3.16Å; W166-S169 WeakPolarHBondContact O-CB 3.49Å; W166-S169 PolarHBondContact O-N 3.05Å; W166-S169 VanDerWaalsContact O-N 3.08Å; W166-L170 PolarHBondContact O-N 2.91Å
167N73.4Confident66Low37 Ų3759.9 Ų59.920%0.19833%0.33CS..Hα-helixtrans-58.1-38.7168.4-80.33.5000111.5S80 Y81 S169 L170 Q171S80-N167 PolarHBondContact OG-ND2 3.42Å; S80-N167 PolarHBondContact OG-OD1 3.26Å; Y81-N167 WeakPolarHBondContact CE2-OD1 3.47Å; N167-S169 VanDerWaalsContact C-N 3.34Å; N167-L170 PolarHBondContact O-N 2.97Å; N167-Q171 WeakPolarHBondContact O-CB 3.43Å; N167-Q171 WeakPolarHBondContact O-CG 3.38Å; N167-Q171 PolarHBondContact O-N 3.31Å
168T80.1Confident69.1Low41 Ų4158.7 Ų58.725%0.25232%0.316SS..Hα-helixtrans-67.9-3417651.40000112R164 H165 W166 Q171 E172R164-T168 WeakPolarHBondContact O-CG2 3.3Å; R164-T168 PolarHBondContact O-OG1 2.98Å; H165-T168 WeakPolarHBondContact CA-OG1 3.48Å; H165-T168 PolarHBondContact O-OG1 2.85Å; W166-T168 PolarHBondContact O-N 3.16Å; T168-Q171 PolarHBondContact O-N 2.95Å; T168-E172 WeakPolarHBondContact O-CB 3.25Å; T168-E172 WeakPolarHBondContact O-CG 3.26Å; T168-E172 PolarHBondContact O-N 3.08Å
169S82Confident72.4Confident5 Ų552.8 Ų52.84%0.03528%0.277CS..Hα-helixtrans-67.5-42.9174.9-620000112.1K129 H165 W166 N167 E172 V173K129-S169 WeakPolarHBondContact CD-OG 3.04Å; K129-S169 PolarHBondContact NZ-OG 3.38Å; H165-S169 PolarHBondContact O-N 3.45Å; H165-S169 PolarHBondContact O-OG 2.83Å; W166-S169 WeakPolarHBondContact O-CB 3.49Å; W166-S169 PolarHBondContact O-N 3.05Å; W166-S169 VanDerWaalsContact O-N 3.08Å; N167-S169 VanDerWaalsContact C-N 3.34Å; S169-E172 PolarHBondContact O-N 3.46Å; S169-V173 WeakPolarHBondContact O-CG2 3.44Å; S169-V173 PolarHBondContact O-N 3.15Å
170L82.8Confident75.6Confident17 Ų1747.4 Ų47.49%0.08924%0.239CC..Hα-helixtrans-65.8-39.9172.6-79170.2000112.5L70 L74 L79 Y81 W166 N167 E172 V173 S174 P380L70-L170 HydrophobicContact CD2-CD2 4.16Å; L74-L170 HydrophobicContact CD1-CD1 4.29Å; L74-L170 HydrophobicContact CD1-CD2 4.08Å; L74-L170 HydrophobicContact CD1-CG 4.15Å; L79-L170 HydrophobicContact CD2-CD1 3.5Å; Y81-L170 HydrophobicContact CD2-CD1 3.81Å; Y81-L170 HydrophobicContact CE2-CB 4.5Å; Y81-L170 HydrophobicContact CE2-CD1 3.75Å; W166-L170 PolarHBondContact O-N 2.91Å; N167-L170 PolarHBondContact O-N 2.97Å; L170-E172 VanDerWaalsContact C-N 3.32Å; L170-E172 PolarHBondContact O-N 3.11Å; L170-V173 PolarHBondContact O-N 2.73Å; L170-S174 WeakPolarHBondContact O-CB 3.49Å; L170-S174 PolarHBondContact O-N 2.79Å; L170-P380 HydrophobicContact CD2-CB 4.11Å
171Q88Confident78.2Confident33 Ų3343.8 Ų43.815%0.15422%0.215CC..Hα-helixtrans-61.9-38.8174.2-74163.99.900112.2N167 T168 S174 G175 N316 L319N167-Q171 WeakPolarHBondContact O-CB 3.43Å; N167-Q171 WeakPolarHBondContact O-CG 3.38Å; N167-Q171 PolarHBondContact O-N 3.31Å; T168-Q171 PolarHBondContact O-N 2.95Å; Q171-S174 PolarHBondContact O-N 3.15Å; Q171-G175 PolarHBondContact O-N 3.24Å; Q171-N316 HydrophobicContact CG-CB 4.46Å; Q171-N316 VanDerWaalsContact NE2-CB 3.29Å; Q171-N316 PolarHBondContact NE2-ND2 3.37Å; Q171-N316 VanDerWaalsContact NE2-ND2 3.15Å; Q171-L319 HydrophobicContact CB-CB 3.9Å; Q171-L319 PolarHBondContact O-N 3.42Å
172E90Very high81.3Confident13 Ų1340.6 Ų40.66%0.06120%0.203CC..Hα-helixtrans-67.5-41.8174.9-78.5-179.3-151.500112.3L125 K129 T168 S169 L170 S174 G175 A176 L319 T321 A324L125-E172 HydrophobicContact CD2-CB 4.36Å; K129-E172 WeakPolarHBondContact CE-OE2 3.28Å; K129-E172 IonicContact NZ-OE1 3.08Å; K129-E172 PolarHBondContact NZ-OE1 2.92Å; K129-E172 IonicContact NZ-OE2 3.3Å; K129-E172 PolarHBondContact NZ-OE2 3.27Å; T168-E172 WeakPolarHBondContact O-CB 3.25Å; T168-E172 WeakPolarHBondContact O-CG 3.26Å; T168-E172 PolarHBondContact O-N 3.08Å; S169-E172 PolarHBondContact O-N 3.46Å; L170-E172 VanDerWaalsContact C-N 3.32Å; L170-E172 PolarHBondContact O-N 3.11Å; E172-S174 VanDerWaalsContact C-N 3.35Å; E172-G175 PolarHBondContact O-N 3.32Å; E172-A176 PolarHBondContact O-N 2.54Å; E172-L319 HydrophobicContact CG-CB 4.13Å; E172-L319 HydrophobicContact CG-CD2 3.83Å; E172-L319 HydrophobicContact CG-CG 4.14Å; E172-T321 HydrophobicContact CG-CG2 3.85Å; E172-A324 HydrophobicContact CB-CB 4.43Å; E172-A324 WeakPolarHBondContact O-CB 3.43Å
173V90.9Very high83.9Confident0 Ų041 Ų410%020%0.196CC..Hα-helixtrans-62.5-44.5173.8172.10000110.3A122 L125 T126 S169 L170 G175 A176 V177 P380A122-V173 HydrophobicContact CB-CG1 3.75Å; A122-V173 HydrophobicContact CB-CG2 4.2Å; L125-V173 HydrophobicContact CD2-CG2 4.06Å; T126-V173 HydrophobicContact CG2-CG2 3.81Å; S169-V173 WeakPolarHBondContact O-CG2 3.44Å; S169-V173 PolarHBondContact O-N 3.15Å; L170-V173 PolarHBondContact O-N 2.73Å; V173-G175 VanDerWaalsContact C-N 3.28Å; V173-G175 PolarHBondContact O-N 3.43Å; V173-A176 WeakPolarHBondContact O-CB 3.28Å; V173-A176 PolarHBondContact O-N 3.29Å; V173-A176 VanDerWaalsContact O-N 3.1Å; V173-V177 WeakPolarHBondContact O-CG2 3.49Å; V173-V177 PolarHBondContact O-N 3.48Å; V173-P380 HydrophobicContact CG1-CB 3.94Å; V173-P380 WeakPolarHBondContact CG1-O 2.87Å
174S91.9Very high86.4Confident6 Ų634.4 Ų34.44%0.04216%0.161CC..Hα-helixtrans-58.9-40.1174.3-148.20000111.7L170 Q171 E172 V177 V178 G375 G378L170-S174 WeakPolarHBondContact O-CB 3.49Å; L170-S174 PolarHBondContact O-N 2.79Å; Q171-S174 PolarHBondContact O-N 3.15Å; E172-S174 VanDerWaalsContact C-N 3.35Å; S174-V177 PolarHBondContact O-N 3.01Å; S174-V178 WeakPolarHBondContact O-CG2 3.28Å; S174-V178 PolarHBondContact O-N 3.19Å; S174-G375 PolarHBondContact OG-O 2.85Å; S174-G378 WeakPolarHBondContact OG-CA 2.94Å
175G94.5Very high88.7Confident0 Ų024.5 Ų24.50%013%0.127CC..Hα-helixtrans-63.2-41.9172.600000113.2Q171 E172 V173 V177 V178 V179Q171-G175 PolarHBondContact O-N 3.24Å; E172-G175 PolarHBondContact O-N 3.32Å; V173-G175 VanDerWaalsContact C-N 3.28Å; V173-G175 PolarHBondContact O-N 3.43Å; G175-V177 VanDerWaalsContact C-N 3.31Å; G175-V177 PolarHBondContact O-N 3.31Å; G175-V178 PolarHBondContact O-N 2.72Å; G175-V179 WeakPolarHBondContact O-CG2 3.45Å; G175-V179 PolarHBondContact O-N 3.2Å
176A95.7Very high90.4Very high0 Ų022.2 Ų22.20%012%0.121CC..Hα-helixtrans-61.4-39.6173.400000111.8L125 E172 V173 V179 S180 A324 A327 G328 M331L125-A176 HydrophobicContact CD2-CB 4.26Å; E172-A176 PolarHBondContact O-N 2.54Å; V173-A176 WeakPolarHBondContact O-CB 3.28Å; V173-A176 PolarHBondContact O-N 3.29Å; V173-A176 VanDerWaalsContact O-N 3.1Å; A176-V179 PolarHBondContact O-N 3.44Å; A176-S180 WeakPolarHBondContact O-CB 3.43Å; A176-S180 PolarHBondContact O-N 3.47Å; A176-A324 WeakPolarHBondContact CA-O 3.18Å; A176-A324 HydrophobicContact CB-CB 4.3Å; A176-A324 VanDerWaalsContact CB-O 3.25Å; A176-A324 WeakPolarHBondContact CB-O 3.42Å; A176-A327 HydrophobicContact CB-CB 4Å; A176-G328 WeakPolarHBondContact O-CA 3.12Å; A176-M331 HydrophobicContact CB-CE 4Å; A176-M331 HydrophobicContact CB-SD 3.99Å
177V95.8Very high91.7Very high0 Ų021.7 Ų21.70%012%0.121CC..Hα-helixtrans-64.7-42.6175.2173.10000111.6F118 V173 S174 G175 S180 G181 M331 S371 A374 P380F118-V177 HydrophobicContact CD1-CG2 4.36Å; V173-V177 WeakPolarHBondContact O-CG2 3.49Å; V173-V177 PolarHBondContact O-N 3.48Å; S174-V177 PolarHBondContact O-N 3.01Å; G175-V177 VanDerWaalsContact C-N 3.31Å; G175-V177 PolarHBondContact O-N 3.31Å; V177-S180 WeakPolarHBondContact O-CB 3.46Å; V177-S180 PolarHBondContact O-N 3.22Å; V177-G181 PolarHBondContact O-N 2.84Å; V177-M331 HydrophobicContact CG2-SD 4.21Å; V177-S371 WeakPolarHBondContact CG1-O 3.4Å; V177-A374 HydrophobicContact CG1-CB 4.49Å; V177-P380 WeakPolarHBondContact CG2-O 3.12Å
178V96.9Very high92.6Very high14 Ų1419.9 Ų19.99%0.08511%0.112CC..Hα-helixtrans-61.4-47.3174.7172.40000111.1S174 G175 S180 G181 L182 P318 L376S174-V178 WeakPolarHBondContact O-CG2 3.28Å; S174-V178 PolarHBondContact O-N 3.19Å; G175-V178 PolarHBondContact O-N 2.72Å; V178-S180 PolarHBondContact O-N 3.01Å; V178-G181 PolarHBondContact O-N 2.76Å; V178-L182 HydrophobicContact CG1-CD1 4.09Å; V178-L182 HydrophobicContact CG1-CG 4.42Å; V178-L182 WeakPolarHBondContact O-CG 3.44Å; V178-L182 PolarHBondContact O-N 2.74Å; V178-P318 HydrophobicContact CG2-CB 4.28Å; V178-P318 HydrophobicContact CG2-CG 4.05Å; V178-L376 HydrophobicContact CG2-CD2 4.26Å; V178-L376 HydrophobicContact CG2-CG 4.31Å
179V97.5Very high93Very high19 Ų1921.2 Ų21.212%0.11512%0.117CC..Hα-helixtrans-56.3-44.3174.8166.30000110.6G175 A176 L182 L183 L320 L325G175-V179 WeakPolarHBondContact O-CG2 3.45Å; G175-V179 PolarHBondContact O-N 3.2Å; A176-V179 PolarHBondContact O-N 3.44Å; V179-L182 PolarHBondContact O-N 2.88Å; V179-L183 WeakPolarHBondContact O-CB 3.32Å; V179-L183 PolarHBondContact O-N 3.41Å; V179-L320 HydrophobicContact CG2-CD2 3.67Å; V179-L325 HydrophobicContact CG1-CD1 3.7Å; V179-L325 HydrophobicContact CG2-CD1 4.17Å
180S97.4Very high93.4Very high0 Ų026.6 Ų26.60%015%0.145CC..Hα-helixtrans-60.6-47.7179.7-1780000111.8F118 A176 V177 V178 L183 Q184 G328 M331 A332F118-S180 WeakPolarHBondContact CE1-OG 3.42Å; A176-S180 WeakPolarHBondContact O-CB 3.43Å; A176-S180 PolarHBondContact O-N 3.47Å; V177-S180 WeakPolarHBondContact O-CB 3.46Å; V177-S180 PolarHBondContact O-N 3.22Å; V178-S180 PolarHBondContact O-N 3.01Å; S180-L183 PolarHBondContact O-N 3.09Å; S180-Q184 WeakPolarHBondContact O-CB 3.44Å; S180-Q184 WeakPolarHBondContact O-CG 3.36Å; S180-Q184 PolarHBondContact O-N 3.47Å; S180-G328 WeakPolarHBondContact CA-O 3.4Å; S180-G328 WeakPolarHBondContact CB-O 3.4Å; S180-M331 WeakPolarHBondContact OG-CB 3.27Å; S180-A332 WeakPolarHBondContact OG-CA 3.49Å; S180-A332 PolarHBondContact OG-N 2.92Å
181G97.1Very high93.6Very high0 Ų026 Ų260%014%0.142CC..Hα-helixtrans-64.2-39.4177.800000113.4V177 V178 G185 G368 V372V177-G181 PolarHBondContact O-N 2.84Å; V178-G181 PolarHBondContact O-N 2.76Å; G181-G185 PolarHBondContact O-N 3.07Å; G181-G368 CarbonylContact C-O 3.57Å; G181-G368 WeakPolarHBondContact CA-O 3.3Å; G181-G368 CarbonylContact O-C 3.53Å; G181-G368 WeakPolarHBondContact O-CA 3.33Å; G181-V372 VanDerWaalsContact C-CG2 3.49Å
182L97.6Very high93.6Very high101 Ų10126 Ų2653%0.52915%0.146SC..Hα-helixtrans-63.2-42.5173.9-71.2173.9000111.3V178 V179 G185 T186 V372V178-L182 HydrophobicContact CG1-CD1 4.09Å; V178-L182 HydrophobicContact CG1-CG 4.42Å; V178-L182 WeakPolarHBondContact O-CG 3.44Å; V178-L182 PolarHBondContact O-N 2.74Å; V179-L182 PolarHBondContact O-N 2.88Å; L182-G185 PolarHBondContact O-N 3.44Å; L182-T186 WeakPolarHBondContact O-CB 3.4Å; L182-T186 VanDerWaalsContact O-CG2 3.27Å; L182-T186 WeakPolarHBondContact O-CG2 3.16Å; L182-T186 PolarHBondContact O-N 3.09Å; L182-T186 PolarHBondContact O-OG1 3.27Å; L182-V372 HydrophobicContact CD2-CG2 3.97Å; L182-V372 HydrophobicContact CG-CG2 3.94Å
183L96.9Very high93.4Very high50 Ų5025.6 Ų25.626%0.26214%0.144SC..Hα-helixtrans-68.7-43.6179-176.357.1000111.9V179 S180 T186 M187 I329 A332V179-L183 WeakPolarHBondContact O-CB 3.32Å; V179-L183 PolarHBondContact O-N 3.41Å; S180-L183 PolarHBondContact O-N 3.09Å; L183-T186 WeakPolarHBondContact CA-OG1 3.44Å; L183-T186 PolarHBondContact O-N 3.2Å; L183-T186 PolarHBondContact O-OG1 2.88Å; L183-M187 HydrophobicContact CD1-CG 4.31Å; L183-M187 HydrophobicContact CD1-SD 4.4Å; L183-M187 HydrophobicContact CG-SD 4.14Å; L183-M187 WeakPolarHBondContact O-CB 3.34Å; L183-M187 WeakPolarHBondContact O-CG 3.14Å; L183-M187 PolarHBondContact O-N 3.42Å; L183-I329 HydrophobicContact CD2-CB 4.23Å; L183-I329 HydrophobicContact CD2-CG1 4.03Å; L183-I329 HydrophobicContact CD2-CG2 4.13Å; L183-A332 HydrophobicContact CB-CB 3.87Å; L183-A332 HydrophobicContact CD2-CB 3.66Å; L183-A332 HydrophobicContact CG-CB 3.88Å
184Q95.6Very high92.9Very high0 Ų026 Ų260%015%0.149CC..Hα-helixtrans-61.4-44.6172.9-74.3175.5-8.100112S180 M187 G188 A332 A335 L364S180-Q184 WeakPolarHBondContact O-CB 3.44Å; S180-Q184 WeakPolarHBondContact O-CG 3.36Å; S180-Q184 PolarHBondContact O-N 3.47Å; Q184-M187 PolarHBondContact O-N 3.33Å; Q184-G188 PolarHBondContact O-N 2.88Å; Q184-A332 HydrophobicContact CG-CB 4.02Å; Q184-A332 PolarHBondContact NE2-O 3.18Å; Q184-A335 VanDerWaalsContact NE2-CB 3.25Å; Q184-L364 HydrophobicContact CB-CD1 4.47Å; Q184-L364 HydrophobicContact CB-CG 4.4Å; Q184-L364 HydrophobicContact CG-CD1 4.4Å
185G94.7Very high92.6Very high11 Ų1134 Ų3411%0.11318%0.178CC..Hα-helixtrans-53.4-57.3174.600000110.8G181 L182 M187 G188 L189G181-G185 PolarHBondContact O-N 3.07Å; L182-G185 PolarHBondContact O-N 3.44Å; G185-M187 PolarHBondContact O-N 2.89Å; G185-G188 PolarHBondContact O-N 3.18Å; G185-L189 VanDerWaalsContact O-CG 3.26Å; G185-L189 WeakPolarHBondContact O-CG 3.44Å; G185-L189 PolarHBondContact O-N 2.74Å
186T93.6Very high92.2Very high65 Ų6537.2 Ų37.240%0.39920%0.197SC..Hα-helixtrans-60.8-44.8179.152.80000112.3L182 L183 G188 L189 L190L182-T186 WeakPolarHBondContact O-CB 3.4Å; L182-T186 VanDerWaalsContact O-CG2 3.27Å; L182-T186 WeakPolarHBondContact O-CG2 3.16Å; L182-T186 PolarHBondContact O-N 3.09Å; L182-T186 PolarHBondContact O-OG1 3.27Å; L183-T186 WeakPolarHBondContact CA-OG1 3.44Å; L183-T186 PolarHBondContact O-N 3.2Å; L183-T186 PolarHBondContact O-OG1 2.88Å; T186-G188 VanDerWaalsContact C-N 3.33Å; T186-G188 PolarHBondContact O-N 3.09Å; T186-L189 PolarHBondContact O-N 2.88Å; T186-L190 WeakPolarHBondContact O-CB 3.5Å; T186-L190 WeakPolarHBondContact O-CD1 3.41Å; T186-L190 PolarHBondContact O-N 2.91Å
187M93.1Very high91.6Very high43 Ų4338.1 Ų38.121%0.21220%0.201CC..Hα-helixtrans-55.6-47.1174.4-76.9176.166.600112.1L183 Q184 G185 L190 G191 S192 P193 L333 L364L183-M187 HydrophobicContact CD1-CG 4.31Å; L183-M187 HydrophobicContact CD1-SD 4.4Å; L183-M187 HydrophobicContact CG-SD 4.14Å; L183-M187 WeakPolarHBondContact O-CB 3.34Å; L183-M187 WeakPolarHBondContact O-CG 3.14Å; L183-M187 PolarHBondContact O-N 3.42Å; Q184-M187 PolarHBondContact O-N 3.33Å; G185-M187 PolarHBondContact O-N 2.89Å; M187-L190 PolarHBondContact O-N 3.2Å; M187-G191 PolarHBondContact O-N 3.17Å; M187-S192 WeakPolarHBondContact CB-OG 3.27Å; M187-S192 PolarHBondContact O-N 3.2Å; M187-S192 VanDerWaalsContact O-N 3.1Å; M187-S192 PolarHBondContact O-OG 2.95Å; M187-P193 WeakPolarHBondContact O-CD 3.44Å; M187-L333 HydrophobicContact CE-CD2 4.33Å; M187-L333 HydrophobicContact SD-CD2 4.35Å; M187-L364 HydrophobicContact CB-CD2 4.24Å
188G91.7Very high90.9Very high0 Ų041.5 Ų41.50%022%0.224CC..Hα-helixtrans-61.7-47.2176.400000112.7Q184 G185 T186 L190 G191 S361Q184-G188 PolarHBondContact O-N 2.88Å; G185-G188 PolarHBondContact O-N 3.18Å; T186-G188 VanDerWaalsContact C-N 3.33Å; T186-G188 PolarHBondContact O-N 3.09Å; G188-L190 VanDerWaalsContact C-N 3.34Å; G188-L190 PolarHBondContact O-N 3.29Å; G188-G191 PolarHBondContact O-N 3.26Å; G188-G191 VanDerWaalsContact O-N 3.11Å; G188-S361 CarbonylContact C-O 3.6Å; G188-S361 VanDerWaalsContact CA-O 3.23Å; G188-S361 WeakPolarHBondContact CA-O 3.48Å; G188-S361 WeakPolarHBondContact O-CB 3.36Å
189L90.1Very high90.4Very high68 Ų6845.9 Ų45.936%0.35624%0.243SC..Hα-helixtrans-62.2-38.8177.9-64.8178.7000112.3G185 T186 G191 L572 L575G185-L189 VanDerWaalsContact O-CG 3.26Å; G185-L189 WeakPolarHBondContact O-CG 3.44Å; G185-L189 PolarHBondContact O-N 2.74Å; T186-L189 PolarHBondContact O-N 2.88Å; L189-G191 PolarHBondContact O-N 3.15Å; L189-L572 HydrophobicContact CB-CD2 3.91Å; L189-L572 HydrophobicContact CD1-CD2 4.37Å; L189-L572 HydrophobicContact CD2-CD2 3.76Å; L189-L572 HydrophobicContact CG-CD2 4.19Å; L189-L575 HydrophobicContact CD2-CD1 3.66Å
190L90.4Very high89.8Confident119 Ų11946.1 Ų46.162%0.62325%0.245SC*.THydrogen-bonded Turntrans-71.8-6.1177.4-9275.4000113.6T186 M187 G188 S192T186-L190 WeakPolarHBondContact O-CB 3.5Å; T186-L190 WeakPolarHBondContact O-CD1 3.41Å; T186-L190 PolarHBondContact O-N 2.91Å; M187-L190 PolarHBondContact O-N 3.2Å; G188-L190 VanDerWaalsContact C-N 3.34Å; G188-L190 PolarHBondContact O-N 3.29Å; L190-S192 VanDerWaalsContact C-N 3.28Å; L190-S192 PolarHBondContact O-N 3.48Å
191G86.4Confident89.3Confident3 Ų346.2 Ų46.23%0.03125%0.246CC..THydrogen-bonded Turntrans76.212.4-177.900000114.1M187 G188 L189 P193 G194 R195 S361M187-G191 PolarHBondContact O-N 3.17Å; G188-G191 PolarHBondContact O-N 3.26Å; G188-G191 VanDerWaalsContact O-N 3.11Å; L189-G191 PolarHBondContact O-N 3.15Å; G191-P193 VanDerWaalsContact C-CD 3.49Å; G191-G194 PolarHBondContact O-N 3.46Å; G191-R195 PolarHBondContact O-N 3.29Å; G191-S361 VanDerWaalsContact CA-OG 3.31Å; G191-S361 WeakPolarHBondContact CA-OG 3.35Å
192S88.9Confident89Confident34 Ų3446.8 Ų46.824%0.23825%0.25CC..Hα-helixtrans-60.7-40.5-174.978.90000113.5M187 L190 G194 R195 V196M187-S192 WeakPolarHBondContact CB-OG 3.27Å; M187-S192 PolarHBondContact O-N 3.2Å; M187-S192 VanDerWaalsContact O-N 3.1Å; M187-S192 PolarHBondContact O-OG 2.95Å; L190-S192 VanDerWaalsContact C-N 3.28Å; L190-S192 PolarHBondContact O-N 3.48Å; S192-G194 VanDerWaalsContact C-N 3.32Å; S192-G194 PolarHBondContact O-N 3.07Å; S192-R195 PolarHBondContact O-N 2.88Å; S192-R195 VanDerWaalsContact O-N 3.17Å; S192-V196 WeakPolarHBondContact O-CG2 3.48Å; S192-V196 PolarHBondContact O-N 3.38Å; S192-V196 VanDerWaalsContact O-N 3.07Å
193P85.4Confident88.7Confident4 Ų442 Ų423%0.02622%0.224CC..Hα-helixtrans-65.3-38177.3-19.934.3000111.6M187 G191 R195 V196 F197 L340 C360 L364M187-P193 WeakPolarHBondContact O-CD 3.44Å; G191-P193 VanDerWaalsContact C-CD 3.49Å; P193-R195 PolarHBondContact O-N 3.01Å; P193-V196 PolarHBondContact O-N 2.87Å; P193-F197 WeakPolarHBondContact O-CB 3.34Å; P193-F197 PolarHBondContact O-N 3.48Å; P193-L340 HydrophobicContact CB-CD1 4.24Å; P193-L340 HydrophobicContact CB-CD2 4Å; P193-C360 HydrophobicContact CB-CB 4.26Å; P193-L364 HydrophobicContact CB-CD2 4.38Å; P193-L364 HydrophobicContact CG-CB 4.08Å; P193-L364 HydrophobicContact CG-CD2 3.33Å; P193-L364 HydrophobicContact CG-CG 4.34Å
194G80.1Confident88.6Confident9 Ų939.8 Ų39.89%0.09321%0.213CC..Hα-helixtrans-63.7-26176.500000114.2G191 S192 P198 P357 S361G191-G194 PolarHBondContact O-N 3.46Å; S192-G194 VanDerWaalsContact C-N 3.32Å; S192-G194 PolarHBondContact O-N 3.07Å; G194-P198 WeakPolarHBondContact O-CD 3.33Å; G194-P198 VanDerWaalsContact O-CG 3.29Å; G194-P198 WeakPolarHBondContact O-CG 3.49Å; G194-P357 WeakPolarHBondContact O-CB 3.39Å; G194-S361 PolarHBondContact N-OG 3.35Å
195R84.8Confident88.5Confident173 Ų17341.4 Ų41.465%0.65322%0.222SC*.Hα-helixtrans-83.9-38.7175-64.5179.2-172170.33.9112.6G191 S192 P193 H199G191-R195 PolarHBondContact O-N 3.29Å; S192-R195 PolarHBondContact O-N 2.88Å; S192-R195 VanDerWaalsContact O-N 3.17Å; P193-R195 PolarHBondContact O-N 3.01Å; R195-H199 PolarHBondContact O-CE1 3.33Å; R195-H199 PolarHBondContact O-ND1 3.15Å
196V85.9Confident88.4Confident68 Ų6840.9 Ų40.941%0.41222%0.216SC..Hα-helixtrans-80.1-43.2-176.6176.90000111.6S192 P193 H199 C200 F513S192-V196 WeakPolarHBondContact O-CG2 3.48Å; S192-V196 PolarHBondContact O-N 3.38Å; S192-V196 VanDerWaalsContact O-N 3.07Å; P193-V196 PolarHBondContact O-N 2.87Å; V196-H199 WeakPolarHBondContact O-CA 3.28Å; V196-H199 WeakPolarHBondContact O-CB 3.47Å; V196-H199 PolarHBondContact O-N 3.07Å; V196-C200 PolarHBondContact O-N 3.29Å; V196-F513 HydrophobicContact CG1-CE2 4.18Å
197F84.4Confident88.5Confident19 Ų1937.8 Ų37.88%0.08320%0.197CC..G310 helixtrans-57.9-38.7-172-172.8-101.9000114.9P193 H199 C200 L205 L340 A344 P355P193-F197 WeakPolarHBondContact O-CB 3.34Å; P193-F197 PolarHBondContact O-N 3.48Å; F197-H199 PolarHBondContact O-N 3.46Å; F197-C200 WeakPolarHBondContact O-CB 3.36Å; F197-C200 PolarHBondContact O-N 3.04Å; F197-L205 HydrophobicContact CE2-CD2 4.4Å; F197-L340 HydrophobicContact CD2-CB 4.06Å; F197-L340 HydrophobicContact CD2-CD1 4.49Å; F197-L340 HydrophobicContact CD2-CD2 4.01Å; F197-L340 HydrophobicContact CD2-CG 4.41Å; F197-L340 HydrophobicContact CE2-CB 4.26Å; F197-A344 HydrophobicContact CE2-CB 4.14Å; F197-A344 HydrophobicContact CZ-CB 3.89Å; F197-P355 HydrophobicContact CE1-CG 3.64Å; F197-P355 HydrophobicContact CZ-CG 3.74Å
198P81.5Confident88.7Confident72 Ų7236.1 Ų36.147%0.46819%0.19SC..G310 helixtrans-60.9-23.5174-25.336000114.3G194 P357G194-P198 WeakPolarHBondContact O-CD 3.33Å; G194-P198 VanDerWaalsContact O-CG 3.29Å; G194-P198 WeakPolarHBondContact O-CG 3.49Å; P198-P357 HydrophobicContact CG-CG 4.18Å
199H84.4Confident88.8Confident106 Ų10636.3 Ų36.349%0.49119%0.191SC..G310 helixtrans-88.3-5.5176.5-57.987.4000112.4R195 V196 F197 G201 F513R195-H199 PolarHBondContact O-CE1 3.33Å; R195-H199 PolarHBondContact O-ND1 3.15Å; V196-H199 WeakPolarHBondContact O-CA 3.28Å; V196-H199 WeakPolarHBondContact O-CB 3.47Å; V196-H199 PolarHBondContact O-N 3.07Å; F197-H199 PolarHBondContact O-N 3.46Å; H199-G201 PolarHBondContact O-N 3.43Å; H199-F513 HydrophobicContact CB-CE2 3.89Å
200C86.4Confident89.1Confident23 Ų2333.1 Ų33.116%0.15517%0.174CC..  trans-87.681.2174.5-62.40000109.9V196 F197 V204 L205V196-C200 PolarHBondContact O-N 3.29Å; F197-C200 WeakPolarHBondContact O-CB 3.36Å; F197-C200 PolarHBondContact O-N 3.04Å; C200-V204 HydrophobicContact CB-CB 4.36Å; C200-V204 HydrophobicContact CB-CG1 4.36Å; C200-L205 HydrophobicContact CB-CD2 4.42Å; C200-L205 HydrophobicContact CB-CG 4.45Å; C200-L205 WeakPolarHBondContact O-CD1 3.48Å
201G87.1Confident89.4Confident2 Ų227.5 Ų27.52%0.02115%0.145CC..  trans-66.1178175.200000114H199 L203 V204 L205H199-G201 PolarHBondContact O-N 3.43Å; G201-L203 PolarHBondContact O-N 2.8Å; G201-L203 VanDerWaalsContact O-N 3.13Å; G201-V204 PolarHBondContact O-N 2.66Å; G201-L205 PolarHBondContact O-N 3.37Å; G201-L205 VanDerWaalsContact O-N 3.15Å
202P90.3Very high89.8Confident12 Ų1227.4 Ų27.48%0.07814%0.144CC..Hα-helixtrans-52.1-35.2176.4-26.533.9000113.6V204 L205 A206 L453 A454 R526P202-V204 PolarHBondContact O-N 3.33Å; P202-L205 PolarHBondContact O-N 3.13Å; P202-A206 WeakPolarHBondContact O-CB 3.42Å; P202-A206 PolarHBondContact O-N 3.29Å; P202-L453 HydrophobicContact CB-CB 4.01Å; P202-L453 HydrophobicContact CG-CB 3.78Å; P202-L453 HydrophobicContact CG-CD1 4.26Å; P202-A454 HydrophobicContact CB-CB 4.39Å; P202-R526 WeakPolarHBondContact CD-O 3.3Å
203L91.9Very high89.9Confident0 Ų026.2 Ų26.20%014%0.137CC..Hα-helixtrans-72.1-13-179.8-63.8168.4000114.1G201 P207 A454 N461 I464 V465 E516G201-L203 PolarHBondContact O-N 2.8Å; G201-L203 VanDerWaalsContact O-N 3.13Å; L203-P207 WeakPolarHBondContact O-CD 3.46Å; L203-P207 WeakPolarHBondContact O-CG 3.3Å; L203-A454 HydrophobicContact CD1-CB 4.36Å; L203-A454 HydrophobicContact CD2-CB 3.95Å; L203-A454 HydrophobicContact CG-CB 4.02Å; L203-N461 HydrophobicContact CD1-CB 4.28Å; L203-N461 VanDerWaalsContact CD1-CG 3.45Å; L203-N461 WeakPolarHBondContact CD1-OD1 3.19Å; L203-N461 HydrophobicContact CD2-CB 4Å; L203-I464 HydrophobicContact CB-CG2 4.48Å; L203-V465 HydrophobicContact CD2-CG2 3.74Å; L203-E516 HydrophobicContact CB-CG 4.48Å; L203-E516 WeakPolarHBondContact CB-OE2 3.14Å; L203-E516 WeakPolarHBondContact CD1-OE2 3.25Å
204V93.9Very high90.3Very high5 Ų528.9 Ų28.93%0.0315%0.15CC..Hα-helixtrans-95.3-45.5171.3-175.20000110.4C200 G201 P202 S208 G509 F513 E516C200-V204 HydrophobicContact CB-CB 4.36Å; C200-V204 HydrophobicContact CB-CG1 4.36Å; G201-V204 PolarHBondContact O-N 2.66Å; P202-V204 PolarHBondContact O-N 3.33Å; V204-S208 WeakPolarHBondContact O-CB 3.08Å; V204-S208 PolarHBondContact O-N 2.91Å; V204-S208 PolarHBondContact O-OG 3.25Å; V204-G509 WeakPolarHBondContact CG1-O 3.48Å; V204-F513 HydrophobicContact CG1-CB 4.05Å; V204-F513 HydrophobicContact CG2-CB 4.35Å; V204-E516 HydrophobicContact CG2-CB 3.97Å; V204-E516 HydrophobicContact CG2-CG 4.16Å
205L92.6Very high90.8Very high33 Ų3329.7 Ų29.717%0.17316%0.155CC..Hα-helixtrans-69.8-44.9-175.9-66.4172.3000111.7F197 C200 G201 P202 S208 L209 A344F197-L205 HydrophobicContact CE2-CD2 4.4Å; C200-L205 HydrophobicContact CB-CD2 4.42Å; C200-L205 HydrophobicContact CB-CG 4.45Å; C200-L205 WeakPolarHBondContact O-CD1 3.48Å; G201-L205 PolarHBondContact O-N 3.37Å; G201-L205 VanDerWaalsContact O-N 3.15Å; P202-L205 PolarHBondContact O-N 3.13Å; L205-S208 WeakPolarHBondContact O-CB 3.47Å; L205-S208 PolarHBondContact O-N 3.47Å; L205-L209 VanDerWaalsContact O-CG 3.3Å; L205-L209 WeakPolarHBondContact O-CG 3Å; L205-L209 PolarHBondContact O-N 2.76Å; L205-A344 HydrophobicContact CD1-CB 3.96Å; L205-A344 HydrophobicContact CD2-CB 4.15Å
206A94.1Very high90.9Very high0 Ų021.7 Ų21.70%013%0.126CC..Hα-helixtrans-63.5-49-175.100000113.1P202 S208 L209 V210 S450 F451P202-A206 WeakPolarHBondContact O-CB 3.42Å; P202-A206 PolarHBondContact O-N 3.29Å; A206-S208 VanDerWaalsContact C-N 3.3Å; A206-S208 PolarHBondContact O-N 3.36Å; A206-L209 PolarHBondContact O-N 3.01Å; A206-V210 WeakPolarHBondContact O-CG2 3.41Å; A206-V210 PolarHBondContact O-N 3.29Å; A206-S450 VanDerWaalsContact CB-CB 3.46Å; A206-F451 HydrophobicContact CB-CD1 3.48Å; A206-F451 VanDerWaalsContact CB-CD1 3.48Å; A206-F451 HydrophobicContact CB-CE1 3.2Å; A206-F451 HydrophobicContact CB-CE2 4.29Å; A206-F451 HydrophobicContact CB-CG 4.13Å; A206-F451 HydrophobicContact CB-CZ 3.63Å
207P96.1Very high91Very high0 Ų024.7 Ų24.70%014%0.135CC..Hα-helixtrans-59-39.7173.1-28.440.2000113.1L203 L209 V210 V211 F451 V465 I469L203-P207 WeakPolarHBondContact O-CD 3.46Å; L203-P207 WeakPolarHBondContact O-CG 3.3Å; P207-L209 VanDerWaalsContact C-N 3.34Å; P207-L209 PolarHBondContact O-N 3.11Å; P207-V210 PolarHBondContact O-N 3.27Å; P207-V211 WeakPolarHBondContact O-CB 3.48Å; P207-V211 VanDerWaalsContact O-CG2 3.31Å; P207-V211 WeakPolarHBondContact O-CG2 3.37Å; P207-V211 PolarHBondContact O-N 2.94Å; P207-F451 HydrophobicContact CG-CE1 4.04Å; P207-F451 HydrophobicContact CG-CZ 4.25Å; P207-V465 HydrophobicContact CG-CG1 4.45Å; P207-V465 HydrophobicContact CG-CG2 4.24Å; P207-I469 HydrophobicContact CB-CD1 4.47Å; P207-I469 HydrophobicContact CB-CG1 3.84Å
208S95.5Very high91.1Very high8 Ų830.1 Ų30.16%0.05616%0.155CC..Hα-helixtrans-61.7-42.1178.7-57.60000111.9V204 L205 A206 A212 G509V204-S208 WeakPolarHBondContact O-CB 3.08Å; V204-S208 PolarHBondContact O-N 2.91Å; V204-S208 PolarHBondContact O-OG 3.25Å; L205-S208 WeakPolarHBondContact O-CB 3.47Å; L205-S208 PolarHBondContact O-N 3.47Å; A206-S208 VanDerWaalsContact C-N 3.3Å; A206-S208 PolarHBondContact O-N 3.36Å; S208-A212 WeakPolarHBondContact O-CB 3.31Å; S208-A212 PolarHBondContact O-N 3.43Å; S208-G509 WeakPolarHBondContact OG-CA 3.46Å; S208-G509 PolarHBondContact OG-N 3.19Å
209L95Very high91.2Very high4 Ų428.1 Ų28.12%0.02114%0.14CC..Hα-helixtrans-69.1-41176.4-67.2178.5000112.6L205 A206 P207 V211 A212 G213 L345 F387 V443L205-L209 VanDerWaalsContact O-CG 3.3Å; L205-L209 WeakPolarHBondContact O-CG 3Å; L205-L209 PolarHBondContact O-N 2.76Å; A206-L209 PolarHBondContact O-N 3.01Å; P207-L209 VanDerWaalsContact C-N 3.34Å; P207-L209 PolarHBondContact O-N 3.11Å; L209-V211 VanDerWaalsContact C-N 3.33Å; L209-V211 PolarHBondContact O-N 2.84Å; L209-A212 WeakPolarHBondContact O-CB 3.18Å; L209-A212 PolarHBondContact O-N 3.45Å; L209-G213 PolarHBondContact O-N 3.02Å; L209-G213 VanDerWaalsContact O-N 3.08Å; L209-L345 HydrophobicContact CD1-CB 4.39Å; L209-L345 HydrophobicContact CD1-CD1 4.15Å; L209-L345 HydrophobicContact CD2-CB 4.16Å; L209-L345 HydrophobicContact CD2-CD2 4.07Å; L209-F387 HydrophobicContact CD2-CD1 4.25Å; L209-F387 HydrophobicContact CD2-CE1 3.35Å; L209-F387 HydrophobicContact CD2-CZ 3.94Å; L209-V443 HydrophobicContact CD2-CG1 4.45Å
210V96.8Very high91.4Very high2 Ų224.2 Ų24.21%0.01212%0.123CC..Hα-helixtrans-59.7-47.1174.6167.20000110.3A206 P207 G213 L214 L444 F448 F451 I469A206-V210 WeakPolarHBondContact O-CG2 3.41Å; A206-V210 PolarHBondContact O-N 3.29Å; P207-V210 PolarHBondContact O-N 3.27Å; V210-G213 PolarHBondContact O-N 3.45Å; V210-L214 HydrophobicContact CG1-CD1 3.76Å; V210-L214 HydrophobicContact CG1-CG 4.42Å; V210-L214 WeakPolarHBondContact O-CB 3.13Å; V210-L214 WeakPolarHBondContact O-CG 3.22Å; V210-L214 PolarHBondContact O-N 3.39Å; V210-L444 HydrophobicContact CB-CD1 4.03Å; V210-L444 HydrophobicContact CG1-CD1 3.67Å; V210-L444 HydrophobicContact CG2-CD1 4.16Å; V210-L444 WeakPolarHBondContact O-CD1 3.34Å; V210-F448 HydrophobicContact CG1-CE1 4.05Å; V210-F448 HydrophobicContact CG1-CZ 4.29Å; V210-F448 HydrophobicContact CG2-CD1 3.77Å; V210-F448 HydrophobicContact CG2-CE1 3.74Å; V210-F448 HydrophobicContact CG2-CG 4.43Å; V210-F448 HydrophobicContact CG2-CZ 4.41Å; V210-F451 HydrophobicContact CG2-CE2 4Å; V210-F451 HydrophobicContact CG2-CZ 4.26Å; V210-I469 HydrophobicContact CB-CD1 4.27Å; V210-I469 HydrophobicContact CG1-CD1 3.86Å; V210-I469 HydrophobicContact CG1-CG1 4.3Å; V210-I469 HydrophobicContact CG1-CG2 4.29Å
211V96.5Very high91.6Very high0 Ų025.2 Ų25.20%013%0.133CC..Hα-helixtrans-68.2-36177.9171.40000111.7P207 L209 G213 L214 S215 I469 A472 L473 P504 A508P207-V211 WeakPolarHBondContact O-CB 3.48Å; P207-V211 VanDerWaalsContact O-CG2 3.31Å; P207-V211 WeakPolarHBondContact O-CG2 3.37Å; P207-V211 PolarHBondContact O-N 2.94Å; L209-V211 VanDerWaalsContact C-N 3.33Å; L209-V211 PolarHBondContact O-N 2.84Å; V211-G213 VanDerWaalsContact C-N 3.34Å; V211-G213 PolarHBondContact O-N 3.09Å; V211-L214 PolarHBondContact O-N 2.85Å; V211-S215 WeakPolarHBondContact O-CB 3.5Å; V211-S215 PolarHBondContact O-N 3.48Å; V211-S215 PolarHBondContact O-OG 2.98Å; V211-I469 HydrophobicContact CG2-CB 4.3Å; V211-I469 HydrophobicContact CG2-CG1 4.29Å; V211-I469 HydrophobicContact CG2-CG2 4.08Å; V211-A472 HydrophobicContact CG1-CB 4.05Å; V211-A472 HydrophobicContact CG2-CB 3.94Å; V211-L473 HydrophobicContact CG1-CD2 4.26Å; V211-P504 HydrophobicContact CG1-CB 3.65Å; V211-A508 HydrophobicContact CB-CB 3.9Å; V211-A508 HydrophobicContact CG1-CB 4.17Å; V211-A508 HydrophobicContact CG2-CB 3.85Å
212A93.3Very high91.6Very high2 Ų230 Ų302%0.01715%0.154CC..Hα-helixtrans-56.9-48.1174.100000111.4S208 L209 S215 F387 V443 I505S208-A212 WeakPolarHBondContact O-CB 3.31Å; S208-A212 PolarHBondContact O-N 3.43Å; L209-A212 WeakPolarHBondContact O-CB 3.18Å; L209-A212 PolarHBondContact O-N 3.45Å; A212-S215 PolarHBondContact O-OG 3.05Å; A212-S215 VanDerWaalsContact O-OG 3.13Å; A212-F387 HydrophobicContact CB-CD2 3.92Å; A212-F387 HydrophobicContact CB-CE2 3.77Å; A212-F387 HydrophobicContact CB-CG 4.33Å; A212-F387 HydrophobicContact CB-CZ 4.11Å; A212-V443 HydrophobicContact CB-CG1 4.39Å; A212-I505 HydrophobicContact CB-CD1 3.7Å; A212-I505 HydrophobicContact CB-CG1 3.88Å
213G92.2Very high91.4Very high8 Ų829.8 Ų29.88%0.08215%0.152CC..Hα-helixtrans-69.1-43.3176.800000113.7L209 V210 V211L209-G213 PolarHBondContact O-N 3.02Å; L209-G213 VanDerWaalsContact O-N 3.08Å; V210-G213 PolarHBondContact O-N 3.45Å; V211-G213 VanDerWaalsContact C-N 3.34Å; V211-G213 PolarHBondContact O-N 3.09Å
214L93.6Very high91.4Very high60 Ų6030 Ų3031%0.31415%0.154SC..Hα-helixtrans-69.4-35.9-179.8-73.8175000112.8V210 V211 A216 H217 L444 L473V210-L214 HydrophobicContact CG1-CD1 3.76Å; V210-L214 HydrophobicContact CG1-CG 4.42Å; V210-L214 WeakPolarHBondContact O-CB 3.13Å; V210-L214 WeakPolarHBondContact O-CG 3.22Å; V210-L214 PolarHBondContact O-N 3.39Å; V211-L214 PolarHBondContact O-N 2.85Å; L214-A216 PolarHBondContact O-N 3.07Å; L214-H217 WeakPolarHBondContact O-CB 2.98Å; L214-H217 PolarHBondContact O-N 3.21Å; L214-H217 PolarHBondContact O-ND1 2.92Å; L214-L444 HydrophobicContact CD1-CD1 4.4Å; L214-L444 HydrophobicContact CD2-CD1 4.36Å; L214-L444 HydrophobicContact CD2-CD2 3.86Å; L214-L444 HydrophobicContact CG-CD1 3.9Å; L214-L444 HydrophobicContact CG-CD2 4.24Å; L214-L473 HydrophobicContact CB-CD2 4.28Å; L214-L473 HydrophobicContact CD1-CD1 4Å
215S90.7Very high91.2Very high26 Ų2632.9 Ų32.918%0.18217%0.174CC..Hα-helixtrans-65.5-24.7-173.463.50000114V211 A212 H217V211-S215 WeakPolarHBondContact O-CB 3.5Å; V211-S215 PolarHBondContact O-N 3.48Å; V211-S215 PolarHBondContact O-OG 2.98Å; A212-S215 PolarHBondContact O-OG 3.05Å; A212-S215 VanDerWaalsContact O-OG 3.13Å; S215-H217 VanDerWaalsContact C-N 3.32Å; S215-H217 PolarHBondContact O-N 2.96Å
216A86.3Confident91Very high6 Ų633 Ų335%0.0518%0.18CC..THydrogen-bonded Turntrans-82.4-1.9-179.500000114.5L214 R218 E219 V220 Q440L214-A216 PolarHBondContact O-N 3.07Å; A216-R218 VanDerWaalsContact C-N 3.29Å; A216-R218 PolarHBondContact O-N 3.5Å; A216-E219 WeakPolarHBondContact CA-OE2 3.2Å; A216-E219 PolarHBondContact O-N 3.2Å; A216-V220 WeakPolarHBondContact O-CB 3.21Å; A216-V220 VanDerWaalsContact O-CG2 3.28Å; A216-V220 WeakPolarHBondContact O-CG2 3.31Å; A216-V220 PolarHBondContact O-N 2.9Å; A216-Q440 HydrophobicContact CB-CG 4.07Å
217H88.8Confident90.9Very high131 Ų13136.2 Ų36.261%0.60620%0.195SC*.Hα-helixtrans-60-36.3-172.871.6-81.2000113.5L214 S215 A221L214-H217 WeakPolarHBondContact O-CB 2.98Å; L214-H217 PolarHBondContact O-N 3.21Å; L214-H217 PolarHBondContact O-ND1 2.92Å; S215-H217 VanDerWaalsContact C-N 3.32Å; S215-H217 PolarHBondContact O-N 2.96Å; H217-A221 VanDerWaalsContact O-CB 3.28Å; H217-A221 WeakPolarHBondContact O-CB 3.42Å; H217-A221 PolarHBondContact O-N 3.08Å
218R85.8Confident90.7Very high133 Ų13343.2 Ų43.250%0.50222%0.221SC..Hα-helixtrans-69.1-46-176.9177179.1172.9166.9-1.5110.7A216 A221 Q222A216-R218 VanDerWaalsContact C-N 3.29Å; A216-R218 PolarHBondContact O-N 3.5Å; R218-A221 PolarHBondContact O-N 3.29Å; R218-Q222 WeakPolarHBondContact O-CB 3.28Å; R218-Q222 PolarHBondContact O-N 3.26Å
219E83.8Confident90.6Very high30 Ų3045.5 Ų45.514%0.1425%0.247CC..Hα-helixtrans-65.3-45.8179.7-6471.7-16000109.5L69 A216 A221 Q222 F223 R480L69-E219 HydrophobicContact CD1-CG 4.3Å; A216-E219 WeakPolarHBondContact CA-OE2 3.2Å; A216-E219 PolarHBondContact O-N 3.2Å; E219-A221 PolarHBondContact O-N 3.5Å; E219-Q222 PolarHBondContact O-N 2.85Å; E219-F223 HydrophobicContact CB-CE2 4.17Å; E219-F223 WeakPolarHBondContact O-CD2 3.35Å; E219-F223 WeakPolarHBondContact O-CE2 3.2Å; E219-F223 PolarHBondContact O-N 3.32Å; E219-F223 VanDerWaalsContact O-N 3.1Å; E219-R480 IonicContact OE1-NH1 2.73Å
220V89.6Confident90.5Very high24 Ų2446 Ų4615%0.14525%0.249CC..Hα-helixtrans-56.5-48.4173.5169.90000111.3A216 Q222 F223 C224 L436A216-V220 WeakPolarHBondContact O-CB 3.21Å; A216-V220 VanDerWaalsContact O-CG2 3.28Å; A216-V220 WeakPolarHBondContact O-CG2 3.31Å; A216-V220 PolarHBondContact O-N 2.9Å; V220-Q222 VanDerWaalsContact C-N 3.31Å; V220-Q222 PolarHBondContact O-N 3.41Å; V220-F223 PolarHBondContact O-N 3.5Å; V220-C224 WeakPolarHBondContact O-CB 3.42Å; V220-C224 PolarHBondContact O-N 2.97Å; V220-C224 PolarHBondContact O-SG 3.42Å; V220-L436 HydrophobicContact CG2-CB 4.1Å
221A90.3Very high90.4Very high43 Ų4345.9 Ų45.936%0.35525%0.248SC..Hα-helixtrans-62.2-38.5178.900000112.4H217 R218 E219 F223 C224 S225H217-A221 VanDerWaalsContact O-CB 3.28Å; H217-A221 WeakPolarHBondContact O-CB 3.42Å; H217-A221 PolarHBondContact O-N 3.08Å; R218-A221 PolarHBondContact O-N 3.29Å; E219-A221 PolarHBondContact O-N 3.5Å; A221-F223 VanDerWaalsContact C-N 3.33Å; A221-F223 PolarHBondContact O-N 3.13Å; A221-C224 PolarHBondContact O-N 3.19Å; A221-S225 VanDerWaalsContact O-CB 3.3Å; A221-S225 WeakPolarHBondContact O-CB 3.44Å; A221-S225 PolarHBondContact O-N 3.02Å; A221-S225 PolarHBondContact O-OG 2.99Å
222Q87.5Confident90.4Very high102 Ų10251 Ų5148%0.47728%0.275SS..Hα-helixtrans-65.4-33.3177.6-176.4174.7-12.700112.8R218 E219 V220 S225R218-Q222 WeakPolarHBondContact O-CB 3.28Å; R218-Q222 PolarHBondContact O-N 3.26Å; E219-Q222 PolarHBondContact O-N 2.85Å; V220-Q222 VanDerWaalsContact C-N 3.31Å; V220-Q222 PolarHBondContact O-N 3.41Å; Q222-S225 PolarHBondContact O-OG 3.43Å
223F86.1Confident90.5Very high8 Ų854.3 Ų54.34%0.03529%0.292CS..Hα-helixtrans-80.9-39.3176.3-62.2-51.9000112.6V65 L69 E219 V220 A221 S225 A226 L429V65-F223 HydrophobicContact CB-CE2 3.93Å; V65-F223 HydrophobicContact CB-CZ 3.95Å; V65-F223 HydrophobicContact CG1-CE2 3.4Å; V65-F223 HydrophobicContact CG1-CZ 3.54Å; V65-F223 HydrophobicContact CG2-CD2 3.8Å; V65-F223 HydrophobicContact CG2-CE1 4.12Å; V65-F223 HydrophobicContact CG2-CE2 3.28Å; V65-F223 HydrophobicContact CG2-CG 4.45Å; V65-F223 HydrophobicContact CG2-CZ 3.49Å; V65-F223 VanDerWaalsContact CG2-CZ 3.49Å; L69-F223 HydrophobicContact CD1-CZ 4.34Å; L69-F223 HydrophobicContact CD2-CZ 4.43Å; L69-F223 HydrophobicContact CG-CZ 4.31Å; E219-F223 HydrophobicContact CB-CE2 4.17Å; E219-F223 WeakPolarHBondContact O-CD2 3.35Å; E219-F223 WeakPolarHBondContact O-CE2 3.2Å; E219-F223 PolarHBondContact O-N 3.32Å; E219-F223 VanDerWaalsContact O-N 3.1Å; V220-F223 PolarHBondContact O-N 3.5Å; A221-F223 VanDerWaalsContact C-N 3.33Å; A221-F223 PolarHBondContact O-N 3.13Å; F223-S225 PolarHBondContact O-N 3.15Å; F223-A226 WeakPolarHBondContact O-CB 3.06Å; F223-A226 PolarHBondContact O-N 3.14Å; F223-L429 HydrophobicContact CD1-CB 4.48Å; F223-L429 HydrophobicContact CD1-CD2 3.97Å; F223-L429 HydrophobicContact CD1-CG 4.15Å; F223-L429 HydrophobicContact CE1-CD2 4.43Å
224C90.9Very high90.6Very high4 Ų454 Ų543%0.02729%0.288CS..Hα-helixtrans-63.8-32.2174.9-68.50000112.2V220 A221 A226 H227 W228 A231V220-C224 WeakPolarHBondContact O-CB 3.42Å; V220-C224 PolarHBondContact O-N 2.97Å; V220-C224 PolarHBondContact O-SG 3.42Å; A221-C224 PolarHBondContact O-N 3.19Å; C224-A226 PolarHBondContact O-N 3.21Å; C224-H227 CarbonylContact O-C 3.58Å; C224-H227 VanDerWaalsContact O-C 3.24Å; C224-H227 PolarHBondContact O-N 3.19Å; C224-W228 HydrophobicContact CB-CE3 3.91Å; C224-W228 HydrophobicContact CB-CH2 3.91Å; C224-W228 HydrophobicContact CB-CZ3 3.57Å; C224-W228 PolarHBondContact O-N 2.83Å; C224-A231 HydrophobicContact CB-CB 3.86Å
225S90.3Very high90.7Very high66 Ų6653.6 Ų53.646%0.46229%0.286SS..THydrogen-bonded Turntrans-66.9-14.5-179.170.90000114.4A221 Q222 F223 H227A221-S225 VanDerWaalsContact O-CB 3.3Å; A221-S225 WeakPolarHBondContact O-CB 3.44Å; A221-S225 PolarHBondContact O-N 3.02Å; A221-S225 PolarHBondContact O-OG 2.99Å; Q222-S225 PolarHBondContact O-OG 3.43Å; F223-S225 PolarHBondContact O-N 3.15Å; S225-H227 VanDerWaalsContact C-N 3.34Å
226A88.4Confident91Very high35 Ų3557.7 Ų57.729%0.28931%0.305SS..THydrogen-bonded Turntrans-60-44.2171.600000111.4F223 C224 L429 P430F223-A226 WeakPolarHBondContact O-CB 3.06Å; F223-A226 PolarHBondContact O-N 3.14Å; C224-A226 PolarHBondContact O-N 3.21Å; A226-L429 HydrophobicContact CB-CB 4.3Å; A226-P430 HydrophobicContact CB-CG 3.92Å
227H91.1Very high91.4Very high69 Ų6959.7 Ų59.732%0.31932%0.315SS..  trans-157.698.4170-72.1-67.9000111.2C224 S225 G229 L230 A231 V293 P430C224-H227 CarbonylContact O-C 3.58Å; C224-H227 VanDerWaalsContact O-C 3.24Å; C224-H227 PolarHBondContact O-N 3.19Å; S225-H227 VanDerWaalsContact C-N 3.34Å; H227-G229 VanDerWaalsContact C-N 3.25Å; H227-G229 PolarHBondContact O-N 3.12Å; H227-L230 HydrophobicContact CB-CB 4.37Å; H227-L230 HydrophobicContact CB-CD1 4.25Å; H227-L230 HydrophobicContact CB-CG 4.42Å; H227-L230 PolarHBondContact O-N 3.33Å; H227-A231 PolarHBondContact O-N 3.39Å; H227-A231 VanDerWaalsContact O-N 3.12Å; H227-V293 VanDerWaalsContact CD2-CG2 3.48Å; H227-V293 WeakPolarHBondContact CD2-CG2 3.46Å; H227-V293 WeakPolarHBondContact NE2-CG2 3.34Å; H227-P430 HydrophobicContact CB-CB 4.47Å; H227-P430 HydrophobicContact CB-CG 3.79Å
228W92.6Very high91.7Very high146 Ų14653.5 Ų53.555%0.55329%0.286SS*.Hα-helixtrans-57.1-34-179.8-72.5106.6000114.1C224 A231 L232C224-W228 HydrophobicContact CB-CE3 3.91Å; C224-W228 HydrophobicContact CB-CH2 3.91Å; C224-W228 HydrophobicContact CB-CZ3 3.57Å; C224-W228 PolarHBondContact O-N 2.83Å; W228-A231 PolarHBondContact O-N 2.98Å; W228-L232 VanDerWaalsContact O-CB 3.3Å; W228-L232 WeakPolarHBondContact O-CB 3.41Å; W228-L232 VanDerWaalsContact O-CG 3.26Å; W228-L232 WeakPolarHBondContact O-CG 3.08Å; W228-L232 PolarHBondContact O-N 3.19Å
229G93.9Very high92Very high57 Ų5749.7 Ų49.759%0.58828%0.278SS*.Hα-helixtrans-62-45.8178.200000113.1H227 L233H227-G229 VanDerWaalsContact C-N 3.25Å; H227-G229 PolarHBondContact O-N 3.12Å; G229-L233 VanDerWaalsContact O-CB 3.31Å; G229-L233 WeakPolarHBondContact O-CB 2.89Å; G229-L233 PolarHBondContact O-N 3.27Å
230L92.8Very high92.4Very high14 Ų1450.5 Ų50.57%0.07329%0.285CS..Hα-helixtrans-69.7-38.9176.8-68.6175.5000111.6H227 L233 V234 V282 F291 P430H227-L230 HydrophobicContact CB-CB 4.37Å; H227-L230 HydrophobicContact CB-CD1 4.25Å; H227-L230 HydrophobicContact CB-CG 4.42Å; H227-L230 PolarHBondContact O-N 3.33Å; L230-L233 PolarHBondContact O-N 3.3Å; L230-V234 PolarHBondContact O-N 2.94Å; L230-V282 HydrophobicContact CB-CG1 4.37Å; L230-V282 HydrophobicContact CD2-CG1 4.04Å; L230-F291 HydrophobicContact CD1-CB 4.27Å; L230-P430 HydrophobicContact CB-CB 4.02Å; L230-P430 HydrophobicContact CB-CG 4.5Å
231A94.2Very high92.5Very high0 Ų049.5 Ų49.50%028%0.279CS..Hα-helixtrans-62.1-48.1175.700000111.7C224 H227 W228 L233 V234 I235 P430C224-A231 HydrophobicContact CB-CB 3.86Å; H227-A231 PolarHBondContact O-N 3.39Å; H227-A231 VanDerWaalsContact O-N 3.12Å; W228-A231 PolarHBondContact O-N 2.98Å; A231-L233 VanDerWaalsContact C-N 3.32Å; A231-L233 PolarHBondContact O-N 3.11Å; A231-V234 WeakPolarHBondContact O-CG1 3.38Å; A231-V234 PolarHBondContact O-N 3.4Å; A231-I235 WeakPolarHBondContact O-CB 3.38Å; A231-I235 WeakPolarHBondContact O-CD1 3.47Å; A231-I235 WeakPolarHBondContact O-CG1 3Å; A231-I235 PolarHBondContact O-N 3.25Å; A231-P430 HydrophobicContact CB-CB 4.07Å
232L95.8Very high92.5Very high106 Ų10647.7 Ų47.756%0.55526%0.264SS*.Hα-helixtrans-63-39.4176.5-74.2171.3000111.6W228 I235 L236W228-L232 VanDerWaalsContact O-CB 3.3Å; W228-L232 WeakPolarHBondContact O-CB 3.41Å; W228-L232 VanDerWaalsContact O-CG 3.26Å; W228-L232 WeakPolarHBondContact O-CG 3.08Å; W228-L232 PolarHBondContact O-N 3.19Å; L232-I235 PolarHBondContact O-N 3.11Å; L232-L236 VanDerWaalsContact O-CB 3.25Å; L232-L236 WeakPolarHBondContact O-CB 3.29Å; L232-L236 PolarHBondContact O-N 2.98Å
233L95.6Very high92.6Very high73 Ų7348.8 Ų48.838%0.38227%0.269SS..Hα-helixtrans-60.8-47.4177.2-178.264.2000111.8G229 L230 A231 L237 V282G229-L233 VanDerWaalsContact O-CB 3.31Å; G229-L233 WeakPolarHBondContact O-CB 2.89Å; G229-L233 PolarHBondContact O-N 3.27Å; L230-L233 PolarHBondContact O-N 3.3Å; A231-L233 VanDerWaalsContact C-N 3.32Å; A231-L233 PolarHBondContact O-N 3.11Å; L233-L237 VanDerWaalsContact O-CB 3.27Å; L233-L237 WeakPolarHBondContact O-CB 3.15Å; L233-L237 PolarHBondContact O-N 3.31Å; L233-V282 HydrophobicContact CB-CG2 4.41Å; L233-V282 HydrophobicContact CD2-CG1 4.43Å; L233-V282 HydrophobicContact CD2-CG2 3.88Å; L233-V282 HydrophobicContact CG-CG2 3.81Å
234V95.6Very high92.7Very high0 Ų054.8 Ų54.80%030%0.297CS..Hα-helixtrans-66.2-41.1178.268.10000111.3L230 A231 L237 M238 P278 V282 V431 V435L230-V234 PolarHBondContact O-N 2.94Å; A231-V234 WeakPolarHBondContact O-CG1 3.38Å; A231-V234 PolarHBondContact O-N 3.4Å; V234-L237 PolarHBondContact O-N 2.94Å; V234-M238 HydrophobicContact CG2-CG 4.27Å; V234-M238 WeakPolarHBondContact O-CB 3.15Å; V234-M238 WeakPolarHBondContact O-CG 3.32Å; V234-M238 PolarHBondContact O-N 3.16Å; V234-P278 HydrophobicContact CG2-CB 4.05Å; V234-V282 HydrophobicContact CB-CB 4.38Å; V234-V282 HydrophobicContact CB-CG2 3.92Å; V234-V282 HydrophobicContact CG2-CG2 4.44Å; V234-V431 HydrophobicContact CG2-CG1 4.32Å; V234-V435 HydrophobicContact CG2-CG2 4.45Å
235I95.8Very high92.4Very high53 Ų5357.5 Ų57.527%0.27231%0.31SS..Hα-helixtrans-62.1-49.9178.7-68.8165.5000110.2A231 L232 L237 M238 V239 V438A231-I235 WeakPolarHBondContact O-CB 3.38Å; A231-I235 WeakPolarHBondContact O-CD1 3.47Å; A231-I235 WeakPolarHBondContact O-CG1 3Å; A231-I235 PolarHBondContact O-N 3.25Å; L232-I235 PolarHBondContact O-N 3.11Å; I235-L237 VanDerWaalsContact C-N 3.32Å; I235-L237 PolarHBondContact O-N 3.03Å; I235-M238 PolarHBondContact O-N 2.95Å; I235-V239 WeakPolarHBondContact O-CG2 3.34Å; I235-V239 PolarHBondContact O-N 3.33Å; I235-V438 HydrophobicContact CB-CG2 4.35Å; I235-V438 HydrophobicContact CG1-CG2 4.07Å; I235-V438 HydrophobicContact CG2-CG2 3.98Å
236L96Very high91.8Very high111 Ų11154.4 Ų54.458%0.58129%0.289SS*.Hα-helixtrans-58.2-46.9178.5-17871.5000110.7L232 M238 V239 V240L232-L236 VanDerWaalsContact O-CB 3.25Å; L232-L236 WeakPolarHBondContact O-CB 3.29Å; L232-L236 PolarHBondContact O-N 2.98Å; L236-M238 VanDerWaalsContact C-N 3.35Å; L236-M238 PolarHBondContact O-N 3.22Å; L236-V239 PolarHBondContact O-N 2.05Å; L236-V240 HydrophobicContact CD1-CG2 4.49Å; L236-V240 HydrophobicContact CG-CG2 4.42Å; L236-V240 WeakPolarHBondContact O-CB 3.45Å; L236-V240 VanDerWaalsContact O-CG2 3.29Å; L236-V240 WeakPolarHBondContact O-CG2 3.16Å; L236-V240 PolarHBondContact O-N 2.96Å
237L95.1Very high91.1Very high48 Ų4856.9 Ų56.925%0.25130%0.304SS..Hα-helixtrans-66.9-36.3-178.7-171.257.4000111.7L233 V234 I235 V240 C241 P278 C281L233-L237 VanDerWaalsContact O-CB 3.27Å; L233-L237 WeakPolarHBondContact O-CB 3.15Å; L233-L237 PolarHBondContact O-N 3.31Å; V234-L237 PolarHBondContact O-N 2.94Å; I235-L237 VanDerWaalsContact C-N 3.32Å; I235-L237 PolarHBondContact O-N 3.03Å; L237-V240 PolarHBondContact O-N 2.98Å; L237-C241 WeakPolarHBondContact O-CB 3.3Å; L237-C241 PolarHBondContact O-N 3.37Å; L237-C241 PolarHBondContact O-SG 3.11Å; L237-P278 HydrophobicContact CB-CB 3.94Å; L237-P278 HydrophobicContact CB-CG 4.28Å; L237-P278 HydrophobicContact CD2-CB 3.92Å; L237-P278 HydrophobicContact CD2-CG 4.44Å; L237-P278 HydrophobicContact CG-CB 3.77Å; L237-P278 HydrophobicContact CG-CG 3.89Å; L237-C281 HydrophobicContact CD2-CB 3.77Å
238M94.3Very high90.2Very high1 Ų156 Ų561%0.00531%0.306CS..Hα-helixtrans-62.2-44.7171.1-63.1-121.5-47.700112.3V234 I235 L236 S242 V275 P278 L395 V435 V438V234-M238 HydrophobicContact CG2-CG 4.27Å; V234-M238 WeakPolarHBondContact O-CB 3.15Å; V234-M238 WeakPolarHBondContact O-CG 3.32Å; V234-M238 PolarHBondContact O-N 3.16Å; I235-M238 PolarHBondContact O-N 2.95Å; L236-M238 VanDerWaalsContact C-N 3.35Å; L236-M238 PolarHBondContact O-N 3.22Å; M238-S242 VanDerWaalsContact O-CB 3.3Å; M238-S242 WeakPolarHBondContact O-CB 3.28Å; M238-S242 PolarHBondContact O-N 3.37Å; M238-S242 PolarHBondContact O-OG 3.07Å; M238-V275 HydrophobicContact CE-CG2 4.06Å; M238-V275 HydrophobicContact SD-CB 3.91Å; M238-V275 HydrophobicContact SD-CG1 3.88Å; M238-V275 HydrophobicContact SD-CG2 3.71Å; M238-P278 HydrophobicContact CB-CG 4.37Å; M238-P278 HydrophobicContact CG-CB 3.85Å; M238-P278 HydrophobicContact CG-CG 3.88Å; M238-L395 HydrophobicContact CE-CD1 4.24Å; M238-V435 HydrophobicContact SD-CG2 4.33Å; M238-V438 HydrophobicContact CE-CB 3.36Å; M238-V438 HydrophobicContact CE-CG1 3.35Å; M238-V438 HydrophobicContact CE-CG2 3.85Å
239V92.7Very high89.1Confident54 Ų5453.8 Ų53.833%0.32730%0.302SS..Hα-helixtrans-64.7-44.1178.1172.60000110.4I235 L236 S242 Q243I235-V239 WeakPolarHBondContact O-CG2 3.34Å; I235-V239 PolarHBondContact O-N 3.33Å; L236-V239 PolarHBondContact O-N 2.05Å; V239-S242 PolarHBondContact O-N 3.39Å; V239-S242 PolarHBondContact O-OG 3.2Å; V239-Q243 HydrophobicContact CG1-CB 4.48Å; V239-Q243 HydrophobicContact CG1-CG 4.18Å; V239-Q243 WeakPolarHBondContact O-CA 3.26Å; V239-Q243 VanDerWaalsContact O-CB 3.29Å; V239-Q243 WeakPolarHBondContact O-CB 3.2Å; V239-Q243 PolarHBondContact O-N 3.41Å
240V93Very high87.6Confident46 Ų4656.8 Ų56.828%0.27930%0.299SS..Iπ-helixtrans-62.7-47.9176.7172.40000111.4L236 L237 S242 H244 L245L236-V240 HydrophobicContact CD1-CG2 4.49Å; L236-V240 HydrophobicContact CG-CG2 4.42Å; L236-V240 WeakPolarHBondContact O-CB 3.45Å; L236-V240 VanDerWaalsContact O-CG2 3.29Å; L236-V240 WeakPolarHBondContact O-CG2 3.16Å; L236-V240 PolarHBondContact O-N 2.96Å; L237-V240 PolarHBondContact O-N 2.98Å; V240-S242 PolarHBondContact O-N 2.83Å; V240-H244 PolarHBondContact O-N 2.89Å; V240-L245 HydrophobicContact CG1-CD1 3.86Å; V240-L245 HydrophobicContact CG1-CG 4.05Å; V240-L245 PolarHBondContact O-N 2.66Å
241C91.1Very high85.8Confident3 Ų362.4 Ų62.42%0.0232%0.324CS..Iπ-helixtrans-64.6-40.6178.9-71.20000112.8L237 G246 F270L237-C241 WeakPolarHBondContact O-CB 3.3Å; L237-C241 PolarHBondContact O-N 3.37Å; L237-C241 PolarHBondContact O-SG 3.11Å; C241-G246 PolarHBondContact O-N 3.34Å; C241-F270 CarbonylContact O-C 3.57Å
242S90.1Very high83.9Confident6 Ų667.4 Ų67.44%0.04235%0.354CS..Iπ-helixtrans-81.2-46.9-177.160.20000113.7M238 V239 V240 G246M238-S242 VanDerWaalsContact O-CB 3.3Å; M238-S242 WeakPolarHBondContact O-CB 3.28Å; M238-S242 PolarHBondContact O-N 3.37Å; M238-S242 PolarHBondContact O-OG 3.07Å; V239-S242 PolarHBondContact O-N 3.39Å; V239-S242 PolarHBondContact O-OG 3.2Å; V240-S242 PolarHBondContact O-N 2.83Å; S242-G246 WeakPolarHBondContact O-CA 3.37Å
243Q89.1Confident81.5Confident125 Ų12567.6 Ų67.658%0.58436%0.363SS*.Iπ-helixtrans-96.3-44.5-169.8-51.9-51.9-51.800112.9V239V239-Q243 HydrophobicContact CG1-CB 4.48Å; V239-Q243 HydrophobicContact CG1-CG 4.18Å; V239-Q243 WeakPolarHBondContact O-CA 3.26Å; V239-Q243 VanDerWaalsContact O-CB 3.29Å; V239-Q243 WeakPolarHBondContact O-CB 3.2Å; V239-Q243 PolarHBondContact O-N 3.41Å
244H88Confident79.3Confident134 Ų13468.1 Ų68.162%0.6237%0.371SS*.Iπ-helixtrans-88.7-43.9-173.4-67.6-72.9000112.9V240V240-H244 PolarHBondContact O-N 2.89Å
245L85.2Confident76.8Confident60 Ų6080.8 Ų80.831%0.31442%0.419SS..SBendtrans-94.32.2178.4-60.5176.9000112.4V240 S247 S248 F270V240-L245 HydrophobicContact CG1-CD1 3.86Å; V240-L245 HydrophobicContact CG1-CG 4.05Å; V240-L245 PolarHBondContact O-N 2.66Å; L245-S247 PolarHBondContact O-N 3.47Å; L245-S247 VanDerWaalsContact O-N 3.16Å; L245-S248 WeakPolarHBondContact O-CB 3.18Å; L245-S248 PolarHBondContact O-N 2.88Å; L245-F270 HydrophobicContact CB-CB 3.99Å; L245-F270 HydrophobicContact CB-CD2 4.21Å; L245-F270 HydrophobicContact CB-CG 4.07Å; L245-F270 HydrophobicContact CD1-CD1 4.34Å; L245-F270 HydrophobicContact CD1-CE1 4.47Å; L245-F270 HydrophobicContact CD1-CG 4.44Å
246G77Confident74.1Confident1 Ų188 Ų881%0.0144%0.443CS..THydrogen-bonded Turntrans-66.6-16.9-17400000114.8C241 S242 R271C241-G246 PolarHBondContact O-N 3.34Å; S242-G246 WeakPolarHBondContact O-CA 3.37Å; G246-R271 PolarHBondContact O-NE 3.15Å; G246-R271 PolarHBondContact O-NH2 3.39Å
247S74Confident71.8Confident88 Ų8894.5 Ų94.562%0.61546%0.46SS*.THydrogen-bonded Turntrans-96.8-11.1173.7570000113.3L245 Q249L245-S247 PolarHBondContact O-N 3.47Å; L245-S247 VanDerWaalsContact O-N 3.16Å; S247-Q249 PolarHBondContact O-N 3.28Å
248S72.4Confident69.4Low50 Ų5097.4 Ų97.435%0.3548%0.48SS..  trans-71.9111.7-179.5-64.40000109.8L245L245-S248 WeakPolarHBondContact O-CB 3.18Å; L245-S248 PolarHBondContact O-N 2.88Å
249Q70.3Confident66.7Low99 Ų99103.3 Ų103.346%0.46352%0.521SS..  trans-84.5123.2178.9-66.4178.4-0.800109.6S247 P266S247-Q249 PolarHBondContact O-N 3.28Å; Q249-P266 HydrophobicContact CB-CB 3.94Å; Q249-P266 HydrophobicContact CG-CB 4.07Å
250F61.8Low64.5Low121 Ų121105.5 Ų105.553%0.53155%0.545SS..BIsolated β-bridgetrans-98.6128.6173.9-120.4-91000109.7V252 L267 A269 F270F250-V252 PolarHBondContact O-N 2.88Å; F250-L267 PolarHBondContact N-O 3.4Å; F250-A269 HydrophobicContact CB-CB 4.34Å; F250-F270 HydrophobicContact CD2-CD2 4.44Å; F250-F270 AromaticContact CD2-CE2 3.69Å; F250-F270 HydrophobicContact CD2-CE2 3.69Å; F250-F270 HydrophobicContact CD2-CZ 4.45Å; F250-F270 AromaticContact CE2-CE2 3.75Å; F250-F270 HydrophobicContact CE2-CE2 3.75Å; F250-F270 HydrophobicContact CE2-CZ 4.2Å
251H55.8Low62.2Low132 Ų132108.7 Ų108.761%0.61157%0.569SS**  trans-81.6100174.4-66.982.8000108.2C253H251-C253 PolarHBondContact O-N 3.3Å
252V54.3Low59.8Low104 Ų104112.4 Ų112.463%0.6360%0.595SS**  trans-68.9115.6175.5-175.30000108.1F250F250-V252 PolarHBondContact O-N 2.88Å
253C45.1Very low57.6Low110 Ų110117.9 Ų117.974%0.74363%0.629SS**  trans-67.8125.1174.7-69.70000109.3H251 W255H251-C253 PolarHBondContact O-N 3.3Å; C253-W255 PolarHBondContact O-N 3.46Å
254P47.8Very low55.6Low85 Ų85118.3 Ų118.355%0.55263%0.63SS**  trans-66.4119.4177.524.3-30.2000109.9R256P254-R256 PolarHBondContact O-N 2.94Å; P254-R256 VanDerWaalsContact O-N 3.11Å
255W43.2Very low54.1Low265 Ų265116.8 Ų116.8100%1.00463%0.631SS**SBendtrans-69.20.9176.3-172.6-76.9000113C253C253-W255 PolarHBondContact O-N 3.46Å
256R40.7Very low53Low205 Ų205116.8 Ų116.877%0.77463%0.634SS**  trans-135.5110.6178.2-169.1174.2-89.4-102.63111.6P254 T258P254-R256 PolarHBondContact O-N 2.94Å; P254-R256 VanDerWaalsContact O-N 3.11Å; R256-T258 PolarHBondContact O-N 3.38Å
257R46.1Very low52.7Low248 Ų248118.4 Ų118.494%0.93664%0.642SS**  trans-74.191.7165-72.2-174.8-150.71676.3108.9
258T45Very low53Low109 Ų109115.8 Ų115.867%0.66962%0.623SS**  trans-157.8121.2153.6380000110.9R256R256-T258 PolarHBondContact O-N 3.38Å
259S37.8Very low53.5Low124 Ų124114.6 Ų114.687%0.86762%0.617SS**  trans86.6130162.1-141.90000119S261S259-S261 PolarHBondContact O-N 2.65Å
260A46Very low54.1Low101 Ų101112.4 Ų112.484%0.83561%0.606SS**SBendtrans-83.896.6-163.300000112.2
261S45.6Very low55.2Low112 Ų112109 Ų10978%0.78359%0.59SS**  trans174.961140.7700000108.5S259 T263S259-S261 PolarHBondContact O-N 2.65Å; S261-T263 PolarHBondContact O-N 3.49Å
262S40.5Very low56.7Low81 Ų81103 Ų10357%0.56656%0.562SS**  trans-86.694.1174.7-167.50000108.3H264S262-H264 PolarHBondContact O-CD2 3.07Å; S262-H264 PolarHBondContact O-N 3.25Å; S262-H264 VanDerWaalsContact O-N 3.07Å
263T43.2Very low58.4Low122 Ų12299.1 Ų99.175%0.74854%0.537SS*.  trans-62.2107.816445.70000107.6S261 T265S261-T263 PolarHBondContact O-N 3.49Å; T263-T265 PolarHBondContact O-N 3.07Å
264H46.8Very low60.6Low133 Ų13393.9 Ų93.962%0.61650%0.502SS*.  trans-64.4102176.4-69.3-87.3000109.3S262 P266S262-H264 PolarHBondContact O-CD2 3.07Å; S262-H264 PolarHBondContact O-N 3.25Å; S262-H264 VanDerWaalsContact O-N 3.07Å; H264-P266 WeakPolarHBondContact O-CD 3.1Å
265T57Low62.7Low103 Ų10389.8 Ų89.863%0.63248%0.476SS*.  trans-88.1114.2170.748.40000108.8T263 L267T263-T265 PolarHBondContact O-N 3.07Å; T265-L267 PolarHBondContact O-N 3.41Å
266P63.5Low65.1Low60 Ų6078.2 Ų78.239%0.3943%0.433SS..  trans-66.4128.9176.725.5-31.9000110.1Q249 H264Q249-P266 HydrophobicContact CB-CB 3.94Å; Q249-P266 HydrophobicContact CG-CB 4.07Å; H264-P266 WeakPolarHBondContact O-CD 3.1Å
267L70.5Confident67.6Low34 Ų3470.8 Ų70.818%0.17841%0.408CS..BIsolated β-bridgetrans-110.9128.7-178.7-78.8149.5000110.2L47 F250 T265 A269 L272L47-L267 HydrophobicContact CD2-CD2 3.91Å; F250-L267 PolarHBondContact N-O 3.4Å; T265-L267 PolarHBondContact O-N 3.41Å; L267-A269 VanDerWaalsContact C-N 3.26Å; L267-A269 PolarHBondContact O-N 3.04Å; L267-L272 HydrophobicContact CD2-CD1 4.25Å
268P80.2Confident69.9Low33 Ų3359 Ų5921%0.21436%0.364CS..  trans-78.174.3176.532.2-34.5000110.7F270 R271 L272P268-F270 VanDerWaalsContact C-N 3.34Å; P268-F270 PolarHBondContact O-N 2.89Å; P268-R271 HydrophobicContact CB-CB 4.29Å; P268-R271 PolarHBondContact O-N 2.86Å; P268-L272 HydrophobicContact CG-CD1 4.39Å; P268-L272 HydrophobicContact CG-CG 4.46Å; P268-L272 WeakPolarHBondContact O-CG 3.11Å; P268-L272 PolarHBondContact O-N 3.21Å; P268-L272 VanDerWaalsContact O-N 3.12Å
269A81.5Confident72.2Confident26 Ų2654 Ų5422%0.21533%0.333CS..Hα-helixtrans-57.8-39.7-172.100000113.7F250 L267 L272 L273F250-A269 HydrophobicContact CB-CB 4.34Å; L267-A269 VanDerWaalsContact C-N 3.26Å; L267-A269 PolarHBondContact O-N 3.04Å; A269-L272 PolarHBondContact O-N 3.08Å; A269-L273 WeakPolarHBondContact O-CB 3.42Å; A269-L273 PolarHBondContact O-N 2.85Å
270F83.3Confident74.9Confident53 Ų5349.9 Ų49.923%0.23231%0.307CS..Hα-helixtrans-66.9-36.4-180-71.5-69.7000113.4C241 L245 F250 P268 S274 I277C241-F270 CarbonylContact O-C 3.57Å; L245-F270 HydrophobicContact CB-CB 3.99Å; L245-F270 HydrophobicContact CB-CD2 4.21Å; L245-F270 HydrophobicContact CB-CG 4.07Å; L245-F270 HydrophobicContact CD1-CD1 4.34Å; L245-F270 HydrophobicContact CD1-CE1 4.47Å; L245-F270 HydrophobicContact CD1-CG 4.44Å; F250-F270 HydrophobicContact CD2-CD2 4.44Å; F250-F270 AromaticContact CD2-CE2 3.69Å; F250-F270 HydrophobicContact CD2-CE2 3.69Å; F250-F270 HydrophobicContact CD2-CZ 4.45Å; F250-F270 AromaticContact CE2-CE2 3.75Å; F250-F270 HydrophobicContact CE2-CE2 3.75Å; F250-F270 HydrophobicContact CE2-CZ 4.2Å; P268-F270 VanDerWaalsContact C-N 3.34Å; P268-F270 PolarHBondContact O-N 2.89Å; F270-S274 VanDerWaalsContact O-CA 3.27Å; F270-S274 WeakPolarHBondContact O-CA 3.45Å; F270-S274 WeakPolarHBondContact O-CB 3.42Å; F270-S274 PolarHBondContact O-N 3Å; F270-S274 VanDerWaalsContact O-N 3.13Å; F270-I277 HydrophobicContact CD1-CD1 4.03Å; F270-I277 HydrophobicContact CE1-CD1 4.37Å
271R86.1Confident77.1Confident50 Ų5047.8 Ų47.819%0.18929%0.285CS..Hα-helixtrans-67.4-50.4174.3-171.6-175.2-63.2-134.1-5110.4G246 P268 L273 S274 I396G246-R271 PolarHBondContact O-NE 3.15Å; G246-R271 PolarHBondContact O-NH2 3.39Å; P268-R271 HydrophobicContact CB-CB 4.29Å; P268-R271 PolarHBondContact O-N 2.86Å; R271-L273 VanDerWaalsContact C-N 3.33Å; R271-L273 PolarHBondContact O-N 2.95Å; R271-S274 WeakPolarHBondContact O-CB 3.31Å; R271-S274 PolarHBondContact O-N 3.48Å; R271-S274 PolarHBondContact O-OG 2.72Å; R271-I396 WeakPolarHBondContact O-CG2 3.28Å
272L86.6Confident79.4Confident6 Ų642.5 Ų42.53%0.03125%0.248CC..Hα-helixtrans-62.4-39.7-177.1-69.9169.9000112.3L47 L51 Q54 L267 P268 A269 I396 A398L47-L272 HydrophobicContact CD1-CD1 4.38Å; L47-L272 HydrophobicContact CD2-CD1 4.1Å; L51-L272 HydrophobicContact CD2-CB 4.3Å; L51-L272 WeakPolarHBondContact CD2-O 3.27Å; Q54-L272 PolarHBondContact OE1-O 3.43Å; Q54-L272 VanDerWaalsContact OE1-O 3.07Å; L267-L272 HydrophobicContact CD2-CD1 4.25Å; P268-L272 HydrophobicContact CG-CD1 4.39Å; P268-L272 HydrophobicContact CG-CG 4.46Å; P268-L272 WeakPolarHBondContact O-CG 3.11Å; P268-L272 PolarHBondContact O-N 3.21Å; P268-L272 VanDerWaalsContact O-N 3.12Å; A269-L272 PolarHBondContact O-N 3.08Å; L272-I396 WeakPolarHBondContact O-CG2 3.44Å; L272-A398 HydrophobicContact CD2-CB 3.98Å
273L89.8Confident81.7Confident21 Ų2142.2 Ų42.211%0.1124%0.235CC..THydrogen-bonded Turntrans-101.323.9-178.5-56.3179.4000113.2L50 L51 A269 R271 V275 L276 I277L50-L273 HydrophobicContact CB-CD2 3.81Å; L50-L273 HydrophobicContact CD1-CD1 4.16Å; L51-L273 HydrophobicContact CD2-CD2 4.47Å; A269-L273 WeakPolarHBondContact O-CB 3.42Å; A269-L273 PolarHBondContact O-N 2.85Å; R271-L273 VanDerWaalsContact C-N 3.33Å; R271-L273 PolarHBondContact O-N 2.95Å; L273-V275 PolarHBondContact O-N 2.99Å; L273-L276 HydrophobicContact CB-CB 4.44Å; L273-L276 HydrophobicContact CD2-CD2 4.12Å; L273-L276 PolarHBondContact O-N 3.12Å; L273-L276 VanDerWaalsContact O-N 3.11Å; L273-I277 HydrophobicContact CB-CD1 3.71Å; L273-I277 HydrophobicContact CB-CG1 3.86Å; L273-I277 HydrophobicContact CD1-CD1 4.43Å; L273-I277 PolarHBondContact O-N 2.99Å
274S91.5Very high84Confident0 Ų041 Ų410%022%0.223CC..THydrogen-bonded Turntrans-63.7-11.2-173.353.40000115.7F270 R271 P278F270-S274 VanDerWaalsContact O-CA 3.27Å; F270-S274 WeakPolarHBondContact O-CA 3.45Å; F270-S274 WeakPolarHBondContact O-CB 3.42Å; F270-S274 PolarHBondContact O-N 3Å; F270-S274 VanDerWaalsContact O-N 3.13Å; R271-S274 WeakPolarHBondContact O-CB 3.31Å; R271-S274 PolarHBondContact O-N 3.48Å; R271-S274 PolarHBondContact O-OG 2.72Å; S274-P278 WeakPolarHBondContact O-CD 3.49Å; S274-P278 WeakPolarHBondContact O-CG 3.41Å
275V92.3Very high86.1Confident0 Ų037.4 Ų37.40%021%0.21CC..THydrogen-bonded Turntrans-106.9-36.8169-176.80000111.2Q54 V58 M238 L273 P278 V279 K392 L395 V435Q54-V275 HydrophobicContact CG-CB 3.65Å; Q54-V275 HydrophobicContact CG-CG1 4.28Å; Q54-V275 HydrophobicContact CG-CG2 4.47Å; Q54-V275 VanDerWaalsContact NE2-CB 3.25Å; Q54-V275 VanDerWaalsContact NE2-N 3.13Å; V58-V275 HydrophobicContact CG2-CG1 4.07Å; M238-V275 HydrophobicContact CE-CG2 4.06Å; M238-V275 HydrophobicContact SD-CB 3.91Å; M238-V275 HydrophobicContact SD-CG1 3.88Å; M238-V275 HydrophobicContact SD-CG2 3.71Å; L273-V275 PolarHBondContact O-N 2.99Å; V275-P278 WeakPolarHBondContact O-CD 3.48Å; V275-V279 HydrophobicContact CG1-CG2 4.04Å; V275-V279 WeakPolarHBondContact O-CB 3.29Å; V275-V279 WeakPolarHBondContact O-CG2 3.34Å; V275-V279 PolarHBondContact O-N 2.86Å; V275-V279 VanDerWaalsContact O-N 3.11Å; V275-K392 HydrophobicContact CG2-CD 4.3Å; V275-K392 HydrophobicContact CG2-CG 3.96Å; V275-L395 HydrophobicContact CG2-CD1 4.3Å; V275-V435 HydrophobicContact CG1-CG1 3.76Å; V275-V435 HydrophobicContact CG1-CG2 4.05Å
276L93.2Very high87.5Confident21 Ų2132.7 Ų32.711%0.1118%0.181CC..Hα-helixtrans-67-47.4-176.4-177.763.7000112L50 L53 Q54 L57 L273 A280L50-L276 HydrophobicContact CB-CD2 4.19Å; L50-L276 HydrophobicContact CD2-CD2 3.95Å; L53-L276 HydrophobicContact CD2-CD1 3.89Å; L53-L276 HydrophobicContact CD2-CD2 4.44Å; L53-L276 HydrophobicContact CG-CD1 4.16Å; Q54-L276 HydrophobicContact CB-CB 4.16Å; Q54-L276 HydrophobicContact CG-CB 4.03Å; L57-L276 HydrophobicContact CD1-CD1 3.4Å; L273-L276 HydrophobicContact CB-CB 4.44Å; L273-L276 HydrophobicContact CD2-CD2 4.12Å; L273-L276 PolarHBondContact O-N 3.12Å; L273-L276 VanDerWaalsContact O-N 3.11Å; L276-A280 VanDerWaalsContact O-CB 3.29Å; L276-A280 WeakPolarHBondContact O-CB 3.38Å; L276-A280 PolarHBondContact O-N 2.87Å
277I92.9Very high88.6Confident49 Ų4933.2 Ų33.225%0.25119%0.19SC..Hα-helixtrans-62-51.6-179.6-65.6166.4000110.4F270 L273 V279 A280 C281F270-I277 HydrophobicContact CD1-CD1 4.03Å; F270-I277 HydrophobicContact CE1-CD1 4.37Å; L273-I277 HydrophobicContact CB-CD1 3.71Å; L273-I277 HydrophobicContact CB-CG1 3.86Å; L273-I277 HydrophobicContact CD1-CD1 4.43Å; L273-I277 PolarHBondContact O-N 2.99Å; I277-V279 PolarHBondContact O-N 3.3Å; I277-A280 PolarHBondContact O-N 3.38Å; I277-C281 WeakPolarHBondContact O-CB 3.12Å; I277-C281 PolarHBondContact O-N 2.62Å; I277-C281 PolarHBondContact O-SG 3.39Å
278P94.8Very high89.3Confident0 Ų040 Ų400%022%0.219CC..Hα-helixtrans-61.2-43.4179.1-24.433.6000114.3V234 L237 M238 S274 V275 C281 V282V234-P278 HydrophobicContact CG2-CB 4.05Å; L237-P278 HydrophobicContact CB-CB 3.94Å; L237-P278 HydrophobicContact CB-CG 4.28Å; L237-P278 HydrophobicContact CD2-CB 3.92Å; L237-P278 HydrophobicContact CD2-CG 4.44Å; L237-P278 HydrophobicContact CG-CB 3.77Å; L237-P278 HydrophobicContact CG-CG 3.89Å; M238-P278 HydrophobicContact CB-CG 4.37Å; M238-P278 HydrophobicContact CG-CB 3.85Å; M238-P278 HydrophobicContact CG-CG 3.88Å; S274-P278 WeakPolarHBondContact O-CD 3.49Å; S274-P278 WeakPolarHBondContact O-CG 3.41Å; V275-P278 WeakPolarHBondContact O-CD 3.48Å; P278-C281 PolarHBondContact O-N 3.17Å; P278-V282 WeakPolarHBondContact O-CG2 3.33Å; P278-V282 PolarHBondContact O-N 3.34Å
279V93.6Very high89.5Confident5 Ų543.2 Ų43.23%0.0323%0.234CC..Hα-helixtrans-61.5-47.6178.3170.10000110.3L57 V275 I277 C281 V282 W283 V431 V435L57-V279 HydrophobicContact CD1-CG1 4.22Å; V275-V279 HydrophobicContact CG1-CG2 4.04Å; V275-V279 WeakPolarHBondContact O-CB 3.29Å; V275-V279 WeakPolarHBondContact O-CG2 3.34Å; V275-V279 PolarHBondContact O-N 2.86Å; V275-V279 VanDerWaalsContact O-N 3.11Å; I277-V279 PolarHBondContact O-N 3.3Å; V279-C281 PolarHBondContact O-N 3.35Å; V279-V282 PolarHBondContact O-N 2.74Å; V279-W283 WeakPolarHBondContact O-CB 3.2Å; V279-W283 PolarHBondContact O-N 3.22Å; V279-V431 HydrophobicContact CB-CG1 4.34Å; V279-V431 HydrophobicContact CG1-CG1 4.04Å; V279-V431 HydrophobicContact CG2-CG1 3.99Å; V279-V435 HydrophobicContact CG2-CG2 3.41Å; V279-V435 VanDerWaalsContact CG2-CG2 3.41Å
280A93.1Very high89Confident38 Ų3844.8 Ų44.831%0.31425%0.253SS..Hα-helixtrans-61.1-45.8178.300000112L276 I277 W283 I284L276-A280 VanDerWaalsContact O-CB 3.29Å; L276-A280 WeakPolarHBondContact O-CB 3.38Å; L276-A280 PolarHBondContact O-N 2.87Å; I277-A280 PolarHBondContact O-N 3.38Å; A280-W283 PolarHBondContact O-N 3.01Å; A280-I284 WeakPolarHBondContact O-CB 3.35Å; A280-I284 WeakPolarHBondContact O-CD1 3.06Å; A280-I284 VanDerWaalsContact O-CG1 3.24Å; A280-I284 WeakPolarHBondContact O-CG1 2.97Å; A280-I284 PolarHBondContact O-N 3.08Å
281C93.1Very high88.2Confident56 Ų5646.9 Ų46.938%0.37826%0.262SS..Hα-helixtrans-60.3-51.4178.5-71.80000112L237 I277 P278 V279 W283 I284 V285L237-C281 HydrophobicContact CD2-CB 3.77Å; I277-C281 WeakPolarHBondContact O-CB 3.12Å; I277-C281 PolarHBondContact O-N 2.62Å; I277-C281 PolarHBondContact O-SG 3.39Å; P278-C281 PolarHBondContact O-N 3.17Å; V279-C281 PolarHBondContact O-N 3.35Å; C281-W283 VanDerWaalsContact C-N 3.33Å; C281-W283 PolarHBondContact O-N 3.38Å; C281-I284 PolarHBondContact O-N 3.34Å; C281-V285 VanDerWaalsContact O-CG2 3.29Å; C281-V285 WeakPolarHBondContact O-CG2 3.44Å; C281-V285 PolarHBondContact O-N 3.14Å
282V93.3Very high86.9Confident1 Ų147.6 Ų47.61%0.00628%0.275CS..Hα-helixtrans-70.3-32.6-177.8-178.50000111.5L230 L233 V234 P278 V279 V285 S286 V431L230-V282 HydrophobicContact CB-CG1 4.37Å; L230-V282 HydrophobicContact CD2-CG1 4.04Å; L233-V282 HydrophobicContact CB-CG2 4.41Å; L233-V282 HydrophobicContact CD2-CG1 4.43Å; L233-V282 HydrophobicContact CD2-CG2 3.88Å; L233-V282 HydrophobicContact CG-CG2 3.81Å; V234-V282 HydrophobicContact CB-CB 4.38Å; V234-V282 HydrophobicContact CB-CG2 3.92Å; V234-V282 HydrophobicContact CG2-CG2 4.44Å; P278-V282 WeakPolarHBondContact O-CG2 3.33Å; P278-V282 PolarHBondContact O-N 3.34Å; V279-V282 PolarHBondContact O-N 2.74Å; V282-V285 PolarHBondContact O-N 3.21Å; V282-S286 WeakPolarHBondContact O-CB 3.21Å; V282-S286 PolarHBondContact O-N 3.48Å; V282-S286 PolarHBondContact O-OG 3.22Å; V282-V431 HydrophobicContact CB-CG2 4.21Å; V282-V431 HydrophobicContact CG1-CG2 3.61Å
283W90.4Very high85.4Confident75 Ų7550 Ų5028%0.28429%0.289SS..Hα-helixtrans-64.3-44.2174.2-168.317000111.6V279 A280 C281 S286 A287 T426 I427V279-W283 WeakPolarHBondContact O-CB 3.2Å; V279-W283 PolarHBondContact O-N 3.22Å; A280-W283 PolarHBondContact O-N 3.01Å; C281-W283 VanDerWaalsContact C-N 3.33Å; C281-W283 PolarHBondContact O-N 3.38Å; W283-S286 PolarHBondContact O-N 2.93Å; W283-S286 PolarHBondContact O-OG 2.91Å; W283-A287 PolarHBondContact O-N 3.49Å; W283-T426 WeakPolarHBondContact CZ2-OG1 3.41Å; W283-T426 PolarHBondContact NE1-O 2.92Å; W283-I427 HydrophobicContact CD2-CG1 4.31Å; W283-I427 HydrophobicContact CH2-CG1 4.25Å; W283-I427 HydrophobicContact CZ2-CG1 4.04Å; W283-I427 HydrophobicContact CZ3-CG1 4.47Å
284I90.4Very high83.9Confident98 Ų9851.8 Ų51.850%0.50330%0.298SS..Hα-helixtrans-62.7-46.4174.1-68.9165000111.2A280 C281 S286 A287 F288A280-I284 WeakPolarHBondContact O-CB 3.35Å; A280-I284 WeakPolarHBondContact O-CD1 3.06Å; A280-I284 VanDerWaalsContact O-CG1 3.24Å; A280-I284 WeakPolarHBondContact O-CG1 2.97Å; A280-I284 PolarHBondContact O-N 3.08Å; C281-I284 PolarHBondContact O-N 3.34Å; I284-S286 VanDerWaalsContact C-N 3.31Å; I284-S286 PolarHBondContact O-N 3.32Å; I284-A287 WeakPolarHBondContact O-CB 3.5Å; I284-A287 PolarHBondContact O-N 3Å; I284-A287 VanDerWaalsContact O-N 3.15Å; I284-F288 HydrophobicContact CG2-CD2 3.63Å; I284-F288 HydrophobicContact CG2-CE2 3.39Å; I284-F288 VanDerWaalsContact O-CD2 3.24Å; I284-F288 WeakPolarHBondContact O-CD2 3.43Å; I284-F288 PolarHBondContact O-N 3.04Å
285V90.2Very high82Confident57 Ų5752.7 Ų52.735%0.34530%0.304SS..Hα-helixtrans-59.8-42177.2169.20000111.2C281 V282 A287 F288 L289C281-V285 VanDerWaalsContact O-CG2 3.29Å; C281-V285 WeakPolarHBondContact O-CG2 3.44Å; C281-V285 PolarHBondContact O-N 3.14Å; V282-V285 PolarHBondContact O-N 3.21Å; V285-A287 VanDerWaalsContact C-N 3.31Å; V285-A287 PolarHBondContact O-N 3.49Å; V285-F288 PolarHBondContact O-N 3.11Å; V285-L289 HydrophobicContact CG1-CD1 3.62Å; V285-L289 HydrophobicContact CG1-CG 4.37Å; V285-L289 WeakPolarHBondContact O-CB 3.43Å; V285-L289 VanDerWaalsContact O-CG 3.31Å; V285-L289 WeakPolarHBondContact O-CG 3.12Å; V285-L289 PolarHBondContact O-N 3.43Å
286S87.7Confident80Confident3 Ų361 Ų612%0.02134%0.343CS..Hα-helixtrans-63.6-36.8176.972.40000112.6V282 W283 I284 G290 F291 P428V282-S286 WeakPolarHBondContact O-CB 3.21Å; V282-S286 PolarHBondContact O-N 3.48Å; V282-S286 PolarHBondContact O-OG 3.22Å; W283-S286 PolarHBondContact O-N 2.93Å; W283-S286 PolarHBondContact O-OG 2.91Å; I284-S286 VanDerWaalsContact C-N 3.31Å; I284-S286 PolarHBondContact O-N 3.32Å; S286-G290 PolarHBondContact O-N 3.47Å; S286-F291 PolarHBondContact O-N 3.32Å; S286-F291 VanDerWaalsContact O-N 3.11Å; S286-P428 VanDerWaalsContact OG-CG 3.27Å; S286-P428 WeakPolarHBondContact OG-CG 2.92Å
287A86Confident77.9Confident71 Ų7165.8 Ų65.859%0.58737%0.365SS*.Hα-helixtrans-66.9-42.5176.600000111.6W283 I284 V285 G290W283-A287 PolarHBondContact O-N 3.49Å; I284-A287 WeakPolarHBondContact O-CB 3.5Å; I284-A287 PolarHBondContact O-N 3Å; I284-A287 VanDerWaalsContact O-N 3.15Å; V285-A287 VanDerWaalsContact C-N 3.31Å; V285-A287 PolarHBondContact O-N 3.49Å; A287-G290 PolarHBondContact O-N 3.08Å
288F86.1Confident75.9Confident178 Ų17863.7 Ų63.778%0.78135%0.354SS*.Hα-helixtrans-66.4-37.8176.7-81-65.1000113.4I284 V285 G290I284-F288 HydrophobicContact CG2-CD2 3.63Å; I284-F288 HydrophobicContact CG2-CE2 3.39Å; I284-F288 VanDerWaalsContact O-CD2 3.24Å; I284-F288 WeakPolarHBondContact O-CD2 3.43Å; I284-F288 PolarHBondContact O-N 3.04Å; V285-F288 PolarHBondContact O-N 3.11Å; F288-G290 PolarHBondContact O-N 3.47Å
289L82.9Confident73.8Confident99 Ų9965.6 Ų65.652%0.51837%0.368SS..THydrogen-bonded Turntrans-77.2-5.3178.8-67.8167.8000113.1V285 F291V285-L289 HydrophobicContact CG1-CD1 3.62Å; V285-L289 HydrophobicContact CG1-CG 4.37Å; V285-L289 WeakPolarHBondContact O-CB 3.43Å; V285-L289 VanDerWaalsContact O-CG 3.31Å; V285-L289 WeakPolarHBondContact O-CG 3.12Å; V285-L289 PolarHBondContact O-N 3.43Å; L289-F291 HydrophobicContact CB-CD2 3.33Å; L289-F291 HydrophobicContact CB-CE2 3.71Å; L289-F291 HydrophobicContact CB-CG 4.26Å; L289-F291 HydrophobicContact CD1-CD2 3.9Å; L289-F291 HydrophobicContact CD1-CE2 4.09Å; L289-F291 HydrophobicContact CD2-CE2 4.48Å; L289-F291 HydrophobicContact CG-CD2 4.2Å; L289-F291 HydrophobicContact CG-CE2 4.32Å; L289-F291 PolarHBondContact O-N 2.85Å
290G71.7Confident71.8Confident60 Ų6067.1 Ų67.162%0.61938%0.38SS*.THydrogen-bonded Turntrans67.98.7-17500000114S286 A287 F288 S292S286-G290 PolarHBondContact O-N 3.47Å; A287-G290 PolarHBondContact O-N 3.08Å; F288-G290 PolarHBondContact O-N 3.47Å; G290-S292 PolarHBondContact O-N 3.44Å
291F67.1Low69.8Low97 Ų9771.5 Ų71.543%0.42541%0.406SS..  trans-79.654.5174.1-64.4-57.3000110.7L230 S286 L289 V293L230-F291 HydrophobicContact CD1-CB 4.27Å; S286-F291 PolarHBondContact O-N 3.32Å; S286-F291 VanDerWaalsContact O-N 3.11Å; L289-F291 HydrophobicContact CB-CD2 3.33Å; L289-F291 HydrophobicContact CB-CE2 3.71Å; L289-F291 HydrophobicContact CB-CG 4.26Å; L289-F291 HydrophobicContact CD1-CD2 3.9Å; L289-F291 HydrophobicContact CD1-CE2 4.09Å; L289-F291 HydrophobicContact CD2-CE2 4.48Å; L289-F291 HydrophobicContact CG-CD2 4.2Å; L289-F291 HydrophobicContact CG-CE2 4.32Å; L289-F291 PolarHBondContact O-N 2.85Å; F291-V293 PolarHBondContact O-N 3.38Å
292S58.3Low67.8Low65 Ų6572.8 Ų72.846%0.45541%0.412SS..  trans-81.874.3168.4-159.20000107.4G290 I294G290-S292 PolarHBondContact O-N 3.44Å; S292-I294 PolarHBondContact O-N 2.6Å; S292-I294 WeakPolarHBondContact OG-CD1 3.43Å; S292-I294 WeakPolarHBondContact OG-CG1 3.47Å
293V55.7Low66.4Low55 Ų5582.3 Ų82.333%0.33345%0.453SS..  trans-72.667.3167.2-1730000107.3H227 F291H227-V293 VanDerWaalsContact CD2-CG2 3.48Å; H227-V293 WeakPolarHBondContact CD2-CG2 3.46Å; H227-V293 WeakPolarHBondContact NE2-CG2 3.34Å; F291-V293 PolarHBondContact O-N 3.38Å
294I56.9Low65.5Low60 Ų6079.1 Ų79.131%0.30844%0.443SS..  trans-72.8131174-40.9-179.6000105.6S292 Q296 S299S292-I294 PolarHBondContact O-N 2.6Å; S292-I294 WeakPolarHBondContact OG-CD1 3.43Å; S292-I294 WeakPolarHBondContact OG-CG1 3.47Å; I294-Q296 PolarHBondContact O-N 3.43Å; I294-S299 WeakPolarHBondContact CG2-OG 3.36Å
295P53.3Low65.1Low19 Ų1976.9 Ų76.912%0.12344%0.435CS..  trans-58.311217218.2-25.7000109.1L68 E297 L298 S299 L429L68-P295 HydrophobicContact CD1-CB 4.31Å; L68-P295 HydrophobicContact CD1-CG 4.24Å; L68-P295 HydrophobicContact CD2-CB 3.65Å; L68-P295 HydrophobicContact CD2-CG 4.26Å; P295-E297 PolarHBondContact O-N 3.16Å; P295-E297 VanDerWaalsContact O-N 3.12Å; P295-L298 HydrophobicContact CB-CD1 4.18Å; P295-L298 HydrophobicContact CG-CB 4.48Å; P295-L298 HydrophobicContact CG-CD1 4.12Å; P295-L298 PolarHBondContact O-N 3.13Å; P295-S299 PolarHBondContact O-N 3.23Å; P295-S299 PolarHBondContact O-OG 2.96Å; P295-L429 HydrophobicContact CB-CD1 4.21Å; P295-L429 HydrophobicContact CG-CD1 3.85Å
296Q48.8Very low64.9Low173 Ų17383 Ų8381%0.80845%0.452SS*.G310 helixtrans-59.2-27.8-175.5-165.6156.5-16.800111.7I294 S299I294-Q296 PolarHBondContact O-N 3.43Å; Q296-S299 PolarHBondContact O-N 2.93Å
297E49.5Very low65Low122 Ų12290 Ų9057%0.5749%0.487SS*.G310 helixtrans-67.7-27.9176.2-59.2-59.1149.900114.7P295P295-E297 PolarHBondContact O-N 3.16Å; P295-E297 VanDerWaalsContact O-N 3.12Å
298L51.8Low65.2Low6 Ų687.8 Ų87.83%0.03146%0.464CS..G310 helixtrans-98.6-1.8172.1-75108.2000113.1L68 P83 L87 P295 T425L68-L298 HydrophobicContact CD1-CD1 4.29Å; L68-L298 HydrophobicContact CD2-CD1 3.1Å; L68-L298 HydrophobicContact CG-CD1 3.43Å; L68-L298 VanDerWaalsContact CG-CD1 3.43Å; P83-L298 HydrophobicContact CB-CD2 4.22Å; P83-L298 HydrophobicContact CB-CG 4.17Å; L87-L298 HydrophobicContact CD1-CD2 4.31Å; P295-L298 HydrophobicContact CB-CD1 4.18Å; P295-L298 HydrophobicContact CG-CB 4.48Å; P295-L298 HydrophobicContact CG-CD1 4.12Å; P295-L298 PolarHBondContact O-N 3.13Å; L298-T425 HydrophobicContact CB-CG2 4.24Å; L298-T425 HydrophobicContact CD2-CG2 3.73Å
299S50Low65.4Low40 Ų4084.7 Ų84.728%0.2846%0.455SS..  trans-100.226.4-174.4-54.10000112.7I294 P295 Q296I294-S299 WeakPolarHBondContact CG2-OG 3.36Å; P295-S299 PolarHBondContact O-N 3.23Å; P295-S299 PolarHBondContact O-OG 2.96Å; Q296-S299 PolarHBondContact O-N 2.93Å
300A51Low65.6Low36 Ų3680.3 Ų80.330%0.29843%0.433SS..  trans-55129.9178.800000110.2T302A300-T302 VanDerWaalsContact C-N 3.29Å; A300-T302 PolarHBondContact O-N 3.47Å
301P52Low66.3Low131 Ų13181.9 Ų81.985%0.85142%0.424SS*.  trans-77.48317930.9-32.1000108.8
302T51.4Low67.3Low82 Ų8280.2 Ų80.250%0.50342%0.423SS..  trans-133.7142.2174.232.90000110.6A300 A304A300-T302 VanDerWaalsContact C-N 3.29Å; A300-T302 PolarHBondContact O-N 3.47Å; T302-A304 PolarHBondContact O-N 3.18Å
303K63.8Low68.2Low201 Ų20178 Ų7887%0.87441%0.41SS*.  trans-66.975.2177.3-80.8176.2176.3174.60110R419K303-R419 VanDerWaalsContact CA-NH2 3.31Å
304A70.6Confident69.2Low9 Ų978.3 Ų78.37%0.07441%0.408CS..  trans-60.1138.6173.700000109.3T302 P418 R419T302-A304 PolarHBondContact O-N 3.18Å; A304-P418 HydrophobicContact CB-CB 4.22Å; A304-R419 HydrophobicContact CB-CG 3.92Å; A304-R419 WeakPolarHBondContact O-CD 3.47Å; A304-R419 WeakPolarHBondContact O-CG 3.32Å; A304-R419 PolarHBondContact O-NE 2.93Å
305P83Confident69.9Low51 Ų5176.7 Ų76.733%0.33140%0.398SS..  trans-68.615017828.4-34.9000110.8W308 P418 R419P305-W308 HydrophobicContact CB-CB 4.49Å; P305-W308 HydrophobicContact CG-CB 3.76Å; P305-W308 HydrophobicContact CG-CG 4.4Å; P305-P418 HydrophobicContact CG-CG 4.42Å; P305-R419 WeakPolarHBondContact O-CG 3.47Å
306W86.4Confident71.3Confident185 Ų18580.3 Ų80.370%0.70142%0.416SS*.SBendtrans-72.7-34.8174.3-81.194.3000112.5S417 L420W306-S417 WeakPolarHBondContact O-CA 3.45Å; W306-S417 WeakPolarHBondContact O-CB 3.36Å; W306-S417 PolarHBondContact O-OG 2.9Å; W306-L420 HydrophobicContact CZ3-CD2 4.46Å
307I89.6Confident73.2Confident149 Ų14980.1 Ų80.176%0.76441%0.408SS*.  trans-126.6122.8177.9-59.8170.6000107.1L416I307-L416 CarbonylContact C-O 3.45Å; I307-L416 WeakPolarHBondContact CA-O 3.5Å
308W89.1Confident75.2Confident25 Ų2575.6 Ų75.610%0.09539%0.389CS..  trans-148.5125.1175.9166.583000107.9Q85 A88 P305 P310 E314 W315 L416 P418Q85-W308 HydrophobicContact CB-CH2 4.4Å; Q85-W308 HydrophobicContact CB-CZ2 4.41Å; Q85-W308 HydrophobicContact CG-CD2 4.36Å; A88-W308 HydrophobicContact CB-CE3 4.29Å; A88-W308 HydrophobicContact CB-CZ3 3.96Å; P305-W308 HydrophobicContact CB-CB 4.49Å; P305-W308 HydrophobicContact CG-CB 3.76Å; P305-W308 HydrophobicContact CG-CG 4.4Å; W308-P310 VanDerWaalsContact CH2-CA 3.44Å; W308-P310 HydrophobicContact CH2-CB 3.41Å; W308-P310 VanDerWaalsContact CH2-CB 3.41Å; W308-P310 HydrophobicContact CH2-CG 4.38Å; W308-P310 HydrophobicContact CZ2-CB 4.19Å; W308-P310 HydrophobicContact CZ3-CB 3.63Å; W308-P310 HydrophobicContact CZ3-CG 4.12Å; W308-P310 WeakPolarHBondContact O-CD 3.33Å; W308-E314 WeakPolarHBondContact CZ2-OE2 3.2Å; W308-E314 PolarHBondContact NE1-OE1 3.26Å; W308-E314 PolarHBondContact NE1-OE2 3.21Å; W308-W315 AromaticContact CH2-CH2 3.14Å; W308-W315 HydrophobicContact CH2-CH2 3.14Å; W308-W315 AromaticContact CH2-CZ2 3.88Å; W308-W315 HydrophobicContact CH2-CZ2 3.88Å; W308-W315 AromaticContact CH2-CZ3 3.89Å; W308-W315 HydrophobicContact CH2-CZ3 3.89Å; W308-W315 AromaticContact CZ2-CH2 3.16Å; W308-W315 HydrophobicContact CZ2-CH2 3.16Å; W308-W315 AromaticContact CZ2-CZ2 3.43Å; W308-W315 HydrophobicContact CZ2-CZ2 3.43Å; W308-W315 VanDerWaalsContact CZ2-CZ2 3.43Å; W308-W315 AromaticContact CZ2-CZ3 3.99Å; W308-W315 HydrophobicContact CZ2-CZ3 3.99Å; W308-W315 HydrophobicContact CZ3-CH2 4.33Å; W308-L416 PolarHBondContact N-O 3.02Å; W308-L416 CarbonylContact O-C 3.24Å; W308-L416 WeakPolarHBondContact O-CA 3.35Å; W308-P418 HydrophobicContact CB-CG 3.85Å; W308-P418 HydrophobicContact CD2-CG 3.95Å; W308-P418 HydrophobicContact CE3-CG 3.6Å; W308-P418 HydrophobicContact CG-CG 4.1Å; W308-P418 HydrophobicContact CZ3-CG 4.48Å
309L90.2Very high77.1Confident114 Ų11478.5 Ų78.560%0.59741%0.405SS*.  trans-93.9114-179.5-179.466.4000108.5H311 L416L309-H311 PolarHBondContact O-N 2.9Å; L309-L416 HydrophobicContact CD1-CD2 3.5Å; L309-L416 VanDerWaalsContact CD1-CD2 3.5Å
310P86.7Confident79.1Confident7 Ų782.2 Ų82.25%0.04542%0.421CS..  trans-60.5119.2174.622.5-32.1000109.7F92 W308 L377F92-P310 HydrophobicContact CB-CG 3.76Å; F92-P310 HydrophobicContact CD1-CG 3.64Å; F92-P310 HydrophobicContact CD2-CG 3.91Å; F92-P310 HydrophobicContact CE1-CG 4.17Å; F92-P310 HydrophobicContact CE2-CG 4.42Å; F92-P310 HydrophobicContact CG-CG 3.48Å; F92-P310 VanDerWaalsContact CG-CG 3.48Å; W308-P310 VanDerWaalsContact CH2-CA 3.44Å; W308-P310 HydrophobicContact CH2-CB 3.41Å; W308-P310 VanDerWaalsContact CH2-CB 3.41Å; W308-P310 HydrophobicContact CH2-CG 4.38Å; W308-P310 HydrophobicContact CZ2-CB 4.19Å; W308-P310 HydrophobicContact CZ3-CB 3.63Å; W308-P310 HydrophobicContact CZ3-CG 4.12Å; W308-P310 WeakPolarHBondContact O-CD 3.33Å; P310-L377 HydrophobicContact CB-CD1 4.19Å; P310-L377 HydrophobicContact CB-CD2 4.02Å; P310-L377 HydrophobicContact CG-CD1 4.49Å; P310-L377 WeakPolarHBondContact O-CD2 3.48Å
311H87.1Confident81.1Confident93 Ų9381.7 Ų81.743%0.43141%0.414SS..  trans-115.5144.2176.464.987.1000112.2L309 G313 E314L309-H311 PolarHBondContact O-N 2.9Å; H311-G313 PolarHBondContact O-N 3.13Å; H311-E314 IonicContact CD2-OE2 3.92Å; H311-E314 PolarHBondContact CD2-OE2 3.44Å; H311-E314 VanDerWaalsContact CE1-CA 3.49Å; H311-E314 WeakPolarHBondContact CE1-CA 3.46Å; H311-E314 WeakPolarHBondContact CE1-CB 3.05Å; H311-E314 WeakPolarHBondContact CE1-CG 3.21Å; H311-E314 IonicContact CE1-OE2 3.56Å; H311-E314 IonicContact CG-OE2 3.83Å; H311-E314 VanDerWaalsContact NE2-CG 3.31Å; H311-E314 WeakPolarHBondContact NE2-CG 3.48Å; H311-E314 IonicContact NE2-OE1 3.31Å; H311-E314 IonicContact NE2-OE2 3.62Å; H311-E314 PolarHBondContact NE2-OE2 3.39Å; H311-E314 PolarHBondContact O-N 3.45Å
312P87.9Confident83.1Confident62 Ų6279.7 Ų79.740%0.40340%0.401SS..THydrogen-bonded Turntrans-55.8137.2176.9-26.835.2000112.2E314 W317 L376 L377P312-E314 VanDerWaalsContact C-N 3.27Å; P312-E314 PolarHBondContact O-N 2.84Å; P312-W317 HydrophobicContact CB-CH2 4.23Å; P312-W317 HydrophobicContact CB-CZ3 4.34Å; P312-L376 WeakPolarHBondContact CA-O 3.29Å; P312-L376 HydrophobicContact CB-CB 4.34Å; P312-L377 HydrophobicContact CG-CD2 4.18Å
313G78.4Confident85.1Confident19 Ų1978.6 Ų78.620%0.19639%0.388CS..THydrogen-bonded Turntrans73.57.2174.800000116.1H311 W315 N316 L376H311-G313 PolarHBondContact O-N 3.13Å; G313-W315 PolarHBondContact O-N 3.27Å; G313-N316 PolarHBondContact O-N 2.74Å; G313-N316 VanDerWaalsContact O-N 3.12Å; G313-L376 PolarHBondContact N-O 2.91Å
314E75.7Confident86.5Confident60 Ų6069 Ų6928%0.2835%0.346SS..THydrogen-bonded Turntrans-54.3-36.1175-169166.217100112.4W308 H311 P312W308-E314 WeakPolarHBondContact CZ2-OE2 3.2Å; W308-E314 PolarHBondContact NE1-OE1 3.26Å; W308-E314 PolarHBondContact NE1-OE2 3.21Å; H311-E314 IonicContact CD2-OE2 3.92Å; H311-E314 PolarHBondContact CD2-OE2 3.44Å; H311-E314 VanDerWaalsContact CE1-CA 3.49Å; H311-E314 WeakPolarHBondContact CE1-CA 3.46Å; H311-E314 WeakPolarHBondContact CE1-CB 3.05Å; H311-E314 WeakPolarHBondContact CE1-CG 3.21Å; H311-E314 IonicContact CE1-OE2 3.56Å; H311-E314 IonicContact CG-OE2 3.83Å; H311-E314 VanDerWaalsContact NE2-CG 3.31Å; H311-E314 WeakPolarHBondContact NE2-CG 3.48Å; H311-E314 IonicContact NE2-OE1 3.31Å; H311-E314 IonicContact NE2-OE2 3.62Å; H311-E314 PolarHBondContact NE2-OE2 3.39Å; H311-E314 PolarHBondContact O-N 3.45Å; P312-E314 VanDerWaalsContact C-N 3.27Å; P312-E314 PolarHBondContact O-N 2.84Å
315W72.3Confident87.7Confident26 Ų2673 Ų7310%0.09837%0.366CS..THydrogen-bonded Turntrans-105.128.6-177.5-63.7-52.3000113.4Y81 Q85 W308 G313 L377Y81-W315 HydrophobicContact CD1-CB 3.89Å; Y81-W315 AromaticContact CD1-CD1 3.09Å; Y81-W315 HydrophobicContact CD1-CD2 4.46Å; Y81-W315 AromaticContact CD1-CG 3.53Å; Y81-W315 HydrophobicContact CD1-CG 3.53Å; Y81-W315 AromaticContact CD1-NE1 3.73Å; Y81-W315 HydrophobicContact CE1-CB 3.39Å; Y81-W315 AromaticContact CE1-CD1 3.38Å; Y81-W315 AromaticContact CE1-CG 3.58Å; Y81-W315 HydrophobicContact CE1-CG 3.58Å; Y81-W315 HydrophobicContact CG-CG 4.45Å; Y81-W315 PolarHBondContact OH-O 3.24Å; Y81-W315 VanDerWaalsContact OH-O 3.13Å; Q85-W315 HydrophobicContact CB-CH2 3.93Å; Q85-W315 HydrophobicContact CB-CZ2 3.59Å; Q85-W315 HydrophobicContact CG-CZ2 4.41Å; W308-W315 AromaticContact CH2-CH2 3.14Å; W308-W315 HydrophobicContact CH2-CH2 3.14Å; W308-W315 AromaticContact CH2-CZ2 3.88Å; W308-W315 HydrophobicContact CH2-CZ2 3.88Å; W308-W315 AromaticContact CH2-CZ3 3.89Å; W308-W315 HydrophobicContact CH2-CZ3 3.89Å; W308-W315 AromaticContact CZ2-CH2 3.16Å; W308-W315 HydrophobicContact CZ2-CH2 3.16Å; W308-W315 AromaticContact CZ2-CZ2 3.43Å; W308-W315 HydrophobicContact CZ2-CZ2 3.43Å; W308-W315 VanDerWaalsContact CZ2-CZ2 3.43Å; W308-W315 AromaticContact CZ2-CZ3 3.99Å; W308-W315 HydrophobicContact CZ2-CZ3 3.99Å; W308-W315 HydrophobicContact CZ3-CH2 4.33Å; G313-W315 PolarHBondContact O-N 3.27Å; W315-L377 WeakPolarHBondContact CZ3-O 3.37Å
316N82.4Confident88.3Confident95 Ų9571 Ų7151%0.50835%0.353SS..  trans73.6158.2-165.2-46-83.1000113Q171 G313Q171-N316 HydrophobicContact CG-CB 4.46Å; Q171-N316 VanDerWaalsContact NE2-CB 3.29Å; Q171-N316 PolarHBondContact NE2-ND2 3.37Å; Q171-N316 VanDerWaalsContact NE2-ND2 3.15Å; G313-N316 PolarHBondContact O-N 2.74Å; G313-N316 VanDerWaalsContact O-N 3.12Å
317W88.9Confident88.7Confident169 Ų16962.1 Ų62.164%0.6432%0.319SS*.PPolyproline II helixtrans-69.1147.5177.7-69.499.1000111.9P312 L319 L376P312-W317 HydrophobicContact CB-CH2 4.23Å; P312-W317 HydrophobicContact CB-CZ3 4.34Å; W317-L319 PolarHBondContact O-N 3.45Å; W317-L376 HydrophobicContact CE3-CD2 4.45Å; W317-L376 HydrophobicContact CZ3-CD2 4.14Å
318P90.9Very high89Confident27 Ų2755 Ų5518%0.17528%0.283CS..PPolyproline II helixtrans-55.9136.2174.821-31.5000111.4V178 L376V178-P318 HydrophobicContact CG2-CB 4.28Å; V178-P318 HydrophobicContact CG2-CG 4.05Å; P318-L376 HydrophobicContact CG-CD2 4.24Å
319L91.1Very high89.4Confident68 Ų6856.5 Ų56.536%0.35629%0.292SS..PPolyproline II helixtrans-94.9116.6-178.3-17563.2000110.4Q171 E172 W317 T321Q171-L319 HydrophobicContact CB-CB 3.9Å; Q171-L319 PolarHBondContact O-N 3.42Å; E172-L319 HydrophobicContact CG-CB 4.13Å; E172-L319 HydrophobicContact CG-CD2 3.83Å; E172-L319 HydrophobicContact CG-CG 4.14Å; W317-L319 PolarHBondContact O-N 3.45Å; L319-T321 HydrophobicContact CD2-CG2 4.05Å; L319-T321 HydrophobicContact CG-CG2 3.98Å; L319-T321 PolarHBondContact O-N 3.4Å
320L93.4Very high89.7Confident117 Ų11751 Ų5161%0.61326%0.263SS*.  trans-92.590.9179.2-61.6177.7000110.5V179V179-L320 HydrophobicContact CG2-CD2 3.67Å
321T93.1Very high90.1Very high26 Ų2650.7 Ų50.716%0.1626%0.261CS..  trans-95.5159.3168.768.10000110.9E172 L319 R323 A324 L325E172-T321 HydrophobicContact CG-CG2 3.85Å; L319-T321 HydrophobicContact CD2-CG2 4.05Å; L319-T321 HydrophobicContact CG-CG2 3.98Å; L319-T321 PolarHBondContact O-N 3.4Å; T321-R323 PolarHBondContact O-N 3.18Å; T321-A324 WeakPolarHBondContact O-CA 3.46Å; T321-A324 WeakPolarHBondContact O-CB 3.46Å; T321-A324 PolarHBondContact O-N 3.2Å; T321-A324 WeakPolarHBondContact OG1-CB 3.28Å; T321-A324 PolarHBondContact OG1-N 3.18Å; T321-A324 VanDerWaalsContact OG1-N 3.1Å; T321-L325 PolarHBondContact O-N 3.5Å
322P93.9Very high90.6Very high88 Ų8846.3 Ų46.357%0.57124%0.241SC*.Hα-helixtrans-55.5-34.2173.6-28.736.8000113.5L325 A326 P492P322-L325 WeakPolarHBondContact O-CB 3.49Å; P322-L325 PolarHBondContact O-N 2.96Å; P322-A326 PolarHBondContact O-N 3.39Å; P322-P492 HydrophobicContact CB-CB 4.24Å; P322-P492 HydrophobicContact CB-CG 3.58Å
323R92.1Very high91Very high60 Ų6045.9 Ų45.923%0.22624%0.235CC..Hα-helixtrans-68.8-40.5173.8-67.3-176.7-67.6168.1-6112.2L125 K129 T321 L325 A326 A327 V495L125-R323 HydrophobicContact CD1-CB 3.64Å; K129-R323 VanDerWaalsContact CE-NH2 3.29Å; T321-R323 PolarHBondContact O-N 3.18Å; R323-L325 VanDerWaalsContact C-N 3.33Å; R323-A326 PolarHBondContact O-N 3.42Å; R323-A327 WeakPolarHBondContact O-CB 3.43Å; R323-A327 PolarHBondContact O-N 2.94Å; R323-V495 HydrophobicContact CB-CG2 4.27Å; R323-V495 HydrophobicContact CG-CG2 4.17Å
324A93.2Very high91.8Very high0 Ų045 Ų450%023%0.225CC..Hα-helixtrans-64-38.1173.700000111.8E172 A176 T321 A327 G328E172-A324 HydrophobicContact CB-CB 4.43Å; E172-A324 WeakPolarHBondContact O-CB 3.43Å; A176-A324 WeakPolarHBondContact CA-O 3.18Å; A176-A324 HydrophobicContact CB-CB 4.3Å; A176-A324 VanDerWaalsContact CB-O 3.25Å; A176-A324 WeakPolarHBondContact CB-O 3.42Å; T321-A324 WeakPolarHBondContact O-CA 3.46Å; T321-A324 WeakPolarHBondContact O-CB 3.46Å; T321-A324 PolarHBondContact O-N 3.2Å; T321-A324 WeakPolarHBondContact OG1-CB 3.28Å; T321-A324 PolarHBondContact OG1-N 3.18Å; T321-A324 VanDerWaalsContact OG1-N 3.1Å; A324-A327 PolarHBondContact O-N 3.35Å; A324-G328 PolarHBondContact O-N 3.26Å
325L96.3Very high92.7Very high93 Ų9342.1 Ų42.149%0.48721%0.212SC..Hα-helixtrans-59.8-49.3172.6179.567.4000111V179 T321 P322 R323 G328 I329V179-L325 HydrophobicContact CG1-CD1 3.7Å; V179-L325 HydrophobicContact CG2-CD1 4.17Å; T321-L325 PolarHBondContact O-N 3.5Å; P322-L325 WeakPolarHBondContact O-CB 3.49Å; P322-L325 PolarHBondContact O-N 2.96Å; R323-L325 VanDerWaalsContact C-N 3.33Å; L325-G328 PolarHBondContact O-N 3.4Å; L325-I329 HydrophobicContact CD1-CD1 4.44Å; L325-I329 HydrophobicContact CG-CD1 4.19Å; L325-I329 VanDerWaalsContact O-CG1 3.31Å; L325-I329 WeakPolarHBondContact O-CG1 3.39Å; L325-I329 PolarHBondContact O-N 3.26Å
326A95.1Very high93.8Very high7 Ų741.1 Ų41.16%0.05821%0.209CC..Hα-helixtrans-59.6-47.6176.800000113P322 R323 G328 I329 S330 P492 V495 L496P322-A326 PolarHBondContact O-N 3.39Å; R323-A326 PolarHBondContact O-N 3.42Å; A326-G328 VanDerWaalsContact C-N 3.33Å; A326-G328 PolarHBondContact O-N 3.02Å; A326-I329 PolarHBondContact O-N 3.37Å; A326-S330 PolarHBondContact O-N 3.38Å; A326-S330 VanDerWaalsContact O-N 3.12Å; A326-P492 HydrophobicContact CB-CB 4.12Å; A326-P492 WeakPolarHBondContact CB-O 3.5Å; A326-V495 HydrophobicContact CB-CB 4.28Å; A326-V495 HydrophobicContact CB-CG1 4.24Å; A326-L496 HydrophobicContact CB-CB 3.98Å; A326-L496 VanDerWaalsContact O-CD1 3.3Å; A326-L496 WeakPolarHBondContact O-CD1 3.48Å
327A94.4Very high94.4Very high0 Ų038.6 Ų38.60%020%0.197CC..Hα-helixtrans-61.4-42.3175.500000111.4L125 A176 R323 A324 I329 S330 M331 V495L125-A327 HydrophobicContact CB-CB 4.18Å; L125-A327 HydrophobicContact CD1-CB 4.37Å; L125-A327 HydrophobicContact CD2-CB 3.95Å; L125-A327 HydrophobicContact CG-CB 4.41Å; A176-A327 HydrophobicContact CB-CB 4Å; R323-A327 WeakPolarHBondContact O-CB 3.43Å; R323-A327 PolarHBondContact O-N 2.94Å; A324-A327 PolarHBondContact O-N 3.35Å; A327-I329 PolarHBondContact O-N 3.24Å; A327-S330 WeakPolarHBondContact O-CB 3.37Å; A327-S330 PolarHBondContact O-N 3.28Å; A327-M331 VanDerWaalsContact O-CG 3.27Å; A327-M331 WeakPolarHBondContact O-CG 3.22Å; A327-M331 PolarHBondContact O-N 2.67Å; A327-V495 HydrophobicContact CB-CG1 3.94Å
328G96.5Very high94.6Very high0 Ų030.6 Ų30.60%017%0.167CC..Hα-helixtrans-64-38.5178.600000113.4A176 S180 A324 L325 A326 M331 A332A176-G328 WeakPolarHBondContact O-CA 3.12Å; S180-G328 WeakPolarHBondContact CA-O 3.4Å; S180-G328 WeakPolarHBondContact CB-O 3.4Å; A324-G328 PolarHBondContact O-N 3.26Å; L325-G328 PolarHBondContact O-N 3.4Å; A326-G328 VanDerWaalsContact C-N 3.33Å; A326-G328 PolarHBondContact O-N 3.02Å; G328-M331 PolarHBondContact O-N 3.46Å; G328-A332 WeakPolarHBondContact O-CB 3.31Å; G328-A332 PolarHBondContact O-N 2.95Å
329I97.4Very high94.8Very high55 Ų5529.3 Ų29.328%0.28216%0.159SC..Hα-helixtrans-61.7-46.3172-67163.1000110.3L183 L325 A326 A327 A332 L333 L496L183-I329 HydrophobicContact CD2-CB 4.23Å; L183-I329 HydrophobicContact CD2-CG1 4.03Å; L183-I329 HydrophobicContact CD2-CG2 4.13Å; L325-I329 HydrophobicContact CD1-CD1 4.44Å; L325-I329 HydrophobicContact CG-CD1 4.19Å; L325-I329 VanDerWaalsContact O-CG1 3.31Å; L325-I329 WeakPolarHBondContact O-CG1 3.39Å; L325-I329 PolarHBondContact O-N 3.26Å; A326-I329 PolarHBondContact O-N 3.37Å; A327-I329 PolarHBondContact O-N 3.24Å; I329-A332 PolarHBondContact O-N 2.88Å; I329-L333 HydrophobicContact CG2-CD1 4.18Å; I329-L333 WeakPolarHBondContact O-CG 3.17Å; I329-L333 PolarHBondContact O-N 3.49Å; I329-L333 VanDerWaalsContact O-N 3.1Å; I329-L496 HydrophobicContact CB-CD1 3.97Å; I329-L496 HydrophobicContact CG2-CD1 3.83Å
330S95.9Very high95Very high0 Ų027.1 Ų27.10%015%0.147CC..Hα-helixtrans-61-45.7177.2174.40000112.3S121 A326 A327 A332 L333 A334 S499 L500S121-S330 PolarHBondContact OG-OG 3.22Å; A326-S330 PolarHBondContact O-N 3.38Å; A326-S330 VanDerWaalsContact O-N 3.12Å; A327-S330 WeakPolarHBondContact O-CB 3.37Å; A327-S330 PolarHBondContact O-N 3.28Å; S330-A332 VanDerWaalsContact C-N 3.33Å; S330-A332 PolarHBondContact O-N 3.27Å; S330-L333 PolarHBondContact O-N 2.64Å; S330-A334 WeakPolarHBondContact O-CB 3.47Å; S330-A334 PolarHBondContact O-N 3.31Å; S330-S499 WeakPolarHBondContact OG-CB 3.45Å; S330-L500 PolarHBondContact OG-N 2.79Å
331M96.4Very high95Very high0 Ų021.9 Ų21.90%012%0.122CC..Hα-helixtrans-57.6-45.8175.2-70.3173.7-176.800111.2F118 A122 A176 V177 S180 A327 G328 L333 A335F118-M331 HydrophobicContact CD1-CB 3.8Å; F118-M331 HydrophobicContact CD1-CG 3.93Å; F118-M331 HydrophobicContact CD1-SD 3.79Å; F118-M331 HydrophobicContact CE1-CB 3.94Å; A122-M331 HydrophobicContact CB-CE 3.94Å; A176-M331 HydrophobicContact CB-CE 4Å; A176-M331 HydrophobicContact CB-SD 3.99Å; V177-M331 HydrophobicContact CG2-SD 4.21Å; S180-M331 WeakPolarHBondContact OG-CB 3.27Å; A327-M331 VanDerWaalsContact O-CG 3.27Å; A327-M331 WeakPolarHBondContact O-CG 3.22Å; A327-M331 PolarHBondContact O-N 2.67Å; G328-M331 PolarHBondContact O-N 3.46Å; M331-L333 PolarHBondContact O-N 3.4Å; M331-A335 VanDerWaalsContact O-CB 3.26Å; M331-A335 WeakPolarHBondContact O-CB 3.28Å; M331-A335 PolarHBondContact O-N 2.87Å
332A96.9Very high95Very high0 Ų020.7 Ų20.70%011%0.114CC..Hα-helixtrans-59.8-49.9-178.700000111.9S180 L183 Q184 G328 I329 S330 S336S180-A332 WeakPolarHBondContact OG-CA 3.49Å; S180-A332 PolarHBondContact OG-N 2.92Å; L183-A332 HydrophobicContact CB-CB 3.87Å; L183-A332 HydrophobicContact CD2-CB 3.66Å; L183-A332 HydrophobicContact CG-CB 3.88Å; Q184-A332 HydrophobicContact CG-CB 4.02Å; Q184-A332 PolarHBondContact NE2-O 3.18Å; G328-A332 WeakPolarHBondContact O-CB 3.31Å; G328-A332 PolarHBondContact O-N 2.95Å; I329-A332 PolarHBondContact O-N 2.88Å; S330-A332 VanDerWaalsContact C-N 3.33Å; S330-A332 PolarHBondContact O-N 3.27Å; A332-S336 VanDerWaalsContact O-CB 3.24Å; A332-S336 WeakPolarHBondContact O-CB 3.28Å; A332-S336 PolarHBondContact O-N 2.94Å; A332-S336 PolarHBondContact O-OG 3.14Å
333L96.1Very high95Very high53 Ų5316.5 Ų16.528%0.2779%0.087SC..Hα-helixtrans-64.4-48.5-178.2-67.5175.8000111.1M187 I329 S330 M331 S336 T337 L500 F506M187-L333 HydrophobicContact CE-CD2 4.33Å; M187-L333 HydrophobicContact SD-CD2 4.35Å; I329-L333 HydrophobicContact CG2-CD1 4.18Å; I329-L333 WeakPolarHBondContact O-CG 3.17Å; I329-L333 PolarHBondContact O-N 3.49Å; I329-L333 VanDerWaalsContact O-N 3.1Å; S330-L333 PolarHBondContact O-N 2.64Å; M331-L333 PolarHBondContact O-N 3.4Å; L333-S336 PolarHBondContact O-N 3.46Å; L333-T337 PolarHBondContact O-N 2.94Å; L333-T337 PolarHBondContact O-OG1 3.42Å; L333-T337 VanDerWaalsContact O-OG1 3.04Å; L333-L500 HydrophobicContact CB-CD2 4.23Å; L333-L500 HydrophobicContact CD1-CD1 4.49Å; L333-L500 HydrophobicContact CD1-CD2 4.16Å; L333-F506 HydrophobicContact CB-CD2 4.37Å; L333-F506 HydrophobicContact CB-CE2 3.96Å
334A95.3Very high95Very high0 Ų014.1 Ų14.10%08%0.08CC..Hα-helixtrans-63.4-47.7-178.700000112.4E117 S330 S336 T337 S338 Q503 F506E117-A334 HydrophobicContact CB-CB 3.92Å; E117-A334 HydrophobicContact CG-CB 4.1Å; S330-A334 WeakPolarHBondContact O-CB 3.47Å; S330-A334 PolarHBondContact O-N 3.31Å; A334-S336 VanDerWaalsContact C-N 3.35Å; A334-S336 PolarHBondContact O-N 3.37Å; A334-T337 PolarHBondContact O-N 3.43Å; A334-S338 WeakPolarHBondContact O-CB 3.33Å; A334-S338 PolarHBondContact O-N 3Å; A334-Q503 HydrophobicContact CB-CB 4.16Å; A334-Q503 HydrophobicContact CB-CG 3.76Å; A334-F506 HydrophobicContact CB-CB 4.22Å
335A95.5Very high95Very high0 Ų014.1 Ų14.10%08%0.08CC..Hα-helixtrans-67.2-34177.400000112.2E117 F118 Q184 M331 T337 S338 S339 A384E117-A335 HydrophobicContact CB-CB 4.5Å; F118-A335 HydrophobicContact CE2-CB 3.74Å; F118-A335 HydrophobicContact CZ-CB 3.85Å; Q184-A335 VanDerWaalsContact NE2-CB 3.25Å; M331-A335 VanDerWaalsContact O-CB 3.26Å; M331-A335 WeakPolarHBondContact O-CB 3.28Å; M331-A335 PolarHBondContact O-N 2.87Å; A335-T337 PolarHBondContact O-N 3.48Å; A335-S338 PolarHBondContact O-N 2.94Å; A335-S339 WeakPolarHBondContact O-CB 3.15Å; A335-S339 PolarHBondContact O-N 3.44Å; A335-S339 PolarHBondContact O-OG 2.94Å; A335-A384 HydrophobicContact CB-CB 4.12Å
336S95.4Very high94.8Very high6 Ų69.7 Ų9.74%0.0426%0.057CC..Hα-helixtrans-61.4-45.7173.7-60.10000112A332 L333 A334 S339 L340A332-S336 VanDerWaalsContact O-CB 3.24Å; A332-S336 WeakPolarHBondContact O-CB 3.28Å; A332-S336 PolarHBondContact O-N 2.94Å; A332-S336 PolarHBondContact O-OG 3.14Å; L333-S336 PolarHBondContact O-N 3.46Å; A334-S336 VanDerWaalsContact C-N 3.35Å; A334-S336 PolarHBondContact O-N 3.37Å; S336-S339 PolarHBondContact O-N 2.88Å; S336-L340 WeakPolarHBondContact O-CG 3.3Å; S336-L340 PolarHBondContact O-N 3.36Å; S336-L340 VanDerWaalsContact O-N 3.08Å
337T93.8Very high94.5Very high42 Ų429.5 Ų9.526%0.2586%0.055SC..Hα-helixtrans-62.7-44.9177.5-52.10000111.2L333 A334 A335 G341L333-T337 PolarHBondContact O-N 2.94Å; L333-T337 PolarHBondContact O-OG1 3.42Å; L333-T337 VanDerWaalsContact O-OG1 3.04Å; A334-T337 PolarHBondContact O-N 3.43Å; A335-T337 PolarHBondContact O-N 3.48Å; T337-G341 PolarHBondContact O-N 3.42Å; T337-G341 VanDerWaalsContact O-N 3.13Å
338S94.4Very high94.1Very high1 Ų113.2 Ų13.21%0.0077%0.069CC..Hα-helixtrans-60.4-46.5177.6-171.50000112.3E117 A334 A335 G341 C342 F387E117-S338 WeakPolarHBondContact OE1-CB 3.28Å; E117-S338 PolarHBondContact OE1-OG 3.04Å; A334-S338 WeakPolarHBondContact O-CB 3.33Å; A334-S338 PolarHBondContact O-N 3Å; A335-S338 PolarHBondContact O-N 2.94Å; S338-G341 WeakPolarHBondContact O-CA 3.2Å; S338-G341 PolarHBondContact O-N 3.08Å; S338-G341 VanDerWaalsContact O-N 3.16Å; S338-C342 PolarHBondContact O-N 3.44Å; S338-F387 WeakPolarHBondContact O-CZ 3.46Å; S338-F387 WeakPolarHBondContact OG-CE2 3.08Å
339S95.4Very high93.7Very high0 Ų015.1 Ų15.10%08%0.08CC..Hα-helixtrans-67.3-39.3-179-71.80000113.3A335 S336 G341 C342 Y343 E367 S385A335-S339 WeakPolarHBondContact O-CB 3.15Å; A335-S339 PolarHBondContact O-N 3.44Å; A335-S339 PolarHBondContact O-OG 2.94Å; S336-S339 PolarHBondContact O-N 2.88Å; S339-G341 VanDerWaalsContact C-N 3.29Å; S339-G341 PolarHBondContact O-N 3.46Å; S339-C342 WeakPolarHBondContact O-CA 3.5Å; S339-C342 WeakPolarHBondContact O-CB 3.41Å; S339-C342 PolarHBondContact O-N 3.43Å; S339-C342 VanDerWaalsContact O-N 3.11Å; S339-Y343 WeakPolarHBondContact O-CD1 3.49Å; S339-Y343 WeakPolarHBondContact O-CE1 3.49Å; S339-Y343 VanDerWaalsContact O-CG 3.29Å; S339-Y343 PolarHBondContact O-N 3.08Å; S339-E367 VanDerWaalsContact CB-OE1 3.29Å; S339-E367 WeakPolarHBondContact CB-OE1 3.34Å; S339-E367 WeakPolarHBondContact CB-OE2 3.31Å; S339-E367 PolarHBondContact OG-OE1 3.37Å; S339-E367 PolarHBondContact OG-OE2 2.97Å; S339-S385 PolarHBondContact OG-N 2.55Å; S339-S385 VanDerWaalsContact OG-N 3.14Å
340L93.9Very high93.2Very high22 Ų2212.9 Ų12.912%0.1157%0.068CC..Hα-helixtrans-61.6-39171.7-70.5174.1000112.1P193 F197 S336 C342 Y343 A344 C360P193-L340 HydrophobicContact CB-CD1 4.24Å; P193-L340 HydrophobicContact CB-CD2 4Å; F197-L340 HydrophobicContact CD2-CB 4.06Å; F197-L340 HydrophobicContact CD2-CD1 4.49Å; F197-L340 HydrophobicContact CD2-CD2 4.01Å; F197-L340 HydrophobicContact CD2-CG 4.41Å; F197-L340 HydrophobicContact CE2-CB 4.26Å; S336-L340 WeakPolarHBondContact O-CG 3.3Å; S336-L340 PolarHBondContact O-N 3.36Å; S336-L340 VanDerWaalsContact O-N 3.08Å; L340-C342 VanDerWaalsContact C-N 3.33Å; L340-C342 PolarHBondContact O-N 3.41Å; L340-Y343 HydrophobicContact CD2-CD2 4.04Å; L340-Y343 HydrophobicContact CD2-CE2 4.3Å; L340-Y343 PolarHBondContact O-N 3.26Å; L340-A344 PolarHBondContact O-N 3.18Å; L340-A344 VanDerWaalsContact O-N 3.07Å; L340-C360 HydrophobicContact CD2-CB 3.87Å
341G93.3Very high92.7Very high7 Ų719.8 Ų19.87%0.07210%0.1CC..Hα-helixtrans-59.8-42.3171.200000112.4T337 S338 S339 Y343 A344 L345T337-G341 PolarHBondContact O-N 3.42Å; T337-G341 VanDerWaalsContact O-N 3.13Å; S338-G341 WeakPolarHBondContact O-CA 3.2Å; S338-G341 PolarHBondContact O-N 3.08Å; S338-G341 VanDerWaalsContact O-N 3.16Å; S339-G341 VanDerWaalsContact C-N 3.29Å; S339-G341 PolarHBondContact O-N 3.46Å; G341-Y343 PolarHBondContact O-N 3.14Å; G341-A344 PolarHBondContact O-N 3.45Å; G341-L345 VanDerWaalsContact O-CB 3.28Å; G341-L345 WeakPolarHBondContact O-CB 3.4Å; G341-L345 PolarHBondContact O-N 2.96Å
342C94.7Very high92Very high0 Ų021.5 Ų21.50%011%0.109CC..Hα-helixtrans-63.4-37.7174.1-74.50000112.8L110 S338 S339 L340 L345 C346 S385 F387 V390L110-C342 HydrophobicContact CD2-CB 4.46Å; S338-C342 PolarHBondContact O-N 3.44Å; S339-C342 WeakPolarHBondContact O-CA 3.5Å; S339-C342 WeakPolarHBondContact O-CB 3.41Å; S339-C342 PolarHBondContact O-N 3.43Å; S339-C342 VanDerWaalsContact O-N 3.11Å; L340-C342 VanDerWaalsContact C-N 3.33Å; L340-C342 PolarHBondContact O-N 3.41Å; C342-L345 PolarHBondContact O-N 2.67Å; C342-C346 WeakPolarHBondContact O-CB 3.45Å; C342-C346 PolarHBondContact O-N 3.07Å; C342-S385 PolarHBondContact SG-O 2.62Å; C342-F387 HydrophobicContact CB-CE1 4.49Å; C342-F387 WeakPolarHBondContact SG-CD1 2.94Å; C342-F387 WeakPolarHBondContact SG-CE1 3.24Å; C342-V390 HydrophobicContact CB-CG2 4.37Å
343Y93.5Very high91.4Very high0 Ų023.9 Ų23.90%012%0.124CC..Hα-helixtrans-64.7-47.4179-62.5-0.3000110.1Q101 L110 S339 L340 G341 G347 C360 G363 L364 E367 S385Q101-Y343 VanDerWaalsContact NE2-CE1 3.34Å; Q101-Y343 VanDerWaalsContact NE2-CZ 3.3Å; Q101-Y343 PolarHBondContact NE2-OH 2.98Å; L110-Y343 HydrophobicContact CD1-CD1 3.14Å; L110-Y343 HydrophobicContact CD1-CE1 3.42Å; L110-Y343 VanDerWaalsContact CD1-CE1 3.42Å; L110-Y343 HydrophobicContact CD1-CG 4.16Å; S339-Y343 WeakPolarHBondContact O-CD1 3.49Å; S339-Y343 WeakPolarHBondContact O-CE1 3.49Å; S339-Y343 VanDerWaalsContact O-CG 3.29Å; S339-Y343 PolarHBondContact O-N 3.08Å; L340-Y343 HydrophobicContact CD2-CD2 4.04Å; L340-Y343 HydrophobicContact CD2-CE2 4.3Å; L340-Y343 PolarHBondContact O-N 3.26Å; G341-Y343 PolarHBondContact O-N 3.14Å; Y343-G347 PolarHBondContact O-N 3.45Å; Y343-G347 VanDerWaalsContact O-N 3.08Å; Y343-C360 HydrophobicContact CD2-CB 4.41Å; Y343-G363 PolarHBondContact OH-O 3.02Å; Y343-L364 PolarHBondContact OH-N 3.4Å; Y343-E367 PolarHBondContact OH-OE2 2.97Å; Y343-S385 VanDerWaalsContact CE1-OG 3.31Å; Y343-S385 WeakPolarHBondContact CE1-OG 3.11Å
344A91.8Very high90.7Very high10 Ų1026.4 Ų26.48%0.08314%0.144CC..Hα-helixtrans-60.8-48.3175.800000111.7F197 L205 L340 G341 G347 R348F197-A344 HydrophobicContact CE2-CB 4.14Å; F197-A344 HydrophobicContact CZ-CB 3.89Å; L205-A344 HydrophobicContact CD1-CB 3.96Å; L205-A344 HydrophobicContact CD2-CB 4.15Å; L340-A344 PolarHBondContact O-N 3.18Å; L340-A344 VanDerWaalsContact O-N 3.07Å; G341-A344 PolarHBondContact O-N 3.45Å; A344-G347 PolarHBondContact O-N 3.32Å; A344-R348 WeakPolarHBondContact O-CG 3.39Å; A344-R348 PolarHBondContact O-N 3.05Å
345L92.8Very high90.3Very high1 Ų126.8 Ų26.81%0.00515%0.147CC..Hα-helixtrans-63.5-44.4-178.9177.862.4000112L209 G341 C342 R348 L349 F387 V390 V443 A446L209-L345 HydrophobicContact CD1-CB 4.39Å; L209-L345 HydrophobicContact CD1-CD1 4.15Å; L209-L345 HydrophobicContact CD2-CB 4.16Å; L209-L345 HydrophobicContact CD2-CD2 4.07Å; G341-L345 VanDerWaalsContact O-CB 3.28Å; G341-L345 WeakPolarHBondContact O-CB 3.4Å; G341-L345 PolarHBondContact O-N 2.96Å; C342-L345 PolarHBondContact O-N 2.67Å; L345-R348 PolarHBondContact O-N 3.48Å; L345-L349 HydrophobicContact CD1-CD1 3.9Å; L345-L349 HydrophobicContact CD1-CD2 4.48Å; L345-L349 HydrophobicContact CD1-CG 3.93Å; L345-L349 HydrophobicContact CD2-CD1 4.49Å; L345-L349 HydrophobicContact CG-CD1 3.91Å; L345-L349 HydrophobicContact CG-CG 4.32Å; L345-L349 WeakPolarHBondContact O-CG 3.39Å; L345-L349 PolarHBondContact O-N 3.34Å; L345-F387 HydrophobicContact CD2-CD1 4.06Å; L345-F387 HydrophobicContact CD2-CE1 4.29Å; L345-V390 HydrophobicContact CB-CG1 4.1Å; L345-V390 HydrophobicContact CD2-CB 4.27Å; L345-V390 HydrophobicContact CD2-CG1 3.55Å; L345-V390 HydrophobicContact CG-CG1 3.54Å; L345-V443 HydrophobicContact CD2-CG1 4.07Å; L345-V443 HydrophobicContact CD2-CG2 4.18Å; L345-A446 HydrophobicContact CD1-CB 3.37Å
346C92.2Very high89.8Confident0 Ų028.4 Ų28.40%016%0.157CC..Hα-helixtrans-63.4-45179.4-175.90000111.5L108 L110 C342 R348 L349 L350 V390L108-C346 HydrophobicContact CD1-CB 4.48Å; L110-C346 HydrophobicContact CD2-CB 3.61Å; L110-C346 HydrophobicContact CG-CB 4.42Å; C342-C346 WeakPolarHBondContact O-CB 3.45Å; C342-C346 PolarHBondContact O-N 3.07Å; C346-R348 VanDerWaalsContact C-N 3.31Å; C346-R348 PolarHBondContact O-N 2.95Å; C346-L349 PolarHBondContact O-N 3.15Å; C346-L350 WeakPolarHBondContact O-CB 3.38Å; C346-L350 WeakPolarHBondContact O-CG 3.48Å; C346-L350 PolarHBondContact O-N 3.49Å; C346-V390 HydrophobicContact CB-CG1 4.04Å; C346-V390 HydrophobicContact CB-CG2 4.36Å
347G88.6Confident89.4Confident2 Ų231 Ų312%0.02117%0.174CC..Hα-helixtrans-56.7-46.5174.200000111.6Y343 A344 L350 H351 L352Y343-G347 PolarHBondContact O-N 3.45Å; Y343-G347 VanDerWaalsContact O-N 3.08Å; A344-G347 PolarHBondContact O-N 3.32Å; G347-L350 CarbonylContact O-C 3.53Å; G347-L350 PolarHBondContact O-N 3.16Å; G347-H351 PolarHBondContact O-N 3.5Å; G347-H351 VanDerWaalsContact O-N 3.08Å; G347-L352 PolarHBondContact O-N 3.45Å
348R87.1Confident89Confident78 Ų7830.8 Ų30.829%0.29417%0.17SC..Hα-helixtrans-62.9-47.8178.2-74.6-177.261.6147.14.1114A344 L345 C346 L350 H351 S449 S450A344-R348 WeakPolarHBondContact O-CG 3.39Å; A344-R348 PolarHBondContact O-N 3.05Å; L345-R348 PolarHBondContact O-N 3.48Å; C346-R348 VanDerWaalsContact C-N 3.31Å; C346-R348 PolarHBondContact O-N 2.95Å; R348-L350 PolarHBondContact O-N 2.87Å; R348-H351 PolarHBondContact O-N 2.89Å; R348-H351 VanDerWaalsContact O-N 3.13Å; R348-S449 PolarHBondContact NH2-O 3.08Å; R348-S450 VanDerWaalsContact NH1-CA 3.27Å; R348-S450 PolarHBondContact NH1-OG 3.22Å
349L87.3Confident88.7Confident41 Ų4130.8 Ų30.822%0.21517%0.17CC..Hα-helixtrans-66.1-25.8-179.4-70.2175.9000112.6L345 C346 V390 A446L345-L349 HydrophobicContact CD1-CD1 3.9Å; L345-L349 HydrophobicContact CD1-CD2 4.48Å; L345-L349 HydrophobicContact CD1-CG 3.93Å; L345-L349 HydrophobicContact CD2-CD1 4.49Å; L345-L349 HydrophobicContact CG-CD1 3.91Å; L345-L349 HydrophobicContact CG-CG 4.32Å; L345-L349 WeakPolarHBondContact O-CG 3.39Å; L345-L349 PolarHBondContact O-N 3.34Å; C346-L349 PolarHBondContact O-N 3.15Å; L349-V390 HydrophobicContact CD1-CG1 3.86Å; L349-V390 VanDerWaalsContact CD1-O 3.32Å; L349-V390 WeakPolarHBondContact CD1-O 3.42Å; L349-A446 HydrophobicContact CD2-CB 4.49Å
350L86.6Confident88.5Confident8 Ų830.8 Ų30.84%0.04217%0.17CC..THydrogen-bonded Turntrans-95.96.1176.3-64.5177.8000113.4P109 C346 G347 R348 L352 V393P109-L350 HydrophobicContact CG-CD1 3.49Å; P109-L350 VanDerWaalsContact CG-CD1 3.49Å; C346-L350 WeakPolarHBondContact O-CB 3.38Å; C346-L350 WeakPolarHBondContact O-CG 3.48Å; C346-L350 PolarHBondContact O-N 3.49Å; G347-L350 CarbonylContact O-C 3.53Å; G347-L350 PolarHBondContact O-N 3.16Å; R348-L350 PolarHBondContact O-N 2.87Å; L350-L352 HydrophobicContact CB-CD1 3.91Å; L350-L352 HydrophobicContact CB-CG 3.82Å; L350-L352 HydrophobicContact CD1-CD1 4.17Å; L350-L352 PolarHBondContact O-N 3.48Å; L350-V393 HydrophobicContact CD2-CG1 3.47Å; L350-V393 VanDerWaalsContact CD2-CG1 3.47Å; L350-V393 HydrophobicContact CG-CG1 3.96Å
351H85.1Confident88.4Confident145 Ų14529.8 Ų29.867%0.67116%0.164SC*.THydrogen-bonded Turntrans5237.1-176.4-60-75.8000113.4G347 R348G347-H351 PolarHBondContact O-N 3.5Å; G347-H351 VanDerWaalsContact O-N 3.08Å; R348-H351 PolarHBondContact O-N 2.89Å; R348-H351 VanDerWaalsContact O-N 3.13Å
352L83.5Confident88.3Confident35 Ų3529.9 Ų29.918%0.18316%0.163CC..PPolyproline II helixtrans-90.7153.9174.2-61.5175.9000110.1L108 G347 L350 V554L108-L352 HydrophobicContact CD2-CD1 3.63Å; G347-L352 PolarHBondContact O-N 3.45Å; L350-L352 HydrophobicContact CB-CD1 3.91Å; L350-L352 HydrophobicContact CB-CG 3.82Å; L350-L352 HydrophobicContact CD1-CD1 4.17Å; L350-L352 PolarHBondContact O-N 3.48Å; L352-V554 HydrophobicContact CD1-CG1 4.16Å; L352-V554 HydrophobicContact CD2-CG2 4.17Å
353P83.1Confident88.3Confident50 Ų5029.9 Ų29.933%0.32516%0.163SC..PPolyproline II helixtrans-60.3157.4172.328.5-36.2000110.4A551 Y555P353-A551 HydrophobicContact CG-CB 3.79Å; P353-Y555 HydrophobicContact CG-CE2 4.15Å; P353-Y555 PolarHBondContact O-OH 3.04Å
354P82.6Confident88.3Confident107 Ų10729.9 Ų29.970%0.69516%0.163SC*.PPolyproline II helixtrans-56.7140178.924.4-33.8000110.6
355P85.6Confident88.5Confident8 Ų830 Ų305%0.05216%0.163CC..PPolyproline II helixtrans-64.6128.2-17525.5-32.4000109.9F197 Y555F197-P355 HydrophobicContact CE1-CG 3.64Å; F197-P355 HydrophobicContact CZ-CG 3.74Å; P355-Y555 HydrophobicContact CB-CE1 3.96Å
356P86.2Confident88.6Confident33 Ų3331 Ų3121%0.21417%0.168CC..PPolyproline II helixtrans-69.9157.8-17828.5-35.4000111.3H358 A359 C360 Y555P356-H358 VanDerWaalsContact C-N 3.28Å; P356-H358 VanDerWaalsContact CB-CE1 3.49Å; P356-H358 WeakPolarHBondContact CB-CE1 3.47Å; P356-H358 WeakPolarHBondContact CG-CE1 3.45Å; P356-H358 PolarHBondContact O-N 3.49Å; P356-H358 VanDerWaalsContact O-N 3.12Å; P356-A359 HydrophobicContact CG-CB 3.88Å; P356-A359 WeakPolarHBondContact O-CB 3.23Å; P356-A359 PolarHBondContact O-N 3.21Å; P356-C360 PolarHBondContact O-N 2.85Å; P356-Y555 HydrophobicContact CG-CD2 4.3Å; P356-Y555 HydrophobicContact CG-CG 4.09Å
357P86.3Confident88.7Confident62 Ų6231 Ų3140%0.40317%0.168SC..Hα-helixtrans-47.3-45.1-178.3-34.838.6000115.1G194 P198 A359 C360 S361G194-P357 WeakPolarHBondContact O-CB 3.39Å; P198-P357 HydrophobicContact CG-CG 4.18Å; P357-A359 VanDerWaalsContact C-N 3.33Å; P357-A359 PolarHBondContact O-N 2.76Å; P357-C360 PolarHBondContact O-N 2.88Å; P357-S361 PolarHBondContact O-N 3.01Å; P357-S361 PolarHBondContact O-OG 3.32Å
358H84.9Confident89.1Confident37 Ų3730.9 Ų30.917%0.17117%0.167CC..Hα-helixtrans-66.9-33.3-178.664.8-94.1000112.7P356 R362 C574P356-H358 VanDerWaalsContact C-N 3.28Å; P356-H358 VanDerWaalsContact CB-CE1 3.49Å; P356-H358 WeakPolarHBondContact CB-CE1 3.47Å; P356-H358 WeakPolarHBondContact CG-CE1 3.45Å; P356-H358 PolarHBondContact O-N 3.49Å; P356-H358 VanDerWaalsContact O-N 3.12Å; H358-R362 WeakPolarHBondContact O-CB 3.21Å; H358-R362 PolarHBondContact O-N 3.47Å; H358-C574 VanDerWaalsContact CA-O 3.28Å; H358-C574 WeakPolarHBondContact CA-O 3.46Å; H358-C574 VanDerWaalsContact CB-O 3.3Å; H358-C574 WeakPolarHBondContact CB-O 3.04Å
359A88.6Confident89.5Confident0 Ų031.6 Ų31.60%018%0.176CC..Hα-helixtrans-70.8-37.6176.800000111.3P356 P357 G363 Y555P356-A359 HydrophobicContact CG-CB 3.88Å; P356-A359 WeakPolarHBondContact O-CB 3.23Å; P356-A359 PolarHBondContact O-N 3.21Å; P357-A359 VanDerWaalsContact C-N 3.33Å; P357-A359 PolarHBondContact O-N 2.76Å; A359-G363 PolarHBondContact O-N 3.31Å; A359-Y555 HydrophobicContact CB-CD1 3.73Å; A359-Y555 HydrophobicContact CB-CE1 4.45Å; A359-Y555 HydrophobicContact CB-CG 4.32Å
360C90.8Very high89.9Confident0 Ų029.7 Ų29.70%017%0.167CC..Hα-helixtrans-64.9-47.6174.2-66.80000111.7P193 L340 Y343 P356 P357 G363 L364P193-C360 HydrophobicContact CB-CB 4.26Å; L340-C360 HydrophobicContact CD2-CB 3.87Å; Y343-C360 HydrophobicContact CD2-CB 4.41Å; P356-C360 PolarHBondContact O-N 2.85Å; P357-C360 PolarHBondContact O-N 2.88Å; C360-G363 PolarHBondContact O-N 3.38Å; C360-L364 PolarHBondContact O-N 2.87Å
361S91.9Very high90.3Very high1 Ų129.3 Ų29.31%0.00717%0.165CC..Hα-helixtrans-61.6-43.3178.1-75.10000113.1G188 G191 G194 P357 S365G188-S361 CarbonylContact C-O 3.6Å; G188-S361 VanDerWaalsContact CA-O 3.23Å; G188-S361 WeakPolarHBondContact CA-O 3.48Å; G188-S361 WeakPolarHBondContact O-CB 3.36Å; G191-S361 VanDerWaalsContact CA-OG 3.31Å; G191-S361 WeakPolarHBondContact CA-OG 3.35Å; G194-S361 PolarHBondContact N-OG 3.35Å; P357-S361 PolarHBondContact O-N 3.01Å; P357-S361 PolarHBondContact O-OG 3.32Å; S361-S365 WeakPolarHBondContact O-CB 3.22Å; S361-S365 PolarHBondContact O-N 3.48Å; S361-S365 PolarHBondContact O-OG 3.15Å
362R92.3Very high90.9Very high9 Ų923.5 Ų23.53%0.03414%0.139CC..Hα-helixtrans-71.9-35.4177.6-167.117667.6-148.83.7113M104 G105 H358 S365 L366 Y555 L575M104-R362 WeakPolarHBondContact O-CD 3.28Å; M104-R362 WeakPolarHBondContact O-CG 3.42Å; M104-R362 PolarHBondContact O-NE 3.04Å; G105-R362 PolarHBondContact O-NE 2.94Å; G105-R362 PolarHBondContact O-NH2 3.42Å; H358-R362 WeakPolarHBondContact O-CB 3.21Å; H358-R362 PolarHBondContact O-N 3.47Å; R362-S365 PolarHBondContact O-OG 3.01Å; R362-L366 WeakPolarHBondContact O-CG 3.46Å; R362-L366 PolarHBondContact O-N 3.43Å; R362-Y555 PolarHBondContact NH2-O 3.33Å; R362-L575 HydrophobicContact CB-CD2 4.03Å; R362-L575 HydrophobicContact CG-CD2 4.45Å; R362-L575 PolarHBondContact NH1-O 2.72Å
363G93.4Very high91.5Very high0 Ų024 Ų240%014%0.141CC..Hα-helixtrans-61.2-52.1172.500000111.3Q101 Y343 A359 C360 S365 L366 E367Q101-G363 VanDerWaalsContact OE1-CA 3.23Å; Q101-G363 PolarHBondContact OE1-O 3.41Å; Q101-G363 VanDerWaalsContact OE1-O 3.04Å; Y343-G363 PolarHBondContact OH-O 3.02Å; A359-G363 PolarHBondContact O-N 3.31Å; C360-G363 PolarHBondContact O-N 3.38Å; G363-S365 VanDerWaalsContact C-N 3.32Å; G363-S365 PolarHBondContact O-N 3.38Å; G363-L366 PolarHBondContact O-N 3.46Å; G363-E367 WeakPolarHBondContact O-CB 3.36Å; G363-E367 PolarHBondContact O-N 3.37Å
364L94.9Very high92Very high1 Ų121.6 Ų21.61%0.00513%0.126CC..Hα-helixtrans-65.7-35-178.2-168.167.8000112.5Q184 M187 P193 Y343 C360 E367 G368Q184-L364 HydrophobicContact CB-CD1 4.47Å; Q184-L364 HydrophobicContact CB-CG 4.4Å; Q184-L364 HydrophobicContact CG-CD1 4.4Å; M187-L364 HydrophobicContact CB-CD2 4.24Å; P193-L364 HydrophobicContact CB-CD2 4.38Å; P193-L364 HydrophobicContact CG-CB 4.08Å; P193-L364 HydrophobicContact CG-CD2 3.33Å; P193-L364 HydrophobicContact CG-CG 4.34Å; Y343-L364 PolarHBondContact OH-N 3.4Å; C360-L364 PolarHBondContact O-N 2.87Å; L364-E367 PolarHBondContact O-N 2.89Å; L364-G368 PolarHBondContact O-N 3.03Å
365S94.7Very high92.5Very high11 Ų1116.5 Ų16.58%0.0779%0.093CC..Hα-helixtrans-65.7-41.6179.466.30000112.6S361 R362 G363 G368 L369S361-S365 WeakPolarHBondContact O-CB 3.22Å; S361-S365 PolarHBondContact O-N 3.48Å; S361-S365 PolarHBondContact O-OG 3.15Å; R362-S365 PolarHBondContact O-OG 3.01Å; G363-S365 VanDerWaalsContact C-N 3.32Å; G363-S365 PolarHBondContact O-N 3.38Å; S365-G368 PolarHBondContact O-N 3.05Å; S365-L369 PolarHBondContact O-N 3.14Å; S365-L369 VanDerWaalsContact O-N 3.08Å
366L94.8Very high92.9Very high23 Ų2318.4 Ų18.412%0.1210%0.102CC..Hα-helixtrans-75.6-33178-65.5-173.2000112.8L100 M104 R362 G363 G368 L369 G370L100-L366 HydrophobicContact CB-CB 4.28Å; L100-L366 HydrophobicContact CB-CD1 4.23Å; L100-L366 WeakPolarHBondContact O-CD1 3.43Å; M104-L366 VanDerWaalsContact C-CD1 3.42Å; M104-L366 HydrophobicContact CB-CD1 3.49Å; M104-L366 VanDerWaalsContact CB-CD1 3.49Å; R362-L366 WeakPolarHBondContact O-CG 3.46Å; R362-L366 PolarHBondContact O-N 3.43Å; G363-L366 PolarHBondContact O-N 3.46Å; L366-G368 VanDerWaalsContact C-N 3.31Å; L366-L369 HydrophobicContact CD2-CD2 4.49Å; L366-L369 WeakPolarHBondContact O-CB 3.33Å; L366-L369 PolarHBondContact O-N 3.49Å; L366-G370 PolarHBondContact O-N 3.36Å
367E95.4Very high93.1Very high0 Ų017 Ų170%09%0.093CC..Hα-helixtrans-60.8-43.1169.7-174.3174.4132.800111Q112 S339 Y343 G363 L364 L369 G370 S371 T383 A384 S385Q112-E367 PolarHBondContact OE1-OE2 3.07Å; S339-E367 VanDerWaalsContact CB-OE1 3.29Å; S339-E367 WeakPolarHBondContact CB-OE1 3.34Å; S339-E367 WeakPolarHBondContact CB-OE2 3.31Å; S339-E367 PolarHBondContact OG-OE1 3.37Å; S339-E367 PolarHBondContact OG-OE2 2.97Å; Y343-E367 PolarHBondContact OH-OE2 2.97Å; G363-E367 WeakPolarHBondContact O-CB 3.36Å; G363-E367 PolarHBondContact O-N 3.37Å; L364-E367 PolarHBondContact O-N 2.89Å; E367-L369 PolarHBondContact O-N 2.99Å; E367-G370 PolarHBondContact O-N 2.97Å; E367-G370 VanDerWaalsContact O-N 3.16Å; E367-S371 PolarHBondContact O-N 3.21Å; E367-S371 PolarHBondContact O-OG 3.17Å; E367-T383 VanDerWaalsContact CG-O 3.27Å; E367-T383 WeakPolarHBondContact CG-O 3.27Å; E367-T383 PolarHBondContact O-OG1 3.02Å; E367-A384 VanDerWaalsContact OE1-CA 3.27Å; E367-A384 WeakPolarHBondContact OE1-CA 3.45Å; E367-A384 WeakPolarHBondContact OE1-CB 3.29Å; E367-S385 PolarHBondContact OE2-OG 3.39Å
368G96Very high93.1Very high0 Ų014.9 Ų14.90%08%0.083CC..Hα-helixtrans-59.4-42.5172.300000112.8G181 L364 S365 L366 G370 S371 V372G181-G368 CarbonylContact C-O 3.57Å; G181-G368 WeakPolarHBondContact CA-O 3.3Å; G181-G368 CarbonylContact O-C 3.53Å; G181-G368 WeakPolarHBondContact O-CA 3.33Å; L364-G368 PolarHBondContact O-N 3.03Å; S365-G368 PolarHBondContact O-N 3.05Å; L366-G368 VanDerWaalsContact C-N 3.31Å; G368-G370 VanDerWaalsContact C-N 3.33Å; G368-G370 PolarHBondContact O-N 3.46Å; G368-S371 WeakPolarHBondContact O-CB 2.99Å; G368-S371 PolarHBondContact O-N 3.3Å; G368-V372 WeakPolarHBondContact O-CG2 3.27Å; G368-V372 PolarHBondContact O-N 2.97Å
369L95.8Very high93.1Very high93 Ų9313.2 Ų13.249%0.4878%0.075SC..Hα-helixtrans-61.7-40.5174.4-176.263000112.1L100 S365 L366 E367 S371 V372 L373L100-L369 HydrophobicContact CD1-CD2 4.09Å; S365-L369 PolarHBondContact O-N 3.14Å; S365-L369 VanDerWaalsContact O-N 3.08Å; L366-L369 HydrophobicContact CD2-CD2 4.49Å; L366-L369 WeakPolarHBondContact O-CB 3.33Å; L366-L369 PolarHBondContact O-N 3.49Å; E367-L369 PolarHBondContact O-N 2.99Å; L369-S371 VanDerWaalsContact C-N 3.34Å; L369-V372 PolarHBondContact O-N 3.33Å; L369-L373 PolarHBondContact O-N 3.38Å
370G95.4Very high92.7Very high1 Ų113.3 Ų13.31%0.018%0.076CC..Hα-helixtrans-61.1-41172.700000112.8L366 E367 G368 L373 A374 T383L366-G370 PolarHBondContact O-N 3.36Å; E367-G370 PolarHBondContact O-N 2.97Å; E367-G370 VanDerWaalsContact O-N 3.16Å; G368-G370 VanDerWaalsContact C-N 3.33Å; G368-G370 PolarHBondContact O-N 3.46Å; G370-L373 PolarHBondContact O-N 3.11Å; G370-A374 WeakPolarHBondContact O-CB 3.32Å; G370-A374 PolarHBondContact O-N 3.25Å; G370-T383 VanDerWaalsContact C-OG1 3.26Å
371S96Very high92.5Very high0 Ų013.3 Ų13.30%08%0.076CC..Hα-helixtrans-66.6-39.8175.1-72.30000112.7V177 E367 G368 L369 A374 G375 T383V177-S371 WeakPolarHBondContact CG1-O 3.4Å; E367-S371 PolarHBondContact O-N 3.21Å; E367-S371 PolarHBondContact O-OG 3.17Å; G368-S371 WeakPolarHBondContact O-CB 2.99Å; G368-S371 PolarHBondContact O-N 3.3Å; L369-S371 VanDerWaalsContact C-N 3.34Å; S371-A374 PolarHBondContact O-N 3.15Å; S371-G375 PolarHBondContact O-N 3.49Å; S371-T383 PolarHBondContact N-OG1 3.47Å; S371-T383 PolarHBondContact OG-N 2.85Å; S371-T383 PolarHBondContact OG-O 3.45Å
372V96.8Very high92.4Very high23 Ų2313.3 Ų13.314%0.1398%0.076CC..Hα-helixtrans-59.7-48.5172.1173.20000110.2G181 L182 G368 L369 A374 G375 L376G181-V372 VanDerWaalsContact C-CG2 3.49Å; L182-V372 HydrophobicContact CD2-CG2 3.97Å; L182-V372 HydrophobicContact CG-CG2 3.94Å; G368-V372 WeakPolarHBondContact O-CG2 3.27Å; G368-V372 PolarHBondContact O-N 2.97Å; L369-V372 PolarHBondContact O-N 3.33Å; V372-A374 VanDerWaalsContact C-N 3.32Å; V372-A374 PolarHBondContact O-N 3.18Å; V372-G375 PolarHBondContact O-N 3.41Å; V372-L376 HydrophobicContact CG1-CD1 3.89Å; V372-L376 HydrophobicContact CG1-CG 4.26Å; V372-L376 VanDerWaalsContact O-CG 3.29Å; V372-L376 WeakPolarHBondContact O-CG 3.43Å; V372-L376 PolarHBondContact O-N 2.78Å
373L95.3Very high92.5Very high44 Ų4412.9 Ų12.923%0.238%0.075CC..Hα-helixtrans-58.4-45.5177179.364.2000111.2V96 L369 G370 G375 L376 L377V96-L373 HydrophobicContact CB-CD2 3.89Å; V96-L373 HydrophobicContact CG1-CD2 3.75Å; V96-L373 HydrophobicContact CG2-CD2 4.14Å; L369-L373 PolarHBondContact O-N 3.38Å; G370-L373 PolarHBondContact O-N 3.11Å; L373-G375 PolarHBondContact O-N 3.29Å; L373-L376 PolarHBondContact O-N 3.19Å; L373-L377 HydrophobicContact CD1-CD1 4.02Å; L373-L377 HydrophobicContact CD1-CG 4.08Å; L373-L377 HydrophobicContact CG-CD1 3.98Å; L373-L377 HydrophobicContact CG-CG 4.38Å; L373-L377 WeakPolarHBondContact O-CB 3.34Å; L373-L377 VanDerWaalsContact O-CG 3.26Å; L373-L377 WeakPolarHBondContact O-CG 3.44Å; L373-L377 PolarHBondContact O-N 2.51Å
374A93.9Very high92.5Very high0 Ų012.9 Ų12.90%08%0.075CC..Hα-helixtrans-56.5-50.6177.200000111.6S93 V177 G370 S371 V372 L376 L377 G378 S379 T383S93-A374 WeakPolarHBondContact OG-CB 3.25Å; V177-A374 HydrophobicContact CG1-CB 4.49Å; G370-A374 WeakPolarHBondContact O-CB 3.32Å; G370-A374 PolarHBondContact O-N 3.25Å; S371-A374 PolarHBondContact O-N 3.15Å; V372-A374 VanDerWaalsContact C-N 3.32Å; V372-A374 PolarHBondContact O-N 3.18Å; A374-L376 VanDerWaalsContact C-N 3.33Å; A374-L376 PolarHBondContact O-N 2.84Å; A374-L377 CarbonylContact O-C 3.59Å; A374-L377 PolarHBondContact O-N 3.19Å; A374-G378 PolarHBondContact O-N 3.39Å; A374-S379 WeakPolarHBondContact O-CA 3.15Å; A374-S379 WeakPolarHBondContact O-CB 3.34Å; A374-S379 PolarHBondContact O-N 2.87Å; A374-T383 HydrophobicContact CB-CG2 4.32Å
375G93.3Very high92.5Very high0 Ų013 Ų130%08%0.075CC..Hα-helixtrans-67.5-28.3179.300000114.1S174 S371 V372 L373 G378S174-G375 PolarHBondContact OG-O 2.85Å; S371-G375 PolarHBondContact O-N 3.49Å; V372-G375 PolarHBondContact O-N 3.41Å; L373-G375 PolarHBondContact O-N 3.29Å; G375-G378 PolarHBondContact O-N 3.49Å
376L93.5Very high92.5Very high48 Ų4812.6 Ų12.625%0.2517%0.073SC..Hα-helixtrans-73.7-33.8173.1-71178.1000112.6V178 P312 G313 W317 P318 V372 L373 A374 G378V178-L376 HydrophobicContact CG2-CD2 4.26Å; V178-L376 HydrophobicContact CG2-CG 4.31Å; P312-L376 WeakPolarHBondContact CA-O 3.29Å; P312-L376 HydrophobicContact CB-CB 4.34Å; G313-L376 PolarHBondContact N-O 2.91Å; W317-L376 HydrophobicContact CE3-CD2 4.45Å; W317-L376 HydrophobicContact CZ3-CD2 4.14Å; P318-L376 HydrophobicContact CG-CD2 4.24Å; V372-L376 HydrophobicContact CG1-CD1 3.89Å; V372-L376 HydrophobicContact CG1-CG 4.26Å; V372-L376 VanDerWaalsContact O-CG 3.29Å; V372-L376 WeakPolarHBondContact O-CG 3.43Å; V372-L376 PolarHBondContact O-N 2.78Å; L373-L376 PolarHBondContact O-N 3.19Å; A374-L376 VanDerWaalsContact C-N 3.33Å; A374-L376 PolarHBondContact O-N 2.84Å; L376-G378 PolarHBondContact O-N 3.14Å
377L91.3Very high92.5Very high3 Ų312 Ų122%0.0167%0.069CC..THydrogen-bonded Turntrans-78.611.6173-64.7-179.3000112.8F92 P310 P312 W315 L373 A374 S379F92-L377 HydrophobicContact CD1-CD1 3.76Å; F92-L377 HydrophobicContact CE1-CD1 4.41Å; P310-L377 HydrophobicContact CB-CD1 4.19Å; P310-L377 HydrophobicContact CB-CD2 4.02Å; P310-L377 HydrophobicContact CG-CD1 4.49Å; P310-L377 WeakPolarHBondContact O-CD2 3.48Å; P312-L377 HydrophobicContact CG-CD2 4.18Å; W315-L377 WeakPolarHBondContact CZ3-O 3.37Å; L373-L377 HydrophobicContact CD1-CD1 4.02Å; L373-L377 HydrophobicContact CD1-CG 4.08Å; L373-L377 HydrophobicContact CG-CD1 3.98Å; L373-L377 HydrophobicContact CG-CG 4.38Å; L373-L377 WeakPolarHBondContact O-CB 3.34Å; L373-L377 VanDerWaalsContact O-CG 3.26Å; L373-L377 WeakPolarHBondContact O-CG 3.44Å; L373-L377 PolarHBondContact O-N 2.51Å; A374-L377 CarbonylContact O-C 3.59Å; A374-L377 PolarHBondContact O-N 3.19Å; L377-S379 PolarHBondContact O-N 3.37Å
378G85.4Confident92.3Very high19 Ų1912.1 Ų12.120%0.1967%0.07CC..THydrogen-bonded Turntrans70.911.3178.900000114.6S174 A374 G375 L376 P380S174-G378 WeakPolarHBondContact OG-CA 2.94Å; A374-G378 PolarHBondContact O-N 3.39Å; G375-G378 PolarHBondContact O-N 3.49Å; L376-G378 PolarHBondContact O-N 3.14Å; G378-P380 WeakPolarHBondContact O-CD 3.43Å
379S86.4Confident92.2Very high1 Ų112.3 Ų12.31%0.0077%0.071CC..  trans-67.8124174.2178.60000108.7S90 A374 L377 M381S90-S379 PolarHBondContact OG-OG 3.47Å; A374-S379 WeakPolarHBondContact O-CA 3.15Å; A374-S379 WeakPolarHBondContact O-CB 3.34Å; A374-S379 PolarHBondContact O-N 2.87Å; L377-S379 PolarHBondContact O-N 3.37Å; S379-M381 PolarHBondContact O-N 3.33Å; S379-M381 PolarHBondContact OG-N 3.34Å; S379-M381 PolarHBondContact OG-O 3.07Å
380P79.2Confident92.1Very high2 Ų28 Ų81%0.0135%0.049CC..SBendtrans-73.2-9.8178.930.7-35.1000112.7L70 L170 V173 V177 G378L70-P380 HydrophobicContact CD2-CB 3.31Å; L70-P380 HydrophobicContact CD2-CG 3.43Å; L70-P380 VanDerWaalsContact CD2-CG 3.43Å; L170-P380 HydrophobicContact CD2-CB 4.11Å; V173-P380 HydrophobicContact CG1-CB 3.94Å; V173-P380 WeakPolarHBondContact CG1-O 2.87Å; V177-P380 WeakPolarHBondContact CG2-O 3.12Å; G378-P380 WeakPolarHBondContact O-CD 3.43Å
381M87.3Confident91.9Very high1 Ų18 Ų81%0.0055%0.048CC..SBendtrans-116.4136.5178.2-54.2-78.78800109.6P114 F118 L119 A122 S379P114-M381 HydrophobicContact CB-CB 3.61Å; P114-M381 HydrophobicContact CB-CG 4.06Å; F118-M381 HydrophobicContact CB-CE 4.17Å; F118-M381 HydrophobicContact CB-SD 4.17Å; L119-M381 HydrophobicContact CB-CE 4.34Å; L119-M381 HydrophobicContact CB-SD 3.91Å; L119-M381 HydrophobicContact CD1-CE 4.29Å; L119-M381 HydrophobicContact CD1-SD 4.25Å; A122-M381 HydrophobicContact CB-CE 3.92Å; S379-M381 PolarHBondContact O-N 3.33Å; S379-M381 PolarHBondContact OG-N 3.34Å; S379-M381 PolarHBondContact OG-O 3.07Å
382G90.6Very high91.7Very high1 Ų18 Ų81%0.015%0.048CC..  trans-75.7-179.9168.500000112.3P114P114-G382 WeakPolarHBondContact CA-O 3.49Å
383T93Very high91.4Very high0 Ų07 Ų70%04%0.042CC..  trans-104.7130.7176.964.30000109.9S97 E367 G370 S371 A374S97-T383 PolarHBondContact OG-OG1 3.18Å; E367-T383 VanDerWaalsContact CG-O 3.27Å; E367-T383 WeakPolarHBondContact CG-O 3.27Å; E367-T383 PolarHBondContact O-OG1 3.02Å; G370-T383 VanDerWaalsContact C-OG1 3.26Å; S371-T383 PolarHBondContact N-OG1 3.47Å; S371-T383 PolarHBondContact OG-N 2.85Å; S371-T383 PolarHBondContact OG-O 3.45Å; A374-T383 HydrophobicContact CB-CG2 4.32Å
384A94.4Very high91Very high0 Ų05.8 Ų5.80%04%0.04CC..EExtended strand (participates in β ladder)trans-142.9168.6170.900000112.1Q112 A113 F118 A335 E367 S386Q112-A384 CarbonylContact C-O 3.5Å; Q112-A384 WeakPolarHBondContact CA-O 3.36Å; Q112-A384 PolarHBondContact OE1-O 3.36Å; A113-A384 PolarHBondContact N-O 3.14Å; A113-A384 PolarHBondContact O-N 2.9Å; F118-A384 HydrophobicContact CE2-CB 3.95Å; A335-A384 HydrophobicContact CB-CB 4.12Å; E367-A384 VanDerWaalsContact OE1-CA 3.27Å; E367-A384 WeakPolarHBondContact OE1-CA 3.45Å; E367-A384 WeakPolarHBondContact OE1-CB 3.29Å; A384-S386 PolarHBondContact O-N 3.04Å
385S95.1Very high90.6Very high2 Ų26.4 Ų6.41%0.0144%0.044CC..EExtended strand (participates in β ladder)trans-70.4131.1-178.7-61.10000111.2Q112 S339 C342 Y343 E367Q112-S385 PolarHBondContact NE2-OG 3.03Å; S339-S385 PolarHBondContact OG-N 2.55Å; S339-S385 VanDerWaalsContact OG-N 3.14Å; C342-S385 PolarHBondContact SG-O 2.62Å; Y343-S385 VanDerWaalsContact CE1-OG 3.31Å; Y343-S385 WeakPolarHBondContact CE1-OG 3.11Å; E367-S385 PolarHBondContact OE2-OG 3.39Å
386S93.8Very high90.3Very high4 Ų46.7 Ų6.73%0.0285%0.045CC..  trans-94111-165.5178.20000113.9V111 A384 N389 V390V111-S386 WeakPolarHBondContact O-CB 3.5Å; V111-S386 PolarHBondContact O-N 3.04Å; A384-S386 PolarHBondContact O-N 3.04Å; S386-N389 PolarHBondContact O-N 3.35Å; S386-N389 VanDerWaalsContact O-N 3.14Å; S386-N389 PolarHBondContact OG-ND2 3.47Å; S386-V390 WeakPolarHBondContact O-CG2 3.5Å; S386-V390 PolarHBondContact O-N 3.49Å
387F94.1Very high89.7Confident9 Ų98.8 Ų8.84%0.0395%0.054CC..Hα-helixtrans-53.1-48.4172.9-82.4-58.8000113.7L209 A212 S338 C342 L345 N389 V390 G391 V443 I505L209-F387 HydrophobicContact CD2-CD1 4.25Å; L209-F387 HydrophobicContact CD2-CE1 3.35Å; L209-F387 HydrophobicContact CD2-CZ 3.94Å; A212-F387 HydrophobicContact CB-CD2 3.92Å; A212-F387 HydrophobicContact CB-CE2 3.77Å; A212-F387 HydrophobicContact CB-CG 4.33Å; A212-F387 HydrophobicContact CB-CZ 4.11Å; S338-F387 WeakPolarHBondContact O-CZ 3.46Å; S338-F387 WeakPolarHBondContact OG-CE2 3.08Å; C342-F387 HydrophobicContact CB-CE1 4.49Å; C342-F387 WeakPolarHBondContact SG-CD1 2.94Å; C342-F387 WeakPolarHBondContact SG-CE1 3.24Å; L345-F387 HydrophobicContact CD2-CD1 4.06Å; L345-F387 HydrophobicContact CD2-CE1 4.29Å; F387-N389 VanDerWaalsContact C-N 3.29Å; F387-N389 PolarHBondContact O-N 2.94Å; F387-V390 CarbonylContact O-C 3.6Å; F387-V390 PolarHBondContact O-N 3.39Å; F387-V390 VanDerWaalsContact O-N 3.15Å; F387-G391 PolarHBondContact O-N 2.97Å; F387-V443 HydrophobicContact CB-CG1 4.44Å; F387-V443 HydrophobicContact CB-CG2 4.22Å; F387-V443 HydrophobicContact CD1-CG1 3.75Å; F387-V443 HydrophobicContact CD1-CG2 4.47Å; F387-V443 HydrophobicContact CE1-CG1 4.37Å; F387-V443 HydrophobicContact CG-CG1 4.27Å; F387-V443 WeakPolarHBondContact O-CG2 3.39Å; F387-I505 HydrophobicContact CD2-CD1 4.33Å; F387-I505 HydrophobicContact CE2-CD1 4.01Å
388P92.7Very high89.1Confident4 Ų49 Ų93%0.0266%0.056CC..Hα-helixtrans-57-38.3176.1-29.136.3000114V58 G391 K392 L436 T439V58-P388 HydrophobicContact CG1-CB 3.69Å; P388-G391 PolarHBondContact O-N 3.06Å; P388-K392 PolarHBondContact O-N 3.49Å; P388-L436 HydrophobicContact CB-CD2 4.15Å; P388-L436 HydrophobicContact CG-CD2 3.98Å; P388-T439 WeakPolarHBondContact O-CB 3.39Å
389N93.6Very high88.8Confident3 Ų38.6 Ų8.62%0.0165%0.052CC..Hα-helixtrans-70.6-37.8177.1-84.1-66.7000112.5H55 M59 V111 S386 F387 K392 V393H55-N389 PolarHBondContact ND1-OD1 3.37Å; H55-N389 PolarHBondContact O-OD1 2.82Å; M59-N389 WeakPolarHBondContact CG-ND2 3.43Å; V111-N389 HydrophobicContact CB-CB 4.06Å; S386-N389 PolarHBondContact O-N 3.35Å; S386-N389 VanDerWaalsContact O-N 3.14Å; S386-N389 PolarHBondContact OG-ND2 3.47Å; F387-N389 VanDerWaalsContact C-N 3.29Å; F387-N389 PolarHBondContact O-N 2.94Å; N389-K392 WeakPolarHBondContact O-CB 3.07Å; N389-K392 PolarHBondContact O-N 2.78Å; N389-V393 PolarHBondContact O-N 2.81Å
390V93.1Very high88.8Confident3 Ų39.5 Ų9.52%0.0186%0.058CC..Hα-helixtrans-68.5-40.6173.61790000110.6L110 C342 L345 C346 L349 S386 F387 K392 V393 G394L110-V390 HydrophobicContact CD2-CG2 3.59Å; C342-V390 HydrophobicContact CB-CG2 4.37Å; L345-V390 HydrophobicContact CB-CG1 4.1Å; L345-V390 HydrophobicContact CD2-CB 4.27Å; L345-V390 HydrophobicContact CD2-CG1 3.55Å; L345-V390 HydrophobicContact CG-CG1 3.54Å; C346-V390 HydrophobicContact CB-CG1 4.04Å; C346-V390 HydrophobicContact CB-CG2 4.36Å; L349-V390 HydrophobicContact CD1-CG1 3.86Å; L349-V390 VanDerWaalsContact CD1-O 3.32Å; L349-V390 WeakPolarHBondContact CD1-O 3.42Å; S386-V390 WeakPolarHBondContact O-CG2 3.5Å; S386-V390 PolarHBondContact O-N 3.49Å; F387-V390 CarbonylContact O-C 3.6Å; F387-V390 PolarHBondContact O-N 3.39Å; F387-V390 VanDerWaalsContact O-N 3.15Å; V390-K392 VanDerWaalsContact C-N 3.26Å; V390-K392 PolarHBondContact O-N 2.86Å; V390-V393 WeakPolarHBondContact O-CA 3.37Å; V390-V393 VanDerWaalsContact O-CB 3.26Å; V390-V393 WeakPolarHBondContact O-CB 3.44Å; V390-V393 PolarHBondContact O-N 3.46Å; V390-G394 PolarHBondContact O-N 3.1Å
391G91.3Very high89.1Confident0 Ų012.5 Ų12.50%07%0.072CC..Hα-helixtrans-58.6-37.6172.500000112.3F387 P388 V393 G394 L395 V442F387-G391 PolarHBondContact O-N 2.97Å; P388-G391 PolarHBondContact O-N 3.06Å; G391-V393 VanDerWaalsContact C-N 3.33Å; G391-V393 PolarHBondContact O-N 3.38Å; G391-G394 WeakPolarHBondContact O-CA 3.21Å; G391-G394 PolarHBondContact O-N 3.47Å; G391-L395 PolarHBondContact O-N 3.2Å; G391-V442 WeakPolarHBondContact O-CG1 3.45Å
392K91.9Very high89.2Confident0 Ų014.4 Ų14.40%08%0.08CC..Hα-helixtrans-61.3-39.5171.4-168.4-161.567.9155.10112.5L51 Q54 H55 V58 V275 P388 N389 V390 G394 L395 I396 T439L51-K392 PolarHBondContact O-NZ 3.16Å; Q54-K392 HydrophobicContact CG-CD 3.91Å; H55-K392 PolarHBondContact CD2-NZ 2.84Å; H55-K392 WeakPolarHBondContact CE1-CE 3.43Å; H55-K392 PolarHBondContact CE1-NZ 3.04Å; H55-K392 VanDerWaalsContact ND1-CE 3.27Å; H55-K392 WeakPolarHBondContact ND1-CE 3.28Å; H55-K392 PolarHBondContact ND1-NZ 3.49Å; H55-K392 VanDerWaalsContact ND1-NZ 3.13Å; H55-K392 WeakPolarHBondContact NE2-CE 3.46Å; H55-K392 PolarHBondContact NE2-NZ 3.49Å; V58-K392 HydrophobicContact CG2-CD 4.13Å; V275-K392 HydrophobicContact CG2-CD 4.3Å; V275-K392 HydrophobicContact CG2-CG 3.96Å; P388-K392 PolarHBondContact O-N 3.49Å; N389-K392 WeakPolarHBondContact O-CB 3.07Å; N389-K392 PolarHBondContact O-N 2.78Å; V390-K392 VanDerWaalsContact C-N 3.26Å; V390-K392 PolarHBondContact O-N 2.86Å; K392-G394 PolarHBondContact O-N 3.4Å; K392-L395 WeakPolarHBondContact O-CB 3.42Å; K392-L395 PolarHBondContact O-N 2.92Å; K392-I396 PolarHBondContact O-N 2.94Å; K392-I396 VanDerWaalsContact O-N 3.09Å; K392-T439 HydrophobicContact CB-CG2 4.25Å
393V90.3Very high89.2Confident3 Ų314.6 Ų14.62%0.0188%0.081CC..Hα-helixtrans-57.3-37173.4175.10000110.4L350 N389 V390 G391 L395 I396 Q397L350-V393 HydrophobicContact CD2-CG1 3.47Å; L350-V393 VanDerWaalsContact CD2-CG1 3.47Å; L350-V393 HydrophobicContact CG-CG1 3.96Å; N389-V393 PolarHBondContact O-N 2.81Å; V390-V393 WeakPolarHBondContact O-CA 3.37Å; V390-V393 VanDerWaalsContact O-CB 3.26Å; V390-V393 WeakPolarHBondContact O-CB 3.44Å; V390-V393 PolarHBondContact O-N 3.46Å; G391-V393 VanDerWaalsContact C-N 3.33Å; G391-V393 PolarHBondContact O-N 3.38Å; V393-L395 PolarHBondContact O-N 2.91Å; V393-I396 PolarHBondContact O-N 2.95Å; V393-Q397 VanDerWaalsContact O-CA 3.32Å; V393-Q397 WeakPolarHBondContact O-CA 3.21Å; V393-Q397 PolarHBondContact O-N 3.32Å
394G86.3Confident89.2Confident18 Ų1814.7 Ų14.719%0.1868%0.082CC..Hα-helixtrans-63.2-34.4173.100000114.4V390 G391 K392V390-G394 PolarHBondContact O-N 3.1Å; G391-G394 WeakPolarHBondContact O-CA 3.21Å; G391-G394 PolarHBondContact O-N 3.47Å; K392-G394 PolarHBondContact O-N 3.4Å
395L86.6Confident89.1Confident14 Ų1417.6 Ų17.67%0.07310%0.096CC..Hα-helixtrans-70.7-43.2175.7-68.4172.3000112.7M238 V275 G391 K392 V393 V438 T439 V442M238-L395 HydrophobicContact CE-CD1 4.24Å; V275-L395 HydrophobicContact CG2-CD1 4.3Å; G391-L395 PolarHBondContact O-N 3.2Å; K392-L395 WeakPolarHBondContact O-CB 3.42Å; K392-L395 PolarHBondContact O-N 2.92Å; V393-L395 PolarHBondContact O-N 2.91Å; L395-V438 HydrophobicContact CD1-CG1 4.2Å; L395-V438 HydrophobicContact CD2-CG1 4.46Å; L395-T439 HydrophobicContact CD1-CG2 4.34Å; L395-V442 HydrophobicContact CD2-CG2 3.53Å; L395-V442 HydrophobicContact CG-CG2 3.87Å
396I87.4Confident89Confident6 Ų619 Ų193%0.03110%0.103CC..Hα-helixtrans-89.4-17.3-17469.6175.1000112.8L51 R271 L272 K392 V393 A398L51-I396 HydrophobicContact CD2-CD1 4.09Å; R271-I396 WeakPolarHBondContact O-CG2 3.28Å; L272-I396 WeakPolarHBondContact O-CG2 3.44Å; K392-I396 PolarHBondContact O-N 2.94Å; K392-I396 VanDerWaalsContact O-N 3.09Å; V393-I396 PolarHBondContact O-N 2.95Å; I396-A398 HydrophobicContact CD1-CB 4.4Å; I396-A398 WeakPolarHBondContact CD1-O 3.41Å; I396-A398 HydrophobicContact CG1-CB 4.26Å; I396-A398 WeakPolarHBondContact CG1-O 3.28Å; I396-A398 PolarHBondContact O-N 2.95Å
397Q79.8Confident89.1Confident92 Ų9218.8 Ų18.843%0.4310%0.101SC..THydrogen-bonded Turntrans50.835.2-175.6-63.4-177.7-37.500113.5V393V393-Q397 VanDerWaalsContact O-CA 3.32Å; V393-Q397 WeakPolarHBondContact O-CA 3.21Å; V393-Q397 PolarHBondContact O-N 3.32Å
398A78.6Confident89.2Confident7 Ų718.3 Ų18.36%0.05810%0.099CC..  trans-143.1131.9-178.700000109.6L272 I396L272-A398 HydrophobicContact CD2-CB 3.98Å; I396-A398 HydrophobicContact CD1-CB 4.4Å; I396-A398 WeakPolarHBondContact CD1-O 3.41Å; I396-A398 HydrophobicContact CG1-CB 4.26Å; I396-A398 WeakPolarHBondContact CG1-O 3.28Å; I396-A398 PolarHBondContact O-N 2.95Å
399G80.4Confident89.4Confident11 Ų1123.1 Ų23.111%0.11312%0.124CC..  trans-140.1122.5176.300000110.2
400S85.9Confident89.4Confident19 Ų1926 Ų2613%0.13314%0.14CC..  trans-129.1133.1179.5174.80000110.2Q402 V403 A404S400-Q402 PolarHBondContact O-N 2.88Å; S400-Q402 PolarHBondContact OG-N 2.95Å; S400-V403 WeakPolarHBondContact O-CB 3.44Å; S400-V403 PolarHBondContact O-N 3.4Å; S400-A404 PolarHBondContact O-N 3.28Å
401Q85.6Confident89.5Confident66 Ų6625.9 Ų25.931%0.30814%0.139SC..Hα-helixtrans-60.8-34.7174-71.7177.2-9.500111.6R107 V403 A404 H405R107-Q401 PolarHBondContact O-NE2 2.65Å; Q401-V403 VanDerWaalsContact C-N 3.31Å; Q401-V403 PolarHBondContact O-N 2.86Å; Q401-A404 PolarHBondContact O-N 3.26Å; Q401-H405 PolarHBondContact O-CD2 2.88Å; Q401-H405 PolarHBondContact O-N 3.47Å
402Q87.9Confident89.7Confident40 Ų4028.4 Ų28.419%0.18715%0.151CC..Hα-helixtrans-60.5-42.3176.1-177.1-174.3-4.400111.5S400 H405 L406S400-Q402 PolarHBondContact O-N 2.88Å; S400-Q402 PolarHBondContact OG-N 2.95Å; Q402-H405 PolarHBondContact O-N 2.63Å; Q402-L406 HydrophobicContact CG-CD1 4.44Å; Q402-L406 WeakPolarHBondContact O-CG 3.32Å; Q402-L406 PolarHBondContact O-N 2.93Å
403V91.9Very high89.8Confident5 Ų530.1 Ų30.13%0.0317%0.169CC..Hα-helixtrans-63.2-45.1176.1174.90000109.8L51 A52 S400 Q401 H405 L406 V407L51-V403 HydrophobicContact CB-CG1 3.79Å; L51-V403 HydrophobicContact CB-CG2 4.1Å; L51-V403 HydrophobicContact CD1-CG2 4.14Å; A52-V403 HydrophobicContact CB-CG1 4.3Å; S400-V403 WeakPolarHBondContact O-CB 3.44Å; S400-V403 PolarHBondContact O-N 3.4Å; Q401-V403 VanDerWaalsContact C-N 3.31Å; Q401-V403 PolarHBondContact O-N 2.86Å; V403-H405 PolarHBondContact O-N 3.33Å; V403-L406 WeakPolarHBondContact O-CB 3.34Å; V403-L406 PolarHBondContact O-N 2.71Å; V403-V407 HydrophobicContact CG1-CG2 4.48Å; V403-V407 VanDerWaalsContact O-CG2 3.28Å; V403-V407 WeakPolarHBondContact O-CG2 3.14Å; V403-V407 PolarHBondContact O-N 3.48Å
404A92.1Very high89.9Confident2 Ų231 Ų312%0.01717%0.173CC..Hα-helixtrans-64.5-36.8179.300000112.9T98 T102 P109 S400 Q401 V407 G408T98-A404 WeakPolarHBondContact CG2-O 3.22Å; T102-A404 HydrophobicContact CG2-CB 3.5Å; P109-A404 HydrophobicContact CB-CB 4.05Å; S400-A404 PolarHBondContact O-N 3.28Å; Q401-A404 PolarHBondContact O-N 3.26Å; A404-V407 WeakPolarHBondContact O-CB 3.44Å; A404-V407 PolarHBondContact O-N 3.5Å; A404-G408 PolarHBondContact O-N 3.19Å
405H91.9Very high90.2Very high62 Ų6230.1 Ų30.129%0.28716%0.164SC..Hα-helixtrans-61.8-45.5170.9-70.6179.8000111.9T102 Q401 Q402 V403 V407 G408 L409T102-H405 PolarHBondContact OG1-CD2 2.82Å; T102-H405 PolarHBondContact OG1-NE2 3.2Å; Q401-H405 PolarHBondContact O-CD2 2.88Å; Q401-H405 PolarHBondContact O-N 3.47Å; Q402-H405 PolarHBondContact O-N 2.63Å; V403-H405 PolarHBondContact O-N 3.33Å; H405-V407 VanDerWaalsContact C-N 3.3Å; H405-V407 PolarHBondContact O-N 3.44Å; H405-G408 PolarHBondContact O-N 3.1Å; H405-L409 WeakPolarHBondContact O-CG 3.33Å; H405-L409 PolarHBondContact O-N 2.92Å
406L94.7Very high90.5Very high30 Ų3032.3 Ų32.316%0.15718%0.176CC..Hα-helixtrans-62-37.4176.2-77.7168.8000112.2W45 A52 Q402 V403 L409 L410W45-L406 HydrophobicContact CE3-CD1 4.29Å; W45-L406 HydrophobicContact CZ3-CD1 4.22Å; W45-L406 HydrophobicContact CZ3-CD2 4.14Å; W45-L406 HydrophobicContact CZ3-CG 4.44Å; A52-L406 HydrophobicContact CB-CB 3.71Å; Q402-L406 HydrophobicContact CG-CD1 4.44Å; Q402-L406 WeakPolarHBondContact O-CG 3.32Å; Q402-L406 PolarHBondContact O-N 2.93Å; V403-L406 WeakPolarHBondContact O-CB 3.34Å; V403-L406 PolarHBondContact O-N 2.71Å; L406-L409 PolarHBondContact O-N 3.37Å; L406-L410 VanDerWaalsContact O-CB 3.28Å; L406-L410 WeakPolarHBondContact O-CB 3.41Å; L406-L410 PolarHBondContact O-N 2.9Å
407V95.6Very high90.7Very high0 Ų032.3 Ų32.30%018%0.176CC..Hα-helixtrans-59-48.8172.9172.50000110.5A52 H55 V56 M59 T98 V111 V403 A404 H405 L409 L410 C411A52-V407 HydrophobicContact CB-CG2 3.75Å; H55-V407 HydrophobicContact CB-CB 4.47Å; H55-V407 HydrophobicContact CB-CG1 4.17Å; H55-V407 HydrophobicContact CB-CG2 3.41Å; H55-V407 VanDerWaalsContact CB-CG2 3.41Å; V56-V407 HydrophobicContact CG2-CG1 4.04Å; M59-V407 HydrophobicContact CE-CG1 3.47Å; M59-V407 VanDerWaalsContact CE-CG1 3.47Å; T98-V407 HydrophobicContact CG2-CG1 4.49Å; V111-V407 HydrophobicContact CG1-CG1 3.93Å; V111-V407 HydrophobicContact CG2-CB 4.47Å; V111-V407 HydrophobicContact CG2-CG1 4.02Å; V111-V407 HydrophobicContact CG2-CG2 4.45Å; V403-V407 HydrophobicContact CG1-CG2 4.48Å; V403-V407 VanDerWaalsContact O-CG2 3.28Å; V403-V407 WeakPolarHBondContact O-CG2 3.14Å; V403-V407 PolarHBondContact O-N 3.48Å; A404-V407 WeakPolarHBondContact O-CB 3.44Å; A404-V407 PolarHBondContact O-N 3.5Å; H405-V407 VanDerWaalsContact C-N 3.3Å; H405-V407 PolarHBondContact O-N 3.44Å; V407-L409 PolarHBondContact O-N 3.36Å; V407-L410 PolarHBondContact O-N 3.16Å; V407-C411 WeakPolarHBondContact O-CB 3.19Å; V407-C411 PolarHBondContact O-N 3.08Å; V407-C411 PolarHBondContact O-SG 3Å; V407-C411 VanDerWaalsContact O-SG 3.38Å
408G95.9Very high91.1Very high0 Ų028 Ų280%016%0.156CC..Hα-helixtrans-58.5-46.4178.300000112.9G95 A404 H405 C411 M412G95-G408 WeakPolarHBondContact CA-O 3.4Å; A404-G408 PolarHBondContact O-N 3.19Å; H405-G408 PolarHBondContact O-N 3.1Å; G408-C411 PolarHBondContact O-N 3.43Å; G408-M412 WeakPolarHBondContact O-CG 3.47Å; G408-M412 PolarHBondContact O-N 2.99Å
409L95.8Very high91.5Very high104 Ų10431.4 Ų31.455%0.54517%0.167SC..Hα-helixtrans-63.5-43.4176.6-69.5174.1000112.5I99 H405 L406 V407 C411 M412 G413I99-L409 HydrophobicContact CD1-CD2 3.95Å; I99-L409 HydrophobicContact CD1-CG 4.28Å; H405-L409 WeakPolarHBondContact O-CG 3.33Å; H405-L409 PolarHBondContact O-N 2.92Å; L406-L409 PolarHBondContact O-N 3.37Å; V407-L409 PolarHBondContact O-N 3.36Å; L409-C411 VanDerWaalsContact C-N 3.35Å; L409-M412 PolarHBondContact O-N 2.96Å; L409-G413 PolarHBondContact O-N 3.45Å
410L95.4Very high91.9Very high65 Ų6534 Ų3434%0.3418%0.178SC..Hα-helixtrans-64.7-40.6178.4-175.159.6000111L53 V56 L406 V407 G413 L414L53-L410 HydrophobicContact CD1-CD2 4.18Å; V56-L410 HydrophobicContact CB-CD2 4.24Å; V56-L410 HydrophobicContact CG2-CB 4.25Å; V56-L410 HydrophobicContact CG2-CD2 3.73Å; V56-L410 HydrophobicContact CG2-CG 4.09Å; L406-L410 VanDerWaalsContact O-CB 3.28Å; L406-L410 WeakPolarHBondContact O-CB 3.41Å; L406-L410 PolarHBondContact O-N 2.9Å; V407-L410 PolarHBondContact O-N 3.16Å; L410-G413 PolarHBondContact O-N 3.26Å; L410-L414 HydrophobicContact CG-CD1 4.47Å; L410-L414 WeakPolarHBondContact O-CG 3.49Å; L410-L414 PolarHBondContact O-N 3.45Å
411C95Very high91.9Very high0 Ų033.1 Ų33.10%017%0.172CC..Hα-helixtrans-65.7-40.8175-75.80000113.2M59 F91 V407 G408 L409 G413 L414 G415M59-C411 WeakPolarHBondContact CE-SG 3.47Å; F91-C411 CarbonylContact C-O 3.54Å; V407-C411 WeakPolarHBondContact O-CB 3.19Å; V407-C411 PolarHBondContact O-N 3.08Å; V407-C411 PolarHBondContact O-SG 3Å; V407-C411 VanDerWaalsContact O-SG 3.38Å; G408-C411 PolarHBondContact O-N 3.43Å; L409-C411 VanDerWaalsContact C-N 3.35Å; C411-G413 VanDerWaalsContact C-N 3.32Å; C411-G413 PolarHBondContact O-N 3.48Å; C411-L414 PolarHBondContact O-N 2.9Å; C411-G415 PolarHBondContact O-N 2.88Å
412M95.3Very high91.8Very high53 Ų5331.6 Ų31.626%0.26117%0.165SC..Hα-helixtrans-59.1-45.5171.2-73.1179.968.600111F92 V96 I99 G408 L409 L414 G415 L416F92-M412 HydrophobicContact CD2-CB 4.43Å; F92-M412 HydrophobicContact CE2-CE 4.11Å; F92-M412 HydrophobicContact CZ-CE 4.26Å; V96-M412 HydrophobicContact CG2-CE 4Å; V96-M412 HydrophobicContact CG2-CG 4.06Å; V96-M412 HydrophobicContact CG2-SD 3.95Å; I99-M412 HydrophobicContact CD1-SD 3.47Å; I99-M412 WeakPolarHBondContact CD1-SD 3.5Å; G408-M412 WeakPolarHBondContact O-CG 3.47Å; G408-M412 PolarHBondContact O-N 2.99Å; L409-M412 PolarHBondContact O-N 2.96Å; M412-L414 PolarHBondContact O-N 3.44Å; M412-G415 PolarHBondContact O-N 3.43Å; M412-G415 VanDerWaalsContact O-N 3.16Å; M412-L416 WeakPolarHBondContact O-CG 3.29Å; M412-L416 PolarHBondContact O-N 3.26Å
413G94.2Very high91.6Very high36 Ų3634.2 Ų34.237%0.37118%0.18SC..Hα-helixtrans-60.4-42.9176.300000113.5L409 L410 C411 G415 L416L409-G413 PolarHBondContact O-N 3.45Å; L410-G413 PolarHBondContact O-N 3.26Å; C411-G413 VanDerWaalsContact C-N 3.32Å; C411-G413 PolarHBondContact O-N 3.48Å; G413-G415 VanDerWaalsContact C-N 3.32Å; G413-G415 PolarHBondContact O-N 3.23Å; G413-L416 PolarHBondContact O-N 3.11Å
414L92.1Very high91.2Very high20 Ų2034.9 Ų34.911%0.10518%0.183CC..Hα-helixtrans-64.1-37.2173.9-71.5171.2000112.1V56 F91 L410 C411 M412 L416 S417 L420 L424V56-L414 HydrophobicContact CG1-CD1 3.43Å; V56-L414 VanDerWaalsContact CG1-CD1 3.43Å; F91-L414 HydrophobicContact CB-CB 4.45Å; F91-L414 HydrophobicContact CG-CB 4.44Å; L410-L414 HydrophobicContact CG-CD1 4.47Å; L410-L414 WeakPolarHBondContact O-CG 3.49Å; L410-L414 PolarHBondContact O-N 3.45Å; C411-L414 PolarHBondContact O-N 2.9Å; M412-L414 PolarHBondContact O-N 3.44Å; L414-L416 VanDerWaalsContact C-N 3.29Å; L414-L416 PolarHBondContact O-N 3.24Å; L414-S417 CarbonylContact O-C 3.4Å; L414-S417 PolarHBondContact O-N 3.23Å; L414-S417 VanDerWaalsContact O-N 3.15Å; L414-S417 VanDerWaalsContact O-O 3.07Å; L414-L420 HydrophobicContact CD2-CB 3.75Å; L414-L420 HydrophobicContact CD2-CD1 4.43Å; L414-L424 HydrophobicContact CD1-CD1 3.79Å; L414-L424 HydrophobicContact CD2-CD1 4.24Å
415G91.6Very high90.6Very high0 Ų035.1 Ų35.10%018%0.184CC..Hα-helixtrans-70.8-22177.700000114.7A88 C411 M412 G413 S417A88-G415 WeakPolarHBondContact CB-O 3.26Å; A88-G415 WeakPolarHBondContact O-CA 3.47Å; C411-G415 PolarHBondContact O-N 2.88Å; M412-G415 PolarHBondContact O-N 3.43Å; M412-G415 VanDerWaalsContact O-N 3.16Å; G413-G415 VanDerWaalsContact C-N 3.32Å; G413-G415 PolarHBondContact O-N 3.23Å; G415-S417 VanDerWaalsContact C-N 3.26Å
416L93.5Very high90.2Very high60 Ų6033.9 Ų33.931%0.31418%0.181SC..THydrogen-bonded Turntrans-78.2-9.2171.2-66.9173.9000113.2F92 I307 W308 L309 M412 G413 L414F92-L416 HydrophobicContact CD2-CD2 4.2Å; F92-L416 HydrophobicContact CD2-CG 4.31Å; F92-L416 HydrophobicContact CE2-CD2 3.91Å; F92-L416 HydrophobicContact CE2-CG 4.24Å; I307-L416 CarbonylContact C-O 3.45Å; I307-L416 WeakPolarHBondContact CA-O 3.5Å; W308-L416 PolarHBondContact N-O 3.02Å; W308-L416 CarbonylContact O-C 3.24Å; W308-L416 WeakPolarHBondContact O-CA 3.35Å; L309-L416 HydrophobicContact CD1-CD2 3.5Å; L309-L416 VanDerWaalsContact CD1-CD2 3.5Å; M412-L416 WeakPolarHBondContact O-CG 3.29Å; M412-L416 PolarHBondContact O-N 3.26Å; G413-L416 PolarHBondContact O-N 3.11Å; L414-L416 VanDerWaalsContact C-N 3.29Å; L414-L416 PolarHBondContact O-N 3.24Å
417S91.9Very high89.8Confident7 Ų733.1 Ų33.15%0.04918%0.177CC..  trans-132.393.7-176.8-169.70000111.7W306 L414 G415 R419 L420 A421W306-S417 WeakPolarHBondContact O-CA 3.45Å; W306-S417 WeakPolarHBondContact O-CB 3.36Å; W306-S417 PolarHBondContact O-OG 2.9Å; L414-S417 CarbonylContact O-C 3.4Å; L414-S417 PolarHBondContact O-N 3.23Å; L414-S417 VanDerWaalsContact O-N 3.15Å; L414-S417 VanDerWaalsContact O-O 3.07Å; G415-S417 VanDerWaalsContact C-N 3.26Å; S417-R419 PolarHBondContact O-N 2.99Å; S417-L420 PolarHBondContact O-N 3.25Å; S417-L420 WeakPolarHBondContact OG-CG 3.44Å; S417-L420 PolarHBondContact OG-N 3.2Å; S417-A421 PolarHBondContact O-N 2.93Å
418P88.8Confident89.4Confident0 Ų033.2 Ų33.20%018%0.178CC..Hα-helixtrans-54.1-28.2173.6-2836000113.5Q85 A88 A304 P305 W308 Q422Q85-P418 HydrophobicContact CG-CB 4.06Å; Q85-P418 HydrophobicContact CG-CG 3.84Å; A88-P418 HydrophobicContact CB-CB 4.34Å; A88-P418 HydrophobicContact CB-CG 4.08Å; A304-P418 HydrophobicContact CB-CB 4.22Å; P305-P418 HydrophobicContact CG-CG 4.42Å; W308-P418 HydrophobicContact CB-CG 3.85Å; W308-P418 HydrophobicContact CD2-CG 3.95Å; W308-P418 HydrophobicContact CE3-CG 3.6Å; W308-P418 HydrophobicContact CG-CG 4.1Å; W308-P418 HydrophobicContact CZ3-CG 4.48Å; P418-Q422 VanDerWaalsContact O-CB 3.29Å; P418-Q422 WeakPolarHBondContact O-CB 3.19Å; P418-Q422 PolarHBondContact O-N 3.43Å
419R86.9Confident89Confident79 Ų7934.9 Ų34.930%0.29819%0.186SC..Hα-helixtrans-65.5-45172.1-77.3-69.6-170.1177.916.1113.6K303 A304 P305 S417 Q422 L423K303-R419 VanDerWaalsContact CA-NH2 3.31Å; A304-R419 HydrophobicContact CB-CG 3.92Å; A304-R419 WeakPolarHBondContact O-CD 3.47Å; A304-R419 WeakPolarHBondContact O-CG 3.32Å; A304-R419 PolarHBondContact O-NE 2.93Å; P305-R419 WeakPolarHBondContact O-CG 3.47Å; S417-R419 PolarHBondContact O-N 2.99Å; R419-Q422 PolarHBondContact O-N 3.38Å; R419-L423 PolarHBondContact O-N 3.37Å
420L87.6Confident88.8Confident66 Ų6629.9 Ų29.935%0.34616%0.161SC..Hα-helixtrans-69.7-37.6176.2-64.7177.3000111.1W306 L414 S417 Q422 L423 L424W306-L420 HydrophobicContact CZ3-CD2 4.46Å; L414-L420 HydrophobicContact CD2-CB 3.75Å; L414-L420 HydrophobicContact CD2-CD1 4.43Å; S417-L420 PolarHBondContact O-N 3.25Å; S417-L420 WeakPolarHBondContact OG-CG 3.44Å; S417-L420 PolarHBondContact OG-N 3.2Å; L420-Q422 VanDerWaalsContact C-N 3.31Å; L420-Q422 PolarHBondContact O-N 3.15Å; L420-L423 WeakPolarHBondContact O-CB 3.33Å; L420-L423 PolarHBondContact O-N 3.48Å; L420-L423 VanDerWaalsContact O-N 3.15Å; L420-L424 PolarHBondContact O-N 2.98Å
421A86.1Confident88.6Confident0 Ų026.9 Ų26.90%015%0.145CC..Hα-helixtrans-59.8-43.3172.500000111.1L87 A88 F91 S417 L423 L424L87-A421 HydrophobicContact CB-CB 4.46Å; L87-A421 HydrophobicContact CD2-CB 4.08Å; L87-A421 VanDerWaalsContact CD2-O 3.3Å; L87-A421 WeakPolarHBondContact CD2-O 3.46Å; A88-A421 HydrophobicContact CB-CB 4.01Å; F91-A421 HydrophobicContact CD2-CB 4.13Å; F91-A421 HydrophobicContact CE2-CB 4.34Å; S417-A421 PolarHBondContact O-N 2.93Å; A421-L423 VanDerWaalsContact C-N 3.32Å; A421-L423 PolarHBondContact O-N 2.85Å; A421-L424 WeakPolarHBondContact O-CB 3.44Å; A421-L424 PolarHBondContact O-N 3.05Å
422Q83.3Confident88.4Confident34 Ų3427.5 Ų27.516%0.15915%0.148CC..Hα-helixtrans-63.2-34.3173.9-172.7179.122.300112.7P418 R419 L420 L424 T425P418-Q422 VanDerWaalsContact O-CB 3.29Å; P418-Q422 WeakPolarHBondContact O-CB 3.19Å; P418-Q422 PolarHBondContact O-N 3.43Å; R419-Q422 PolarHBondContact O-N 3.38Å; L420-Q422 VanDerWaalsContact C-N 3.31Å; L420-Q422 PolarHBondContact O-N 3.15Å; Q422-L424 PolarHBondContact O-N 3.2Å; Q422-T425 PolarHBondContact O-N 2.93Å; Q422-T425 VanDerWaalsContact O-N 3.11Å; Q422-T425 PolarHBondContact O-OG1 3.18Å
423L84Confident88.2Confident95 Ų9525 Ų2550%0.49714%0.136SC..Hα-helixtrans-60.1-35.9175.6-176.565.5000111.6R419 L420 A421 T425 T426R419-L423 PolarHBondContact O-N 3.37Å; L420-L423 WeakPolarHBondContact O-CB 3.33Å; L420-L423 PolarHBondContact O-N 3.48Å; L420-L423 VanDerWaalsContact O-N 3.15Å; A421-L423 VanDerWaalsContact C-N 3.32Å; A421-L423 PolarHBondContact O-N 2.85Å; L423-T425 VanDerWaalsContact C-N 3.25Å; L423-T425 PolarHBondContact O-N 2.96Å; L423-T426 WeakPolarHBondContact O-CB 3.32Å; L423-T426 WeakPolarHBondContact O-CG2 3.49Å; L423-T426 PolarHBondContact O-N 3.22Å; L423-T426 PolarHBondContact O-OG1 2.87Å
424L83.9Confident88.2Confident20 Ų2023.2 Ų23.211%0.10512%0.118CC..Hα-helixtrans-69.2-21.8178.4-64.1173.9000113.3L57 A60 F91 L414 L420 A421 Q422 T426 I427L57-L424 HydrophobicContact CD2-CD2 4.44Å; A60-L424 HydrophobicContact CB-CB 4.39Å; A60-L424 HydrophobicContact CB-CD1 4.07Å; F91-L424 HydrophobicContact CE1-CD1 4.28Å; F91-L424 HydrophobicContact CE2-CD1 3.95Å; F91-L424 HydrophobicContact CZ-CD1 3.61Å; L414-L424 HydrophobicContact CD1-CD1 3.79Å; L414-L424 HydrophobicContact CD2-CD1 4.24Å; L420-L424 PolarHBondContact O-N 2.98Å; A421-L424 WeakPolarHBondContact O-CB 3.44Å; A421-L424 PolarHBondContact O-N 3.05Å; Q422-L424 PolarHBondContact O-N 3.2Å; L424-T426 PolarHBondContact O-N 3.24Å; L424-I427 HydrophobicContact CD2-CD1 4.37Å; L424-I427 WeakPolarHBondContact O-CG1 3.36Å; L424-I427 PolarHBondContact O-N 2.98Å
425T79.5Confident88.2Confident6 Ų622.6 Ų22.64%0.03712%0.115CC..THydrogen-bonded Turntrans-76.5-10175.5720000112.7L87 L298 Q422 L423 I427L87-T425 HydrophobicContact CD2-CG2 3.47Å; L87-T425 VanDerWaalsContact CD2-CG2 3.47Å; L298-T425 HydrophobicContact CB-CG2 4.24Å; L298-T425 HydrophobicContact CD2-CG2 3.73Å; Q422-T425 PolarHBondContact O-N 2.93Å; Q422-T425 VanDerWaalsContact O-N 3.11Å; Q422-T425 PolarHBondContact O-OG1 3.18Å; L423-T425 VanDerWaalsContact C-N 3.25Å; L423-T425 PolarHBondContact O-N 2.96Å; T425-I427 PolarHBondContact O-N 3.43Å
426T83.3Confident88.2Confident37 Ų3723 Ų2323%0.22712%0.118CC..THydrogen-bonded Turntrans-77.9-8.4173.871.40000113.2W283 L423 L424 P428W283-T426 WeakPolarHBondContact CZ2-OG1 3.41Å; W283-T426 PolarHBondContact NE1-O 2.92Å; L423-T426 WeakPolarHBondContact O-CB 3.32Å; L423-T426 WeakPolarHBondContact O-CG2 3.49Å; L423-T426 PolarHBondContact O-N 3.22Å; L423-T426 PolarHBondContact O-OG1 2.87Å; L424-T426 PolarHBondContact O-N 3.24Å; T426-P428 WeakPolarHBondContact O-CD 3.41Å
427I86.7Confident88.1Confident13 Ų1321.1 Ų21.17%0.06711%0.112CC..SBendtrans-64.3124.6171.9-60.3171.7000107.8L57 W283 L424 T425 L429 V431 V432L57-I427 HydrophobicContact CD2-CD1 3.72Å; W283-I427 HydrophobicContact CD2-CG1 4.31Å; W283-I427 HydrophobicContact CH2-CG1 4.25Å; W283-I427 HydrophobicContact CZ2-CG1 4.04Å; W283-I427 HydrophobicContact CZ3-CG1 4.47Å; L424-I427 HydrophobicContact CD2-CD1 4.37Å; L424-I427 WeakPolarHBondContact O-CG1 3.36Å; L424-I427 PolarHBondContact O-N 2.98Å; T425-I427 PolarHBondContact O-N 3.43Å; I427-L429 PolarHBondContact O-N 2.89Å; I427-V431 HydrophobicContact CG2-CB 4.09Å; I427-V431 HydrophobicContact CG2-CG1 4.02Å; I427-V432 HydrophobicContact CB-CG2 4.44Å; I427-V432 HydrophobicContact CG2-CG2 3.88Å
428P87.4Confident88.2Confident2 Ų221.7 Ų21.71%0.01312%0.115CC..  trans-59.2139-177.8-22.330.3000112.4S286 T426 P430 V431 V432S286-P428 VanDerWaalsContact OG-CG 3.27Å; S286-P428 WeakPolarHBondContact OG-CG 2.92Å; T426-P428 WeakPolarHBondContact O-CD 3.41Å; P428-P430 VanDerWaalsContact C-N 3.31Å; P428-V431 HydrophobicContact CB-CG2 4.1Å; P428-V431 HydrophobicContact CG-CG2 4.18Å; P428-V431 WeakPolarHBondContact O-CB 3.21Å; P428-V431 PolarHBondContact O-N 2.82Å; P428-V432 PolarHBondContact O-N 3.1Å
429L86.5Confident88.4Confident35 Ų3521.7 Ų21.718%0.18312%0.115CC..Hα-helixtrans-49.5-42.4175.1-88.168.5000113.8F223 A226 P295 I427 V431 V432 G433F223-L429 HydrophobicContact CD1-CB 4.48Å; F223-L429 HydrophobicContact CD1-CD2 3.97Å; F223-L429 HydrophobicContact CD1-CG 4.15Å; F223-L429 HydrophobicContact CE1-CD2 4.43Å; A226-L429 HydrophobicContact CB-CB 4.3Å; P295-L429 HydrophobicContact CB-CD1 4.21Å; P295-L429 HydrophobicContact CG-CD1 3.85Å; I427-L429 PolarHBondContact O-N 2.89Å; L429-V431 PolarHBondContact O-N 3.37Å; L429-V432 WeakPolarHBondContact O-CB 3.26Å; L429-V432 PolarHBondContact O-N 3.36Å; L429-G433 PolarHBondContact O-N 2.92Å
430P91.2Very high88.7Confident0 Ų018.7 Ų18.70%011%0.105CC..Hα-helixtrans-59.3-33.7176.6-22.930.9000113.9A226 H227 L230 A231 P428 G434A226-P430 HydrophobicContact CB-CG 3.92Å; H227-P430 HydrophobicContact CB-CB 4.47Å; H227-P430 HydrophobicContact CB-CG 3.79Å; L230-P430 HydrophobicContact CB-CB 4.02Å; L230-P430 HydrophobicContact CB-CG 4.5Å; A231-P430 HydrophobicContact CB-CB 4.07Å; P428-P430 VanDerWaalsContact C-N 3.31Å; P430-G434 PolarHBondContact O-N 3.47Å
431V92.2Very high89Confident1 Ų117.9 Ų17.91%0.00611%0.107CC..Hα-helixtrans-71.1-46.6179177.50000110V234 V279 V282 I427 P428 L429 G433 G434 V435V234-V431 HydrophobicContact CG2-CG1 4.32Å; V279-V431 HydrophobicContact CB-CG1 4.34Å; V279-V431 HydrophobicContact CG1-CG1 4.04Å; V279-V431 HydrophobicContact CG2-CG1 3.99Å; V282-V431 HydrophobicContact CB-CG2 4.21Å; V282-V431 HydrophobicContact CG1-CG2 3.61Å; I427-V431 HydrophobicContact CG2-CB 4.09Å; I427-V431 HydrophobicContact CG2-CG1 4.02Å; P428-V431 HydrophobicContact CB-CG2 4.1Å; P428-V431 HydrophobicContact CG-CG2 4.18Å; P428-V431 WeakPolarHBondContact O-CB 3.21Å; P428-V431 PolarHBondContact O-N 2.82Å; L429-V431 PolarHBondContact O-N 3.37Å; V431-G433 VanDerWaalsContact C-N 3.33Å; V431-G433 PolarHBondContact O-N 2.88Å; V431-G434 PolarHBondContact O-N 3.39Å; V431-V435 WeakPolarHBondContact O-CG2 3.15Å; V431-V435 PolarHBondContact O-N 3.19Å
432V90.1Very high89.4Confident13 Ų1319.4 Ų19.48%0.07912%0.117CC..Hα-helixtrans-54.9-49.3173.3169.20000110.4S61 V65 I427 P428 L429 V435 L436S61-V432 VanDerWaalsContact CB-CG1 3.47Å; V65-V432 HydrophobicContact CG2-CG1 3.57Å; I427-V432 HydrophobicContact CB-CG2 4.44Å; I427-V432 HydrophobicContact CG2-CG2 3.88Å; P428-V432 PolarHBondContact O-N 3.1Å; L429-V432 WeakPolarHBondContact O-CB 3.26Å; L429-V432 PolarHBondContact O-N 3.36Å; V432-V435 PolarHBondContact O-N 3.24Å; V432-L436 HydrophobicContact CG1-CD1 4.09Å; V432-L436 WeakPolarHBondContact O-CB 3.24Å; V432-L436 WeakPolarHBondContact O-CG 3.12Å; V432-L436 PolarHBondContact O-N 3.46Å
433G91.3Very high89.9Confident0 Ų017.8 Ų17.80%011%0.109CC..Hα-helixtrans-59.8-46177.700000113L429 V431 L436 G437L429-G433 PolarHBondContact O-N 2.92Å; V431-G433 VanDerWaalsContact C-N 3.33Å; V431-G433 PolarHBondContact O-N 2.88Å; G433-L436 PolarHBondContact O-N 2.62Å; G433-G437 PolarHBondContact O-N 3.42Å
434G93.4Very high90.4Very high0 Ų014.7 Ų14.70%09%0.093CC..Hα-helixtrans-62.9-42.9178.900000113.5P430 V431 G437 V438P430-G434 PolarHBondContact O-N 3.47Å; V431-G434 PolarHBondContact O-N 3.39Å; G434-G437 PolarHBondContact O-N 2.89Å; G434-V438 WeakPolarHBondContact O-CG2 3.27Å; G434-V438 PolarHBondContact O-N 3.48Å; G434-V438 VanDerWaalsContact O-N 3.09Å
435V92.9Very high90.9Very high6 Ų617.1 Ų17.14%0.03611%0.111CC..Hα-helixtrans-64.2-46.7176.8173.20000111.4V58 V234 M238 V275 V279 V431 V432 G437 T439V58-V435 HydrophobicContact CG2-CG1 3.86Å; V234-V435 HydrophobicContact CG2-CG2 4.45Å; M238-V435 HydrophobicContact SD-CG2 4.33Å; V275-V435 HydrophobicContact CG1-CG1 3.76Å; V275-V435 HydrophobicContact CG1-CG2 4.05Å; V279-V435 HydrophobicContact CG2-CG2 3.41Å; V279-V435 VanDerWaalsContact CG2-CG2 3.41Å; V431-V435 WeakPolarHBondContact O-CG2 3.15Å; V431-V435 PolarHBondContact O-N 3.19Å; V432-V435 PolarHBondContact O-N 3.24Å; V435-G437 VanDerWaalsContact C-N 3.34Å; V435-G437 PolarHBondContact O-N 2.9Å; V435-T439 WeakPolarHBondContact O-CB 3.45Å; V435-T439 WeakPolarHBondContact O-CG2 3.35Å; V435-T439 PolarHBondContact O-N 3.22Å; V435-T439 VanDerWaalsContact O-N 3.07Å; V435-T439 PolarHBondContact O-OG1 3.03Å
436L91.1Very high91.4Very high10 Ų1017.5 Ų17.55%0.05212%0.115CC..Hα-helixtrans-61.9-42.6176.2-71.9174.7000111.3L62 V65 V220 P388 V432 G433 T439 Q440L62-L436 HydrophobicContact CD1-CD2 4.38Å; V65-L436 HydrophobicContact CG2-CD1 4Å; V220-L436 HydrophobicContact CG2-CB 4.1Å; P388-L436 HydrophobicContact CB-CD2 4.15Å; P388-L436 HydrophobicContact CG-CD2 3.98Å; V432-L436 HydrophobicContact CG1-CD1 4.09Å; V432-L436 WeakPolarHBondContact O-CB 3.24Å; V432-L436 WeakPolarHBondContact O-CG 3.12Å; V432-L436 PolarHBondContact O-N 3.46Å; G433-L436 PolarHBondContact O-N 2.62Å; L436-T439 WeakPolarHBondContact CA-OG1 3.23Å; L436-T439 PolarHBondContact O-N 3.26Å; L436-T439 PolarHBondContact O-OG1 3.12Å; L436-T439 VanDerWaalsContact O-OG1 3.13Å; L436-Q440 VanDerWaalsContact O-CB 3.25Å; L436-Q440 WeakPolarHBondContact O-CB 3.39Å; L436-Q440 WeakPolarHBondContact O-CG 3.29Å; L436-Q440 PolarHBondContact O-N 2.82Å
437G92.8Very high91.9Very high20 Ų2015.7 Ų15.721%0.20610%0.104CC..Hα-helixtrans-59.4-49.5179.100000113.1G433 G434 V435 A441G433-G437 PolarHBondContact O-N 3.42Å; G434-G437 PolarHBondContact O-N 2.89Å; V435-G437 VanDerWaalsContact C-N 3.34Å; V435-G437 PolarHBondContact O-N 2.9Å; G437-A441 WeakPolarHBondContact O-CB 3.21Å; G437-A441 PolarHBondContact O-N 3.05Å
438V94.3Very high92.3Very high18 Ų1820.3 Ų20.311%0.10912%0.124CC..Hα-helixtrans-68.4-43.3-180176.10000111.6I235 M238 L395 G434 Q440 A441 V442I235-V438 HydrophobicContact CB-CG2 4.35Å; I235-V438 HydrophobicContact CG1-CG2 4.07Å; I235-V438 HydrophobicContact CG2-CG2 3.98Å; M238-V438 HydrophobicContact CE-CB 3.36Å; M238-V438 HydrophobicContact CE-CG1 3.35Å; M238-V438 HydrophobicContact CE-CG2 3.85Å; L395-V438 HydrophobicContact CD1-CG1 4.2Å; L395-V438 HydrophobicContact CD2-CG1 4.46Å; G434-V438 WeakPolarHBondContact O-CG2 3.27Å; G434-V438 PolarHBondContact O-N 3.48Å; G434-V438 VanDerWaalsContact O-N 3.09Å; V438-Q440 PolarHBondContact O-N 3.48Å; V438-A441 WeakPolarHBondContact O-CB 3.44Å; V438-A441 PolarHBondContact O-N 3.32Å; V438-V442 WeakPolarHBondContact O-CG2 3.39Å; V438-V442 PolarHBondContact O-N 2.75Å; V438-V442 VanDerWaalsContact O-N 3.14Å
439T92.9Very high92.4Very high0 Ų023.7 Ų23.70%015%0.148CC..Hα-helixtrans-65.8-38.4179.9510000112.2P388 K392 L395 V435 L436 V442 V443P388-T439 WeakPolarHBondContact O-CB 3.39Å; K392-T439 HydrophobicContact CB-CG2 4.25Å; L395-T439 HydrophobicContact CD1-CG2 4.34Å; V435-T439 WeakPolarHBondContact O-CB 3.45Å; V435-T439 WeakPolarHBondContact O-CG2 3.35Å; V435-T439 PolarHBondContact O-N 3.22Å; V435-T439 VanDerWaalsContact O-N 3.07Å; V435-T439 PolarHBondContact O-OG1 3.03Å; L436-T439 WeakPolarHBondContact CA-OG1 3.23Å; L436-T439 PolarHBondContact O-N 3.26Å; L436-T439 PolarHBondContact O-OG1 3.12Å; L436-T439 VanDerWaalsContact O-OG1 3.13Å; T439-V442 PolarHBondContact O-N 3.12Å; T439-V443 WeakPolarHBondContact O-CG2 3.36Å; T439-V443 PolarHBondContact O-N 3.21Å
440Q92.2Very high92.5Very high17 Ų1722.1 Ų22.18%0.07914%0.139CC..Hα-helixtrans-69.4-34.2173.9-70.8-71.29.500112.7A216 L436 V438 V442 V443 L444A216-Q440 HydrophobicContact CB-CG 4.07Å; L436-Q440 VanDerWaalsContact O-CB 3.25Å; L436-Q440 WeakPolarHBondContact O-CB 3.39Å; L436-Q440 WeakPolarHBondContact O-CG 3.29Å; L436-Q440 PolarHBondContact O-N 2.82Å; V438-Q440 PolarHBondContact O-N 3.48Å; Q440-V442 VanDerWaalsContact C-N 3.26Å; Q440-V442 PolarHBondContact O-N 3.49Å; Q440-V443 PolarHBondContact O-N 2.77Å; Q440-L444 WeakPolarHBondContact O-CB 3.41Å; Q440-L444 PolarHBondContact O-N 3.37Å
441A94.3Very high92.4Very high48 Ų4823.2 Ų23.240%0.39714%0.144SC..Hα-helixtrans-60.6-37.6172.400000111.7G437 V438 L444 S445G437-A441 WeakPolarHBondContact O-CB 3.21Å; G437-A441 PolarHBondContact O-N 3.05Å; V438-A441 WeakPolarHBondContact O-CB 3.44Å; V438-A441 PolarHBondContact O-N 3.32Å; A441-L444 WeakPolarHBondContact O-CB 3.22Å; A441-L444 PolarHBondContact O-N 2.95Å; A441-S445 PolarHBondContact O-N 3.01Å; A441-S445 PolarHBondContact O-OG 2.92Å; A441-S445 VanDerWaalsContact O-OG 3.11Å
442V93.7Very high92.2Very high32 Ų3231 Ų3119%0.19418%0.175CC..Hα-helixtrans-66.8-40.6174.6176.70000111.8G391 L395 V438 T439 Q440 S445 A446G391-V442 WeakPolarHBondContact O-CG1 3.45Å; L395-V442 HydrophobicContact CD2-CG2 3.53Å; L395-V442 HydrophobicContact CG-CG2 3.87Å; V438-V442 WeakPolarHBondContact O-CG2 3.39Å; V438-V442 PolarHBondContact O-N 2.75Å; V438-V442 VanDerWaalsContact O-N 3.14Å; T439-V442 PolarHBondContact O-N 3.12Å; Q440-V442 VanDerWaalsContact C-N 3.26Å; Q440-V442 PolarHBondContact O-N 3.49Å; V442-S445 PolarHBondContact O-N 3.16Å; V442-A446 WeakPolarHBondContact O-CB 3.5Å; V442-A446 PolarHBondContact O-N 3.05Å
443V93.9Very high92Very high0 Ų032.4 Ų32.40%018%0.182CC..Hα-helixtrans-61.3-45.3174.8175.50000110.8L209 A212 L345 F387 T439 Q440 S445 A446 G447L209-V443 HydrophobicContact CD2-CG1 4.45Å; A212-V443 HydrophobicContact CB-CG1 4.39Å; L345-V443 HydrophobicContact CD2-CG1 4.07Å; L345-V443 HydrophobicContact CD2-CG2 4.18Å; F387-V443 HydrophobicContact CB-CG1 4.44Å; F387-V443 HydrophobicContact CB-CG2 4.22Å; F387-V443 HydrophobicContact CD1-CG1 3.75Å; F387-V443 HydrophobicContact CD1-CG2 4.47Å; F387-V443 HydrophobicContact CE1-CG1 4.37Å; F387-V443 HydrophobicContact CG-CG1 4.27Å; F387-V443 WeakPolarHBondContact O-CG2 3.39Å; T439-V443 WeakPolarHBondContact O-CG2 3.36Å; T439-V443 PolarHBondContact O-N 3.21Å; Q440-V443 PolarHBondContact O-N 2.77Å; V443-S445 PolarHBondContact O-N 3.2Å; V443-A446 PolarHBondContact O-N 3.16Å; V443-G447 PolarHBondContact O-N 3.24Å
444L95.9Very high92Very high31 Ų3133 Ų3316%0.16219%0.186CC..Hα-helixtrans-56.1-50.3174.1171.958.4000111.6V210 L214 Q440 A441 A446 G447 F448V210-L444 HydrophobicContact CB-CD1 4.03Å; V210-L444 HydrophobicContact CG1-CD1 3.67Å; V210-L444 HydrophobicContact CG2-CD1 4.16Å; V210-L444 WeakPolarHBondContact O-CD1 3.34Å; L214-L444 HydrophobicContact CD1-CD1 4.4Å; L214-L444 HydrophobicContact CD2-CD1 4.36Å; L214-L444 HydrophobicContact CD2-CD2 3.86Å; L214-L444 HydrophobicContact CG-CD1 3.9Å; L214-L444 HydrophobicContact CG-CD2 4.24Å; Q440-L444 WeakPolarHBondContact O-CB 3.41Å; Q440-L444 PolarHBondContact O-N 3.37Å; A441-L444 WeakPolarHBondContact O-CB 3.22Å; A441-L444 PolarHBondContact O-N 2.95Å; L444-A446 VanDerWaalsContact C-N 3.33Å; L444-A446 PolarHBondContact O-N 3.04Å; L444-G447 WeakPolarHBondContact O-CA 3.47Å; L444-G447 PolarHBondContact O-N 3.1Å; L444-G447 VanDerWaalsContact O-N 3.1Å; L444-F448 HydrophobicContact CD1-CD2 4.34Å; L444-F448 HydrophobicContact CD1-CE1 4.45Å; L444-F448 HydrophobicContact CD1-CE2 3.63Å; L444-F448 HydrophobicContact CD1-CZ 3.69Å; L444-F448 HydrophobicContact CD2-CE2 4.34Å; L444-F448 HydrophobicContact CG-CD2 4.33Å; L444-F448 HydrophobicContact CG-CE2 3.75Å; L444-F448 HydrophobicContact CG-CZ 4.3Å; L444-F448 PolarHBondContact O-N 3.49Å; L444-F448 VanDerWaalsContact O-N 3.08Å
445S93.3Very high91.8Very high70 Ų7036.6 Ų36.649%0.4921%0.206SC..Hα-helixtrans-62.3-37.4178.3-63.80000112.9A441 V442 V443 G447 F448 S449A441-S445 PolarHBondContact O-N 3.01Å; A441-S445 PolarHBondContact O-OG 2.92Å; A441-S445 VanDerWaalsContact O-OG 3.11Å; V442-S445 PolarHBondContact O-N 3.16Å; V443-S445 PolarHBondContact O-N 3.2Å; S445-G447 VanDerWaalsContact C-N 3.29Å; S445-G447 PolarHBondContact O-N 3.01Å; S445-F448 PolarHBondContact O-N 3.04Å; S445-S449 PolarHBondContact O-N 2.89Å
446A91.3Very high91.6Very high14 Ų1439.3 Ų39.312%0.11622%0.219CC..Hα-helixtrans-65.8-33.6174.400000112.1L345 L349 V442 V443 L444 S449 S450L345-A446 HydrophobicContact CD1-CB 3.37Å; L349-A446 HydrophobicContact CD2-CB 4.49Å; V442-A446 WeakPolarHBondContact O-CB 3.5Å; V442-A446 PolarHBondContact O-N 3.05Å; V443-A446 PolarHBondContact O-N 3.16Å; L444-A446 VanDerWaalsContact C-N 3.33Å; L444-A446 PolarHBondContact O-N 3.04Å; A446-S449 PolarHBondContact O-N 3.28Å; A446-S450 PolarHBondContact O-N 3.17Å; A446-S450 PolarHBondContact O-OG 3.25Å
447G93.2Very high91.5Very high0 Ų045.5 Ų45.50%025%0.252CS..Hα-helixtrans-58.8-48.4167.900000112.1V443 L444 S445 S449 S450V443-G447 PolarHBondContact O-N 3.24Å; L444-G447 WeakPolarHBondContact O-CA 3.47Å; L444-G447 PolarHBondContact O-N 3.1Å; L444-G447 VanDerWaalsContact O-N 3.1Å; S445-G447 VanDerWaalsContact C-N 3.29Å; S445-G447 PolarHBondContact O-N 3.01Å; G447-S449 PolarHBondContact O-N 2.96Å; G447-S450 WeakPolarHBondContact O-CA 3.3Å; G447-S450 WeakPolarHBondContact O-CB 3.5Å; G447-S450 PolarHBondContact O-N 3.35Å
448F94Very high91.6Very high110 Ų11045.7 Ų45.748%0.48225%0.251SS..Hα-helixtrans-61.9-43.3176.1-66.9-45.3000113.2V210 L444 S445 S450 F451V210-F448 HydrophobicContact CG1-CE1 4.05Å; V210-F448 HydrophobicContact CG1-CZ 4.29Å; V210-F448 HydrophobicContact CG2-CD1 3.77Å; V210-F448 HydrophobicContact CG2-CE1 3.74Å; V210-F448 HydrophobicContact CG2-CG 4.43Å; V210-F448 HydrophobicContact CG2-CZ 4.41Å; L444-F448 HydrophobicContact CD1-CD2 4.34Å; L444-F448 HydrophobicContact CD1-CE1 4.45Å; L444-F448 HydrophobicContact CD1-CE2 3.63Å; L444-F448 HydrophobicContact CD1-CZ 3.69Å; L444-F448 HydrophobicContact CD2-CE2 4.34Å; L444-F448 HydrophobicContact CG-CD2 4.33Å; L444-F448 HydrophobicContact CG-CE2 3.75Å; L444-F448 HydrophobicContact CG-CZ 4.3Å; L444-F448 PolarHBondContact O-N 3.49Å; L444-F448 VanDerWaalsContact O-N 3.08Å; S445-F448 PolarHBondContact O-N 3.04Å; F448-S450 PolarHBondContact O-N 2.83Å; F448-S450 VanDerWaalsContact O-N 3.15Å; F448-F451 HydrophobicContact CD1-CD2 4.26Å; F448-F451 AromaticContact CD1-CE2 3.92Å; F448-F451 HydrophobicContact CD1-CE2 3.92Å; F448-F451 PolarHBondContact O-N 3.22Å; F448-F451 VanDerWaalsContact O-N 3.15Å
449S90.3Very high91.5Very high73 Ų7347.5 Ų47.551%0.5127%0.273SS..Hα-helixtrans-61.1-22.7174.5176.40000112.5R348 S445 A446 G447 F451 Y452R348-S449 PolarHBondContact NH2-O 3.08Å; S445-S449 PolarHBondContact O-N 2.89Å; A446-S449 PolarHBondContact O-N 3.28Å; G447-S449 PolarHBondContact O-N 2.96Å; S449-F451 VanDerWaalsContact C-N 3.31Å; S449-F451 PolarHBondContact O-N 3.23Å; S449-Y452 WeakPolarHBondContact O-CB 3.26Å; S449-Y452 PolarHBondContact O-N 2.95Å
450S88.1Confident91.6Very high1 Ų148.7 Ų48.71%0.00728%0.277CS..Hα-helixtrans-71.8-24.1178.4-58.50000113.9A206 R348 A446 G447 F448 Y452 L453A206-S450 VanDerWaalsContact CB-CB 3.46Å; R348-S450 VanDerWaalsContact NH1-CA 3.27Å; R348-S450 PolarHBondContact NH1-OG 3.22Å; A446-S450 PolarHBondContact O-N 3.17Å; A446-S450 PolarHBondContact O-OG 3.25Å; G447-S450 WeakPolarHBondContact O-CA 3.3Å; G447-S450 WeakPolarHBondContact O-CB 3.5Å; G447-S450 PolarHBondContact O-N 3.35Å; F448-S450 PolarHBondContact O-N 2.83Å; F448-S450 VanDerWaalsContact O-N 3.15Å; S450-Y452 PolarHBondContact O-N 2.95Å; S450-L453 PolarHBondContact O-N 3.46Å
451F89.4Confident91.7Very high24 Ų2447.9 Ų47.911%0.10527%0.273CS..G310 helixtrans-67.9-22.5175.9-63.8-54.4000113.3A206 P207 V210 F448 S449 L453 A454 I456 V465 I469A206-F451 HydrophobicContact CB-CD1 3.48Å; A206-F451 VanDerWaalsContact CB-CD1 3.48Å; A206-F451 HydrophobicContact CB-CE1 3.2Å; A206-F451 HydrophobicContact CB-CE2 4.29Å; A206-F451 HydrophobicContact CB-CG 4.13Å; A206-F451 HydrophobicContact CB-CZ 3.63Å; P207-F451 HydrophobicContact CG-CE1 4.04Å; P207-F451 HydrophobicContact CG-CZ 4.25Å; V210-F451 HydrophobicContact CG2-CE2 4Å; V210-F451 HydrophobicContact CG2-CZ 4.26Å; F448-F451 HydrophobicContact CD1-CD2 4.26Å; F448-F451 AromaticContact CD1-CE2 3.92Å; F448-F451 HydrophobicContact CD1-CE2 3.92Å; F448-F451 PolarHBondContact O-N 3.22Å; F448-F451 VanDerWaalsContact O-N 3.15Å; S449-F451 VanDerWaalsContact C-N 3.31Å; S449-F451 PolarHBondContact O-N 3.23Å; F451-L453 PolarHBondContact O-N 3.35Å; F451-L453 VanDerWaalsContact O-N 3.1Å; F451-A454 PolarHBondContact O-N 2.93Å; F451-I456 HydrophobicContact CB-CD1 4.47Å; F451-I456 HydrophobicContact CD1-CD1 4.27Å; F451-I456 HydrophobicContact CG-CD1 4.47Å; F451-V465 HydrophobicContact CD1-CG1 4.36Å; F451-V465 HydrophobicContact CD1-CG2 3.95Å; F451-V465 HydrophobicContact CE1-CB 4.14Å; F451-V465 HydrophobicContact CE1-CG1 3.5Å; F451-V465 HydrophobicContact CE1-CG2 3.45Å; F451-V465 VanDerWaalsContact CE1-CG2 3.45Å; F451-V465 HydrophobicContact CE2-CG1 4.18Å; F451-V465 HydrophobicContact CZ-CB 4.49Å; F451-V465 HydrophobicContact CZ-CG1 3.41Å; F451-V465 VanDerWaalsContact CZ-CG1 3.41Å; F451-V465 HydrophobicContact CZ-CG2 4.26Å; F451-I469 HydrophobicContact CZ-CD1 4.3Å
452Y88.8Confident91.8Very high165 Ų16550 Ų5065%0.64728%0.277SS*.G310 helixtrans-62.8-16.9176.9-176.1-112.8000113.7S449 S450 A454 P533S449-Y452 WeakPolarHBondContact O-CB 3.26Å; S449-Y452 PolarHBondContact O-N 2.95Å; S450-Y452 PolarHBondContact O-N 2.95Å; Y452-A454 VanDerWaalsContact C-N 3.32Å; Y452-P533 HydrophobicContact CD1-CG 4.09Å; Y452-P533 HydrophobicContact CE1-CB 4.29Å; Y452-P533 HydrophobicContact CE1-CG 3.31Å
453L86.1Confident91.9Very high42 Ų4253.8 Ų53.822%0.2229%0.291CS..G310 helixtrans-79.7-14.1176.8-60.4-179.2000113.3P202 S450 F451 G527P202-L453 HydrophobicContact CB-CB 4.01Å; P202-L453 HydrophobicContact CG-CB 3.78Å; P202-L453 HydrophobicContact CG-CD1 4.26Å; S450-L453 PolarHBondContact O-N 3.46Å; F451-L453 PolarHBondContact O-N 3.35Å; F451-L453 VanDerWaalsContact O-N 3.1Å; L453-G527 WeakPolarHBondContact O-CA 3.39Å
454A89.6Confident91.9Very high12 Ų1253.8 Ų53.810%0.09929%0.291CS..SBendtrans-121.4160-178.800000110.5P202 L203 F451 Y452 I456P202-A454 HydrophobicContact CB-CB 4.39Å; L203-A454 HydrophobicContact CD1-CB 4.36Å; L203-A454 HydrophobicContact CD2-CB 3.95Å; L203-A454 HydrophobicContact CG-CB 4.02Å; F451-A454 PolarHBondContact O-N 2.93Å; Y452-A454 VanDerWaalsContact C-N 3.32Å; A454-I456 PolarHBondContact O-N 3.29Å
455D90.1Very high91.9Very high76 Ų7653 Ų5341%0.40629%0.288SS..  trans-76.690.4176.3-177.63.8000110.2D457 S458 N461 E525D455-D457 PolarHBondContact O-N 3.28Å; D455-D457 PolarHBondContact OD1-N 2.7Å; D455-S458 PolarHBondContact O-N 2.75Å; D455-N461 WeakPolarHBondContact O-CB 3.5Å; D455-N461 PolarHBondContact O-ND2 2.97Å; D455-E525 HydrophobicContact CB-CG 4.39Å; D455-E525 PolarHBondContact N-O 3.41Å; D455-E525 VanDerWaalsContact N-O 3.15Å
456I89.1Confident92Very high63 Ų6351.5 Ų51.532%0.32328%0.283SS..THydrogen-bonded Turntrans-75.2-7.6-176.8-155.859.9000113.2F451 A454 S458 I462 V465F451-I456 HydrophobicContact CB-CD1 4.47Å; F451-I456 HydrophobicContact CD1-CD1 4.27Å; F451-I456 HydrophobicContact CG-CD1 4.47Å; A454-I456 PolarHBondContact O-N 3.29Å; I456-S458 VanDerWaalsContact C-N 3.32Å; I456-I462 WeakPolarHBondContact O-CD1 3.26Å; I456-I462 WeakPolarHBondContact O-CG1 3.13Å; I456-V465 HydrophobicContact CD1-CG2 3.99Å
457D89.2Confident92.3Very high140 Ų14054.7 Ų54.775%0.74930%0.295SS*.THydrogen-bonded Turntrans-82.5-15.3177.3-65.6-35.9000111.8D455 G459D455-D457 PolarHBondContact O-N 3.28Å; D455-D457 PolarHBondContact OD1-N 2.7Å; D457-G459 PolarHBondContact O-N 3.25Å
458S93.6Very high92.5Very high24 Ų2454.7 Ų54.717%0.16830%0.295CS..SBendtrans-67.5130.6172.8174.70000112.2D455 I456 R460 N461 I462 E525D455-S458 PolarHBondContact O-N 2.75Å; I456-S458 VanDerWaalsContact C-N 3.32Å; S458-R460 PolarHBondContact O-N 3.44Å; S458-R460 VanDerWaalsContact O-N 3.16Å; S458-R460 PolarHBondContact OG-N 2.99Å; S458-N461 PolarHBondContact O-N 2.9Å; S458-I462 WeakPolarHBondContact O-CG1 3.29Å; S458-I462 PolarHBondContact O-N 3.37Å; S458-E525 VanDerWaalsContact CB-OE1 3.28Å; S458-E525 WeakPolarHBondContact CB-OE1 3.44Å; S458-E525 PolarHBondContact OG-OE1 3.11Å
459G93.6Very high92.6Very high56 Ų5650.9 Ų50.958%0.57728%0.279SS*.Hα-helixtrans-56.3-31174.700000113.8D457 F463D457-G459 PolarHBondContact O-N 3.25Å; G459-F463 WeakPolarHBondContact O-CB 3.44Å; G459-F463 PolarHBondContact O-N 2.92Å; G459-F463 VanDerWaalsContact O-N 3.11Å
460R94.2Very high93Very high24 Ų2453.7 Ų53.79%0.09128%0.283CS..Hα-helixtrans-59-55.3172.1166.9-176.9-179.2-89.20.4110.5S458 F463 I464 E516 I519 P520 R526S458-R460 PolarHBondContact O-N 3.44Å; S458-R460 VanDerWaalsContact O-N 3.16Å; S458-R460 PolarHBondContact OG-N 2.99Å; R460-F463 PolarHBondContact O-N 3.27Å; R460-I464 HydrophobicContact CG-CD1 3.7Å; R460-I464 VanDerWaalsContact O-CG1 3.28Å; R460-I464 WeakPolarHBondContact O-CG1 3.27Å; R460-I464 PolarHBondContact O-N 3.23Å; R460-E516 IonicContact CZ-OE1 3.9Å; R460-E516 IonicContact CZ-OE2 2.83Å; R460-E516 IonicContact NH1-OE1 3.1Å; R460-E516 PolarHBondContact NH1-OE1 3.39Å; R460-E516 IonicContact NH1-OE2 3.61Å; R460-E516 PolarHBondContact NH2-O 3.49Å; R460-E516 IonicContact NH2-OE1 3.81Å; R460-E516 PolarHBondContact NH2-OE1 2.93Å; R460-E516 IonicContact NH2-OE2 3.71Å; R460-E516 PolarHBondContact NH2-OE2 2.81Å; R460-I519 HydrophobicContact CG-CG2 3.76Å; R460-I519 PolarHBondContact NE-O 3.46Å; R460-I519 PolarHBondContact NH2-O 2.78Å; R460-P520 WeakPolarHBondContact CD-O 3.1Å; R460-P520 PolarHBondContact NE-O 2.78Å; R460-R526 VanDerWaalsContact NH2-NE 3.17Å
461N94.8Very high93.3Very high0 Ų056.7 Ų56.70%030%0.297CS..Hα-helixtrans-69.4-39.1-173.1-69.9-2.5000111.3L203 D455 S458 F463 I464 V465 E525L203-N461 HydrophobicContact CD1-CB 4.28Å; L203-N461 VanDerWaalsContact CD1-CG 3.45Å; L203-N461 WeakPolarHBondContact CD1-OD1 3.19Å; L203-N461 HydrophobicContact CD2-CB 4Å; D455-N461 WeakPolarHBondContact O-CB 3.5Å; D455-N461 PolarHBondContact O-ND2 2.97Å; S458-N461 PolarHBondContact O-N 2.9Å; N461-F463 VanDerWaalsContact C-N 3.3Å; N461-F463 PolarHBondContact O-N 2.87Å; N461-I464 PolarHBondContact O-N 3.37Å; N461-V465 WeakPolarHBondContact O-CB 3.31Å; N461-V465 VanDerWaalsContact O-CG2 3.31Å; N461-V465 WeakPolarHBondContact O-CG2 3.48Å; N461-V465 PolarHBondContact O-N 3.41Å; N461-E525 PolarHBondContact ND2-O 3.3Å
462I95Very high93.7Very high93 Ų9355.6 Ų55.648%0.47729%0.292SS..Hα-helixtrans-55.8-47172.5-65170.1000110.4I456 S458 G466I456-I462 WeakPolarHBondContact O-CD1 3.26Å; I456-I462 WeakPolarHBondContact O-CG1 3.13Å; S458-I462 WeakPolarHBondContact O-CG1 3.29Å; S458-I462 PolarHBondContact O-N 3.37Å; I462-G466 PolarHBondContact O-N 2.95Å
463F95.7Very high93.9Very high111 Ų11150.6 Ų50.649%0.48728%0.276SS..Hα-helixtrans-64-48.8178.3-179.8-96.4000112G459 R460 N461 V465 G466 F467 I519G459-F463 WeakPolarHBondContact O-CB 3.44Å; G459-F463 PolarHBondContact O-N 2.92Å; G459-F463 VanDerWaalsContact O-N 3.11Å; R460-F463 PolarHBondContact O-N 3.27Å; N461-F463 VanDerWaalsContact C-N 3.3Å; N461-F463 PolarHBondContact O-N 2.87Å; F463-V465 PolarHBondContact O-N 3.25Å; F463-G466 PolarHBondContact O-N 3.22Å; F463-F467 HydrophobicContact CE1-CB 4.42Å; F463-F467 HydrophobicContact CZ-CB 4.34Å; F463-F467 HydrophobicContact CZ-CD2 4.13Å; F463-F467 HydrophobicContact CZ-CG 4.32Å; F463-F467 WeakPolarHBondContact O-CB 3.08Å; F463-F467 PolarHBondContact O-N 3.43Å; F463-I519 HydrophobicContact CD1-CD1 4.24Å
464I95.7Very high94.3Very high0 Ų052.5 Ų52.50%029%0.286CS..Hα-helixtrans-56.2-51.2180-67169.2000110.5L203 R460 N461 S468 L515 E516 I519L203-I464 HydrophobicContact CB-CG2 4.48Å; R460-I464 HydrophobicContact CG-CD1 3.7Å; R460-I464 VanDerWaalsContact O-CG1 3.28Å; R460-I464 WeakPolarHBondContact O-CG1 3.27Å; R460-I464 PolarHBondContact O-N 3.23Å; N461-I464 PolarHBondContact O-N 3.37Å; I464-S468 WeakPolarHBondContact O-CB 3.14Å; I464-S468 PolarHBondContact O-N 2.88Å; I464-S468 PolarHBondContact O-OG 2.88Å; I464-L515 HydrophobicContact CG1-CB 3.99Å; I464-L515 HydrophobicContact CG2-CB 4.17Å; I464-E516 WeakPolarHBondContact CD1-OE2 3.38Å; I464-I519 HydrophobicContact CD1-CD1 4.25Å; I464-I519 HydrophobicContact CG1-CD1 3.88Å
465V95.5Very high94.3Very high14 Ų1454.1 Ų54.19%0.08529%0.293CS..Hα-helixtrans-65-51.7-177.9171.50000111L203 P207 F451 I456 N461 F463 S468 I469L203-V465 HydrophobicContact CD2-CG2 3.74Å; P207-V465 HydrophobicContact CG-CG1 4.45Å; P207-V465 HydrophobicContact CG-CG2 4.24Å; F451-V465 HydrophobicContact CD1-CG1 4.36Å; F451-V465 HydrophobicContact CD1-CG2 3.95Å; F451-V465 HydrophobicContact CE1-CB 4.14Å; F451-V465 HydrophobicContact CE1-CG1 3.5Å; F451-V465 HydrophobicContact CE1-CG2 3.45Å; F451-V465 VanDerWaalsContact CE1-CG2 3.45Å; F451-V465 HydrophobicContact CE2-CG1 4.18Å; F451-V465 HydrophobicContact CZ-CB 4.49Å; F451-V465 HydrophobicContact CZ-CG1 3.41Å; F451-V465 VanDerWaalsContact CZ-CG1 3.41Å; F451-V465 HydrophobicContact CZ-CG2 4.26Å; I456-V465 HydrophobicContact CD1-CG2 3.99Å; N461-V465 WeakPolarHBondContact O-CB 3.31Å; N461-V465 VanDerWaalsContact O-CG2 3.31Å; N461-V465 WeakPolarHBondContact O-CG2 3.48Å; N461-V465 PolarHBondContact O-N 3.41Å; F463-V465 PolarHBondContact O-N 3.25Å; V465-S468 PolarHBondContact O-N 2.87Å; V465-I469 HydrophobicContact CG1-CD1 3.72Å; V465-I469 WeakPolarHBondContact O-CG1 3.38Å; V465-I469 PolarHBondContact O-N 2.91Å; V465-I469 VanDerWaalsContact O-N 3.08Å
466G95.8Very high94.3Very high39 Ų3950.8 Ų50.840%0.40228%0.276SS..Hα-helixtrans-61.4-47.4-177.500000112.5I462 F463 F470I462-G466 PolarHBondContact O-N 2.95Å; F463-G466 PolarHBondContact O-N 3.22Å; G466-F470 WeakPolarHBondContact O-CB 3.13Å; G466-F470 PolarHBondContact O-N 3.23Å
467F96.9Very high94.2Very high82 Ų8255.5 Ų55.536%0.3629%0.289SS..Hα-helixtrans-64.4-45.2179.3-175.8-90.7000111.8F463 F470 M471 L515F463-F467 HydrophobicContact CE1-CB 4.42Å; F463-F467 HydrophobicContact CZ-CB 4.34Å; F463-F467 HydrophobicContact CZ-CD2 4.13Å; F463-F467 HydrophobicContact CZ-CG 4.32Å; F463-F467 WeakPolarHBondContact O-CB 3.08Å; F463-F467 PolarHBondContact O-N 3.43Å; F467-F470 PolarHBondContact O-N 2.91Å; F467-M471 HydrophobicContact CD1-CG 4.02Å; F467-M471 HydrophobicContact CD2-CG 4.09Å; F467-M471 HydrophobicContact CE1-CB 4.49Å; F467-M471 HydrophobicContact CE1-CG 3.74Å; F467-M471 HydrophobicContact CE2-CG 3.79Å; F467-M471 HydrophobicContact CE2-SD 4.32Å; F467-M471 HydrophobicContact CG-CG 4.22Å; F467-M471 HydrophobicContact CZ-CE 4.17Å; F467-M471 HydrophobicContact CZ-CG 3.62Å; F467-M471 HydrophobicContact CZ-SD 4.36Å; F467-M471 WeakPolarHBondContact O-CB 3.38Å; F467-M471 WeakPolarHBondContact O-CG 3.2Å; F467-M471 PolarHBondContact O-N 2.99Å; F467-L515 HydrophobicContact CB-CD1 4.4Å; F467-L515 HydrophobicContact CD1-CD1 3.55Å; F467-L515 HydrophobicContact CE1-CD1 4.2Å; F467-L515 HydrophobicContact CG-CD1 4.3Å
468S97Very high94.1Very high0 Ų055.7 Ų55.70%028%0.28CS..Hα-helixtrans-63.1-46-178.1-56.50000111.8I464 V465 A472 S511 G512I464-S468 WeakPolarHBondContact O-CB 3.14Å; I464-S468 PolarHBondContact O-N 2.88Å; I464-S468 PolarHBondContact O-OG 2.88Å; V465-S468 PolarHBondContact O-N 2.87Å; S468-A472 WeakPolarHBondContact O-CB 3.37Å; S468-A472 PolarHBondContact O-N 3.45Å; S468-A472 VanDerWaalsContact O-N 3.1Å; S468-S511 WeakPolarHBondContact CA-OG 3.35Å; S468-S511 WeakPolarHBondContact CB-OG 3.5Å; S468-S511 PolarHBondContact OG-OG 2.94Å; S468-G512 WeakPolarHBondContact OG-CA 3.47Å; S468-G512 PolarHBondContact OG-N 2.93Å
469I97.1Very high93.6Very high29 Ų2955.2 Ų55.215%0.14928%0.275CS..Hα-helixtrans-65.1-47.9177.6-63.9168.4000110.6P207 V210 V211 F451 V465 A472 L473P207-I469 HydrophobicContact CB-CD1 4.47Å; P207-I469 HydrophobicContact CB-CG1 3.84Å; V210-I469 HydrophobicContact CB-CD1 4.27Å; V210-I469 HydrophobicContact CG1-CD1 3.86Å; V210-I469 HydrophobicContact CG1-CG1 4.3Å; V210-I469 HydrophobicContact CG1-CG2 4.29Å; V211-I469 HydrophobicContact CG2-CB 4.3Å; V211-I469 HydrophobicContact CG2-CG1 4.29Å; V211-I469 HydrophobicContact CG2-CG2 4.08Å; F451-I469 HydrophobicContact CZ-CD1 4.3Å; V465-I469 HydrophobicContact CG1-CD1 3.72Å; V465-I469 WeakPolarHBondContact O-CG1 3.38Å; V465-I469 PolarHBondContact O-N 2.91Å; V465-I469 VanDerWaalsContact O-N 3.08Å; I469-A472 PolarHBondContact O-N 3.28Å; I469-L473 HydrophobicContact CG2-CD1 4.08Å; I469-L473 WeakPolarHBondContact O-CG 3.34Å; I469-L473 PolarHBondContact O-N 2.84Å
470F96.9Very high92.8Very high133 Ų13358 Ų5858%0.58327%0.268SS*.Hα-helixtrans-62.9-49-176.1-177.5-102.8000111.8G466 F467 A472 L473 L474G466-F470 WeakPolarHBondContact O-CB 3.13Å; G466-F470 PolarHBondContact O-N 3.23Å; F467-F470 PolarHBondContact O-N 2.91Å; F470-A472 PolarHBondContact O-N 3.42Å; F470-L473 PolarHBondContact O-N 2.79Å; F470-L474 HydrophobicContact CD1-CD2 4.38Å; F470-L474 HydrophobicContact CE1-CB 4.5Å; F470-L474 HydrophobicContact CE1-CD2 3.7Å; F470-L474 HydrophobicContact CZ-CD2 4.19Å; F470-L474 VanDerWaalsContact O-CB 3.22Å; F470-L474 WeakPolarHBondContact O-CB 3.37Å; F470-L474 PolarHBondContact O-N 3.43Å
471M96.1Very high92.1Very high64 Ų6463 Ų6332%0.31529%0.292SS..Hα-helixtrans-66.4-37.6-179.8-69-61.7-84.700112.2F467 L473 L474 L475F467-M471 HydrophobicContact CD1-CG 4.02Å; F467-M471 HydrophobicContact CD2-CG 4.09Å; F467-M471 HydrophobicContact CE1-CB 4.49Å; F467-M471 HydrophobicContact CE1-CG 3.74Å; F467-M471 HydrophobicContact CE2-CG 3.79Å; F467-M471 HydrophobicContact CE2-SD 4.32Å; F467-M471 HydrophobicContact CG-CG 4.22Å; F467-M471 HydrophobicContact CZ-CE 4.17Å; F467-M471 HydrophobicContact CZ-CG 3.62Å; F467-M471 HydrophobicContact CZ-SD 4.36Å; F467-M471 WeakPolarHBondContact O-CB 3.38Å; F467-M471 WeakPolarHBondContact O-CG 3.2Å; F467-M471 PolarHBondContact O-N 2.99Å; M471-L473 PolarHBondContact O-N 3.32Å; M471-L474 PolarHBondContact O-N 3Å; M471-L474 HydrophobicContact SD-CD2 4.19Å; M471-L475 VanDerWaalsContact O-CB 3.3Å; M471-L475 WeakPolarHBondContact O-CB 3.42Å; M471-L475 PolarHBondContact O-N 3.47Å
472A96.2Very high91.2Very high0 Ų064 Ų640%030%0.3CS..Hα-helixtrans-66.5-23.3177.500000114V211 S468 I469 F470 P476 P504 L507 A508V211-A472 HydrophobicContact CG1-CB 4.05Å; V211-A472 HydrophobicContact CG2-CB 3.94Å; S468-A472 WeakPolarHBondContact O-CB 3.37Å; S468-A472 PolarHBondContact O-N 3.45Å; S468-A472 VanDerWaalsContact O-N 3.1Å; I469-A472 PolarHBondContact O-N 3.28Å; F470-A472 PolarHBondContact O-N 3.42Å; A472-P476 WeakPolarHBondContact O-CD 3.45Å; A472-P476 VanDerWaalsContact O-CG 3.22Å; A472-P476 WeakPolarHBondContact O-CG 3.43Å; A472-P504 WeakPolarHBondContact CB-O 3.33Å; A472-P504 WeakPolarHBondContact O-CB 3.47Å; A472-L507 HydrophobicContact CB-CB 4.05Å; A472-A508 HydrophobicContact CB-CB 3.69Å
473L93.9Very high89.2Confident60 Ų6065.3 Ų65.331%0.31432%0.315SS..Hα-helixtrans-92.6-37.8173.1-64.6175.4000112.3V211 L214 I469 F470 M471 R477V211-L473 HydrophobicContact CG1-CD2 4.26Å; L214-L473 HydrophobicContact CB-CD2 4.28Å; L214-L473 HydrophobicContact CD1-CD1 4Å; I469-L473 HydrophobicContact CG2-CD1 4.08Å; I469-L473 WeakPolarHBondContact O-CG 3.34Å; I469-L473 PolarHBondContact O-N 2.84Å; F470-L473 PolarHBondContact O-N 2.79Å; M471-L473 PolarHBondContact O-N 3.32Å; L473-R477 WeakPolarHBondContact O-CB 3.19Å
474L93.4Very high87.3Confident82 Ų8264.8 Ų64.843%0.42932%0.321SS..Hα-helixtrans-67.6-51.4-178.1177.867.8000111.8F470 M471 R477 W478F470-L474 HydrophobicContact CD1-CD2 4.38Å; F470-L474 HydrophobicContact CE1-CB 4.5Å; F470-L474 HydrophobicContact CE1-CD2 3.7Å; F470-L474 HydrophobicContact CZ-CD2 4.19Å; F470-L474 VanDerWaalsContact O-CB 3.22Å; F470-L474 WeakPolarHBondContact O-CB 3.37Å; F470-L474 PolarHBondContact O-N 3.43Å; M471-L474 PolarHBondContact O-N 3Å; M471-L474 HydrophobicContact SD-CD2 4.19Å; L474-R477 WeakPolarHBondContact O-CB 3.44Å; L474-R477 PolarHBondContact O-N 3.1Å; L474-W478 PolarHBondContact O-N 3.22Å
475L91.2Very high85.9Confident46 Ų4667.3 Ų67.324%0.24133%0.334CS..Hα-helixtrans-67.1-47.6-168.3-169.166000112.2M471 R477 W478 F479 L501 L507M471-L475 VanDerWaalsContact O-CB 3.3Å; M471-L475 WeakPolarHBondContact O-CB 3.42Å; M471-L475 PolarHBondContact O-N 3.47Å; L475-R477 VanDerWaalsContact C-N 3.25Å; L475-R477 PolarHBondContact O-N 3.19Å; L475-W478 HydrophobicContact CD1-CE3 4.49Å; L475-W478 PolarHBondContact O-N 3.26Å; L475-F479 HydrophobicContact CD1-CD2 4.03Å; L475-F479 HydrophobicContact CD1-CE2 3.53Å; L475-F479 HydrophobicContact CD1-CZ 4.48Å; L475-F479 HydrophobicContact CD2-CE2 4.16Å; L475-F479 HydrophobicContact CG-CD2 3.84Å; L475-F479 HydrophobicContact CG-CE2 3.6Å; L475-F479 VanDerWaalsContact O-CD2 3.26Å; L475-F479 WeakPolarHBondContact O-CD2 3.32Å; L475-F479 PolarHBondContact O-N 2.86Å; L475-L501 HydrophobicContact CD2-CB 4.32Å; L475-L501 HydrophobicContact CD2-CD2 3.93Å; L475-L507 HydrophobicContact CB-CD1 4.08Å; L475-L507 HydrophobicContact CD2-CD1 3.99Å; L475-L507 HydrophobicContact CD2-CD2 4.2Å; L475-L507 HydrophobicContact CG-CD1 4.4Å
476P89.4Confident84.5Confident6 Ų670.3 Ų70.34%0.03935%0.346CS..Hα-helixtrans-59.7-35.3174.1-28.239.4000113.5A472 R480 T502 P504 L507A472-P476 WeakPolarHBondContact O-CD 3.45Å; A472-P476 VanDerWaalsContact O-CG 3.22Å; A472-P476 WeakPolarHBondContact O-CG 3.43Å; P476-R480 WeakPolarHBondContact O-CB 3.39Å; P476-R480 PolarHBondContact O-N 3.44Å; P476-R480 VanDerWaalsContact O-N 3.1Å; P476-T502 HydrophobicContact CB-CG2 4.46Å; P476-P504 HydrophobicContact CG-CB 4.18Å; P476-L507 HydrophobicContact CG-CD1 3.7Å
477R87.2Confident83.3Confident162 Ų16273.6 Ų73.661%0.61136%0.363SS*.Hα-helixtrans-66.7-45.5177.7-177.4178.3177.2176.4-2.6111.2L473 L474 L475 R480 E481L473-R477 WeakPolarHBondContact O-CB 3.19Å; L474-R477 WeakPolarHBondContact O-CB 3.44Å; L474-R477 PolarHBondContact O-N 3.1Å; L475-R477 VanDerWaalsContact C-N 3.25Å; L475-R477 PolarHBondContact O-N 3.19Å; R477-R480 PolarHBondContact O-N 3.49Å; R477-E481 WeakPolarHBondContact CG-OE1 3.32Å; R477-E481 IonicContact CZ-OE1 3.42Å; R477-E481 IonicContact NE-OE1 2.74Å; R477-E481 PolarHBondContact NE-OE1 3.47Å; R477-E481 VanDerWaalsContact NE-OE1 3.08Å; R477-E481 IonicContact NH2-OE1 3.8Å; R477-E481 PolarHBondContact O-N 3.12Å
478W86.6Confident82.5Confident144 Ų14472.9 Ų72.955%0.54537%0.365SS..Hα-helixtrans-59.9-46.6176.7-179.480.4000111.5L474 L475 R480 E481 A482L474-W478 PolarHBondContact O-N 3.22Å; L475-W478 HydrophobicContact CD1-CE3 4.49Å; L475-W478 PolarHBondContact O-N 3.26Å; W478-R480 VanDerWaalsContact C-N 3.26Å; W478-R480 PolarHBondContact O-N 2.99Å; W478-E481 PolarHBondContact O-N 3.28Å; W478-A482 HydrophobicContact CD2-CB 4.43Å; W478-A482 HydrophobicContact CZ2-CB 4.3Å; W478-A482 WeakPolarHBondContact O-CB 3.19Å; W478-A482 PolarHBondContact O-N 3.11Å
479F83.4Confident81.7Confident15 Ų1576.2 Ų76.27%0.06640%0.4CS..Hα-helixtrans-61-33176.8-84.2-66.2000113.5L475 E481 F486 H498 L501L475-F479 HydrophobicContact CD1-CD2 4.03Å; L475-F479 HydrophobicContact CD1-CE2 3.53Å; L475-F479 HydrophobicContact CD1-CZ 4.48Å; L475-F479 HydrophobicContact CD2-CE2 4.16Å; L475-F479 HydrophobicContact CG-CD2 3.84Å; L475-F479 HydrophobicContact CG-CE2 3.6Å; L475-F479 VanDerWaalsContact O-CD2 3.26Å; L475-F479 WeakPolarHBondContact O-CD2 3.32Å; L475-F479 PolarHBondContact O-N 2.86Å; F479-E481 VanDerWaalsContact C-N 3.31Å; F479-E481 PolarHBondContact O-N 2.82Å; F479-F486 HydrophobicContact CD1-CE2 4.37Å; F479-F486 HydrophobicContact CE1-CD2 4.07Å; F479-F486 AromaticContact CE1-CE2 3.24Å; F479-F486 HydrophobicContact CE1-CE2 3.24Å; F479-F486 AromaticContact CE1-CZ 3.72Å; F479-F486 HydrophobicContact CE1-CZ 3.72Å; F479-F486 AromaticContact CZ-CE2 3.48Å; F479-F486 HydrophobicContact CZ-CE2 3.48Å; F479-F486 VanDerWaalsContact CZ-CE2 3.48Å; F479-F486 AromaticContact CZ-CZ 3.61Å; F479-F486 HydrophobicContact CZ-CZ 3.61Å; F479-H498 AromaticContact CD1-CD2 3.82Å; F479-L501 HydrophobicContact CD2-CB 3.77Å; F479-L501 HydrophobicContact CE2-CB 3.41Å; F479-L501 VanDerWaalsContact CE2-CB 3.41Å; F479-L501 HydrophobicContact CE2-CD1 3.67Å; F479-L501 HydrophobicContact CE2-CG 4.14Å; F479-L501 HydrophobicContact CZ-CB 4.03Å; F479-L501 HydrophobicContact CZ-CD1 3.53Å; F479-L501 HydrophobicContact CZ-CG 4.44Å
480R77.1Confident81.2Confident115 Ų11584 Ų8443%0.43443%0.427SS..Hα-helixtrans-71.9-24176.7-132.8-176.1-81-171.2-3.1113.3E219 P476 R477 W478E219-R480 IonicContact OE1-NH1 2.73Å; P476-R480 WeakPolarHBondContact O-CB 3.39Å; P476-R480 PolarHBondContact O-N 3.44Å; P476-R480 VanDerWaalsContact O-N 3.1Å; R477-R480 PolarHBondContact O-N 3.49Å; W478-R480 VanDerWaalsContact C-N 3.26Å; W478-R480 PolarHBondContact O-N 2.99Å
481E79.7Confident80.7Confident128 Ų12880.6 Ų80.660%0.59842%0.42SS*.Hα-helixtrans-104.9-19.6-175.7-67.4176.9-16400113.2R477 W478 F479R477-E481 WeakPolarHBondContact CG-OE1 3.32Å; R477-E481 IonicContact CZ-OE1 3.42Å; R477-E481 IonicContact NE-OE1 2.74Å; R477-E481 PolarHBondContact NE-OE1 3.47Å; R477-E481 VanDerWaalsContact NE-OE1 3.08Å; R477-E481 IonicContact NH2-OE1 3.8Å; R477-E481 PolarHBondContact O-N 3.12Å; W478-E481 PolarHBondContact O-N 3.28Å; F479-E481 VanDerWaalsContact C-N 3.31Å; F479-E481 PolarHBondContact O-N 2.82Å
482A75.3Confident80.5Confident21 Ų2179.2 Ų79.217%0.17442%0.416CS..  trans-68.8131.1-175.700000112.5W478W478-A482 HydrophobicContact CD2-CB 4.43Å; W478-A482 HydrophobicContact CZ2-CB 4.3Å; W478-A482 WeakPolarHBondContact O-CB 3.19Å; W478-A482 PolarHBondContact O-N 3.11Å
483P52.6Low80.2Confident120 Ų12082.6 Ų82.678%0.77943%0.433SS*.SBendtrans-80.4-13.1-174.630.2-35.1000115.1
484V56.9Low80Confident101 Ų10180.4 Ų80.461%0.61242%0.422SS*.SBendtrans-129.2109.3179.3-171.70000109
485L64.9Low79.8Confident52 Ų5276.5 Ų76.527%0.27240%0.402SS..  trans-70.8157.7171.4-106.571.2000110.6Q128 S487 H498Q128-L485 HydrophobicContact CG-CD2 4.08Å; L485-S487 PolarHBondContact O-N 3.22Å; L485-S487 PolarHBondContact O-OG 3.32Å; L485-H498 HydrophobicContact CD2-CB 4.46Å; L485-H498 WeakPolarHBondContact CD2-ND1 3.49Å
486F66.7Low79.9Confident78 Ų7876.2 Ų76.234%0.34240%0.4SS..  trans-40.7125.1167.4-65-71.7000110.8F479 T488 D494 L497 L501F479-F486 HydrophobicContact CD1-CE2 4.37Å; F479-F486 HydrophobicContact CE1-CD2 4.07Å; F479-F486 AromaticContact CE1-CE2 3.24Å; F479-F486 HydrophobicContact CE1-CE2 3.24Å; F479-F486 AromaticContact CE1-CZ 3.72Å; F479-F486 HydrophobicContact CE1-CZ 3.72Å; F479-F486 AromaticContact CZ-CE2 3.48Å; F479-F486 HydrophobicContact CZ-CE2 3.48Å; F479-F486 VanDerWaalsContact CZ-CE2 3.48Å; F479-F486 AromaticContact CZ-CZ 3.61Å; F479-F486 HydrophobicContact CZ-CZ 3.61Å; F486-T488 HydrophobicContact CB-CG2 4.47Å; F486-D494 HydrophobicContact CB-CB 4.46Å; F486-D494 WeakPolarHBondContact CB-OD1 3.25Å; F486-L497 HydrophobicContact CD2-CB 4.4Å; F486-L497 HydrophobicContact CE2-CB 4.39Å; F486-L501 HydrophobicContact CE2-CD1 3.93Å; F486-L501 HydrophobicContact CZ-CD1 4Å
487S71.6Confident80Confident108 Ų10878.8 Ų78.876%0.75541%0.413SS*.  trans-119.569.1172-64.60000106.7L485 G489L485-S487 PolarHBondContact O-N 3.22Å; L485-S487 PolarHBondContact O-OG 3.32Å; S487-G489 PolarHBondContact O-N 2.61Å
488T78.9Confident80.1Confident66 Ų6671.8 Ų71.841%0.40539%0.387SS..  trans-71.8-8.5177.759.80000112.2F486 W490 L493 D494F486-T488 HydrophobicContact CB-CG2 4.47Å; T488-W490 PolarHBondContact OG1-N 3.29Å; T488-L493 HydrophobicContact CG2-CD2 4.34Å; T488-D494 VanDerWaalsContact CB-OD1 3.31Å; T488-D494 WeakPolarHBondContact CB-OD1 3.27Å; T488-D494 VanDerWaalsContact CG2-OD1 3.26Å; T488-D494 WeakPolarHBondContact CG2-OD1 3.44Å; T488-D494 PolarHBondContact N-OD1 3.47Å; T488-D494 VanDerWaalsContact N-OD1 3.1Å; T488-D494 VanDerWaalsContact OG1-CG 3.31Å; T488-D494 PolarHBondContact OG1-OD1 3.2Å
489G80.3Confident80.4Confident71 Ų7164.9 Ų64.973%0.73236%0.361SS*.SBendtrans84.3-6.3-171.400000113S487S487-G489 PolarHBondContact O-N 2.61Å
490W87.9Confident80.8Confident192 Ų19265.3 Ų65.373%0.72736%0.364SS*.  trans-118.693-179.2-78.256000110.4T488 P492 L493 D494T488-W490 PolarHBondContact OG1-N 3.29Å; W490-P492 VanDerWaalsContact C-N 3.31Å; W490-P492 VanDerWaalsContact O-N 3.11Å; W490-L493 HydrophobicContact CB-CB 3.97Å; W490-L493 WeakPolarHBondContact O-CB 3.48Å; W490-L493 PolarHBondContact O-N 3.03Å; W490-D494 PolarHBondContact O-N 2.89Å; W490-D494 VanDerWaalsContact O-N 3.1Å
491S85.7Confident81.5Confident62 Ų6262 Ų6243%0.43436%0.355SS..Hα-helixtrans-51.8-36.7-175.670.10000115.6D494 V495S491-D494 PolarHBondContact O-N 3.45Å; S491-V495 WeakPolarHBondContact O-CG2 3.44Å; S491-V495 PolarHBondContact O-N 3.32Å; S491-V495 VanDerWaalsContact O-N 3.11Å
492P90.9Very high82.1Confident34 Ų3456.3 Ų56.322%0.22133%0.329CS..Hα-helixtrans-67.3-36.4176.2-21.537.2000112.6P322 A326 W490 V495 L496P322-P492 HydrophobicContact CB-CB 4.24Å; P322-P492 HydrophobicContact CB-CG 3.58Å; A326-P492 HydrophobicContact CB-CB 4.12Å; A326-P492 WeakPolarHBondContact CB-O 3.5Å; W490-P492 VanDerWaalsContact C-N 3.31Å; W490-P492 VanDerWaalsContact O-N 3.11Å; P492-V495 PolarHBondContact O-N 2.99Å; P492-L496 WeakPolarHBondContact O-CB 3.3Å; P492-L496 PolarHBondContact O-N 2.66Å
493L90.9Very high82.9Confident71 Ų7155.3 Ų55.337%0.37232%0.321SS..Hα-helixtrans-68.5-41.5178.7-176.963.2000110.7T488 W490 V495 L496 L497T488-L493 HydrophobicContact CG2-CD2 4.34Å; W490-L493 HydrophobicContact CB-CB 3.97Å; W490-L493 WeakPolarHBondContact O-CB 3.48Å; W490-L493 PolarHBondContact O-N 3.03Å; L493-V495 VanDerWaalsContact C-N 3.33Å; L493-V495 PolarHBondContact O-N 3.37Å; L493-L496 PolarHBondContact O-N 3.32Å; L493-L497 HydrophobicContact CD1-CD1 4.15Å; L493-L497 HydrophobicContact CD1-CG 4.17Å; L493-L497 HydrophobicContact CG-CD1 3.98Å; L493-L497 HydrophobicContact CG-CG 4.39Å; L493-L497 WeakPolarHBondContact O-CB 3.1Å; L493-L497 WeakPolarHBondContact O-CG 3.21Å; L493-L497 PolarHBondContact O-N 3.15Å
494D89.3Confident84.9Confident14 Ų1450.1 Ų50.18%0.07529%0.287CS..Hα-helixtrans-60.6-43.2175.7-62.8-32.1000111F486 T488 W490 S491 H498F486-D494 HydrophobicContact CB-CB 4.46Å; F486-D494 WeakPolarHBondContact CB-OD1 3.25Å; T488-D494 VanDerWaalsContact CB-OD1 3.31Å; T488-D494 WeakPolarHBondContact CB-OD1 3.27Å; T488-D494 VanDerWaalsContact CG2-OD1 3.26Å; T488-D494 WeakPolarHBondContact CG2-OD1 3.44Å; T488-D494 PolarHBondContact N-OD1 3.47Å; T488-D494 VanDerWaalsContact N-OD1 3.1Å; T488-D494 VanDerWaalsContact OG1-CG 3.31Å; T488-D494 PolarHBondContact OG1-OD1 3.2Å; W490-D494 PolarHBondContact O-N 2.89Å; W490-D494 VanDerWaalsContact O-N 3.1Å; S491-D494 PolarHBondContact O-N 3.45Å; D494-H498 WeakPolarHBondContact O-CB 3.44Å; D494-H498 PolarHBondContact O-N 3.25Å
495V89.9Confident86.8Confident0 Ų045.9 Ų45.90%026%0.261CS..Hα-helixtrans-61.7-47.1174172.70000111.2L125 R323 A326 A327 S491 P492 L493 S499L125-V495 HydrophobicContact CD1-CG1 4.41Å; R323-V495 HydrophobicContact CB-CG2 4.27Å; R323-V495 HydrophobicContact CG-CG2 4.17Å; A326-V495 HydrophobicContact CB-CB 4.28Å; A326-V495 HydrophobicContact CB-CG1 4.24Å; A327-V495 HydrophobicContact CB-CG1 3.94Å; S491-V495 WeakPolarHBondContact O-CG2 3.44Å; S491-V495 PolarHBondContact O-N 3.32Å; S491-V495 VanDerWaalsContact O-N 3.11Å; P492-V495 PolarHBondContact O-N 2.99Å; L493-V495 VanDerWaalsContact C-N 3.33Å; L493-V495 PolarHBondContact O-N 3.37Å; V495-S499 WeakPolarHBondContact O-CB 3.23Å; V495-S499 PolarHBondContact O-N 3.3Å; V495-S499 PolarHBondContact O-OG 2.86Å
496L93.3Very high88.2Confident40 Ų4044.7 Ų44.721%0.20925%0.253CS..Hα-helixtrans-59.8-52.6-178.4-179.167.5000111.2A326 I329 P492 L493 S499 L500A326-L496 HydrophobicContact CB-CB 3.98Å; A326-L496 VanDerWaalsContact O-CD1 3.3Å; A326-L496 WeakPolarHBondContact O-CD1 3.48Å; I329-L496 HydrophobicContact CB-CD1 3.97Å; I329-L496 HydrophobicContact CG2-CD1 3.83Å; P492-L496 WeakPolarHBondContact O-CB 3.3Å; P492-L496 PolarHBondContact O-N 2.66Å; L493-L496 PolarHBondContact O-N 3.32Å; L496-S499 PolarHBondContact O-N 2.94Å; L496-L500 HydrophobicContact CD1-CD1 4.04Å; L496-L500 HydrophobicContact CG-CD1 4.14Å; L496-L500 WeakPolarHBondContact O-CB 3.28Å; L496-L500 WeakPolarHBondContact O-CG 3.5Å; L496-L500 PolarHBondContact O-N 3.07Å
497L91.3Very high89.7Confident60 Ų6042 Ų4231%0.31424%0.242SC..Hα-helixtrans-65.1-49-177.6-69.6175.1000111.1F486 L493 S499 L500 L501F486-L497 HydrophobicContact CD2-CB 4.4Å; F486-L497 HydrophobicContact CE2-CB 4.39Å; L493-L497 HydrophobicContact CD1-CD1 4.15Å; L493-L497 HydrophobicContact CD1-CG 4.17Å; L493-L497 HydrophobicContact CG-CD1 3.98Å; L493-L497 HydrophobicContact CG-CG 4.39Å; L493-L497 WeakPolarHBondContact O-CB 3.1Å; L493-L497 WeakPolarHBondContact O-CG 3.21Å; L493-L497 PolarHBondContact O-N 3.15Å; L497-S499 VanDerWaalsContact C-N 3.32Å; L497-S499 PolarHBondContact O-N 3.22Å; L497-L500 PolarHBondContact O-N 3.3Å; L497-L501 WeakPolarHBondContact O-CB 3.48Å; L497-L501 WeakPolarHBondContact O-CG 3.45Å; L497-L501 PolarHBondContact O-N 3.1Å
498H90Very high90.9Very high15 Ų1536.8 Ų36.87%0.06921%0.206CC..Hα-helixtrans-63.1-40.8179.9-176-155.1000111.6V124 F479 L485 D494 T502V124-H498 HydrophobicContact CG1-CB 4.12Å; V124-H498 WeakPolarHBondContact CG1-ND1 3.19Å; F479-H498 AromaticContact CD1-CD2 3.82Å; L485-H498 HydrophobicContact CD2-CB 4.46Å; L485-H498 WeakPolarHBondContact CD2-ND1 3.49Å; D494-H498 WeakPolarHBondContact O-CB 3.44Å; D494-H498 PolarHBondContact O-N 3.25Å; H498-T502 PolarHBondContact CD2-OG1 3.42Å; H498-T502 WeakPolarHBondContact O-CB 3.09Å; H498-T502 PolarHBondContact O-N 3.3Å; H498-T502 VanDerWaalsContact O-N 3.15Å; H498-T502 PolarHBondContact O-OG1 3.39Å
499S91.4Very high91.6Very high0 Ų033.9 Ų33.90%019%0.189CC..Hα-helixtrans-62.5-51177.1-58.90000111V124 S330 V495 L496 L497 L501 T502 Q503V124-S499 WeakPolarHBondContact CG1-OG 3.48Å; S330-S499 WeakPolarHBondContact OG-CB 3.45Å; V495-S499 WeakPolarHBondContact O-CB 3.23Å; V495-S499 PolarHBondContact O-N 3.3Å; V495-S499 PolarHBondContact O-OG 2.86Å; L496-S499 PolarHBondContact O-N 2.94Å; L497-S499 VanDerWaalsContact C-N 3.32Å; L497-S499 PolarHBondContact O-N 3.22Å; S499-L501 PolarHBondContact O-N 3.29Å; S499-T502 PolarHBondContact O-N 3.48Å; S499-Q503 VanDerWaalsContact O-CG 3.23Å; S499-Q503 WeakPolarHBondContact O-CG 3.41Å
500L93.1Very high92.3Very high24 Ų2434 Ų3413%0.12617%0.172CC..Hα-helixtrans-63-42.9-179.3-75.2172.1000113.3S330 L333 L496 L497 T502 Q503 F506S330-L500 PolarHBondContact OG-N 2.79Å; L333-L500 HydrophobicContact CB-CD2 4.23Å; L333-L500 HydrophobicContact CD1-CD1 4.49Å; L333-L500 HydrophobicContact CD1-CD2 4.16Å; L496-L500 HydrophobicContact CD1-CD1 4.04Å; L496-L500 HydrophobicContact CG-CD1 4.14Å; L496-L500 WeakPolarHBondContact O-CB 3.28Å; L496-L500 WeakPolarHBondContact O-CG 3.5Å; L496-L500 PolarHBondContact O-N 3.07Å; L497-L500 PolarHBondContact O-N 3.3Å; L500-T502 PolarHBondContact O-N 3.21Å; L500-Q503 WeakPolarHBondContact O-CB 3.13Å; L500-Q503 PolarHBondContact O-N 3.24Å; L500-Q503 VanDerWaalsContact O-N 3.16Å; L500-F506 HydrophobicContact CB-CE1 4.39Å; L500-F506 HydrophobicContact CD2-CD1 4.09Å; L500-F506 HydrophobicContact CD2-CE1 3.84Å; L500-F506 HydrophobicContact CD2-CZ 4.06Å
501L91.8Very high92.7Very high46 Ų4625.8 Ų25.824%0.24114%0.144CC..Hα-helixtrans-75.5-9.1-178.6-60.6174.8000113.2L475 F479 F486 L497 S499 L507L475-L501 HydrophobicContact CD2-CB 4.32Å; L475-L501 HydrophobicContact CD2-CD2 3.93Å; F479-L501 HydrophobicContact CD2-CB 3.77Å; F479-L501 HydrophobicContact CE2-CB 3.41Å; F479-L501 VanDerWaalsContact CE2-CB 3.41Å; F479-L501 HydrophobicContact CE2-CD1 3.67Å; F479-L501 HydrophobicContact CE2-CG 4.14Å; F479-L501 HydrophobicContact CZ-CB 4.03Å; F479-L501 HydrophobicContact CZ-CD1 3.53Å; F479-L501 HydrophobicContact CZ-CG 4.44Å; F486-L501 HydrophobicContact CE2-CD1 3.93Å; F486-L501 HydrophobicContact CZ-CD1 4Å; L497-L501 WeakPolarHBondContact O-CB 3.48Å; L497-L501 WeakPolarHBondContact O-CG 3.45Å; L497-L501 PolarHBondContact O-N 3.1Å; S499-L501 PolarHBondContact O-N 3.29Å; L501-L507 HydrophobicContact CD2-CD2 4.11Å; L501-L507 WeakPolarHBondContact O-CD1 3.31Å
502T91.2Very high93.2Very high7 Ų722.8 Ų22.84%0.04312%0.124CC..THydrogen-bonded Turntrans-94-3.4172.2-50.40000112.1I120 P476 H498 S499 L500 P504I120-T502 HydrophobicContact CG2-CG2 3.68Å; P476-T502 HydrophobicContact CB-CG2 4.46Å; H498-T502 PolarHBondContact CD2-OG1 3.42Å; H498-T502 WeakPolarHBondContact O-CB 3.09Å; H498-T502 PolarHBondContact O-N 3.3Å; H498-T502 VanDerWaalsContact O-N 3.15Å; H498-T502 PolarHBondContact O-OG1 3.39Å; S499-T502 PolarHBondContact O-N 3.48Å; L500-T502 PolarHBondContact O-N 3.21Å; T502-P504 WeakPolarHBondContact O-CD 3.22Å
503Q93.1Very high93.4Very high1 Ų124.1 Ų24.11%0.00513%0.126CC..  trans-90.7103.4-178.8-65.6-77.6-9.500110.8E117 I120 S121 A334 S499 L500 I505 F506 L507E117-Q503 VanDerWaalsContact CA-OE1 3.28Å; E117-Q503 PolarHBondContact O-NE2 2.94Å; I120-Q503 HydrophobicContact CG2-CG 4.49Å; S121-Q503 PolarHBondContact OG-NE2 3.29Å; A334-Q503 HydrophobicContact CB-CB 4.16Å; A334-Q503 HydrophobicContact CB-CG 3.76Å; S499-Q503 VanDerWaalsContact O-CG 3.23Å; S499-Q503 WeakPolarHBondContact O-CG 3.41Å; L500-Q503 WeakPolarHBondContact O-CB 3.13Å; L500-Q503 PolarHBondContact O-N 3.24Å; L500-Q503 VanDerWaalsContact O-N 3.16Å; Q503-I505 PolarHBondContact O-N 2.64Å; Q503-F506 HydrophobicContact CB-CB 3.69Å; Q503-F506 PolarHBondContact O-N 3.29Å; Q503-L507 WeakPolarHBondContact O-CG 3.33Å; Q503-L507 PolarHBondContact O-N 3.36Å
504P94.9Very high93.6Very high11 Ų1125 Ų257%0.07113%0.13CC..Hα-helixtrans-66.2-43.1-172.926.6-34.3000112.3V211 A472 P476 T502 L507 A508V211-P504 HydrophobicContact CG1-CB 3.65Å; A472-P504 WeakPolarHBondContact CB-O 3.33Å; A472-P504 WeakPolarHBondContact O-CB 3.47Å; P476-P504 HydrophobicContact CG-CB 4.18Å; T502-P504 WeakPolarHBondContact O-CD 3.22Å; P504-L507 PolarHBondContact O-N 3.41Å; P504-A508 WeakPolarHBondContact O-CB 3.27Å; P504-A508 PolarHBondContact O-N 3.03Å
505I95.1Very high93.9Very high12 Ų1225.7 Ų25.76%0.06213%0.134CC..Hα-helixtrans-68-41.5-177.7-59.9166.7000110.9E117 A212 F387 Q503 A508 G509E117-I505 VanDerWaalsContact OE1-CD1 3.29Å; E117-I505 WeakPolarHBondContact OE1-CD1 3.36Å; A212-I505 HydrophobicContact CB-CD1 3.7Å; A212-I505 HydrophobicContact CB-CG1 3.88Å; F387-I505 HydrophobicContact CD2-CD1 4.33Å; F387-I505 HydrophobicContact CE2-CD1 4.01Å; Q503-I505 PolarHBondContact O-N 2.64Å; I505-A508 PolarHBondContact O-N 2.99Å; I505-G509 PolarHBondContact O-N 3.28Å
506F95.9Very high94.1Very high27 Ų2725.8 Ų25.812%0.11814%0.135CC..Hα-helixtrans-60.7-45.3174.7177.3-101.1000111.3L333 A334 L500 Q503 G509 L510L333-F506 HydrophobicContact CB-CD2 4.37Å; L333-F506 HydrophobicContact CB-CE2 3.96Å; A334-F506 HydrophobicContact CB-CB 4.22Å; L500-F506 HydrophobicContact CB-CE1 4.39Å; L500-F506 HydrophobicContact CD2-CD1 4.09Å; L500-F506 HydrophobicContact CD2-CE1 3.84Å; L500-F506 HydrophobicContact CD2-CZ 4.06Å; Q503-F506 HydrophobicContact CB-CB 3.69Å; Q503-F506 PolarHBondContact O-N 3.29Å; F506-G509 PolarHBondContact O-N 3.41Å; F506-L510 HydrophobicContact CE1-CB 4.5Å; F506-L510 HydrophobicContact CE1-CD2 3.81Å; F506-L510 HydrophobicContact CZ-CD2 3.99Å; F506-L510 VanDerWaalsContact O-CB 3.24Å; F506-L510 WeakPolarHBondContact O-CB 3.36Å; F506-L510 PolarHBondContact O-N 2.95Å
507L96.3Very high94Very high20 Ų2027 Ų2711%0.10514%0.141CC..Hα-helixtrans-63.5-42.1177.8-75.1175.1000112.6A472 L475 P476 L501 Q503 P504 L510 S511A472-L507 HydrophobicContact CB-CB 4.05Å; L475-L507 HydrophobicContact CB-CD1 4.08Å; L475-L507 HydrophobicContact CD2-CD1 3.99Å; L475-L507 HydrophobicContact CD2-CD2 4.2Å; L475-L507 HydrophobicContact CG-CD1 4.4Å; P476-L507 HydrophobicContact CG-CD1 3.7Å; L501-L507 HydrophobicContact CD2-CD2 4.11Å; L501-L507 WeakPolarHBondContact O-CD1 3.31Å; Q503-L507 WeakPolarHBondContact O-CG 3.33Å; Q503-L507 PolarHBondContact O-N 3.36Å; P504-L507 PolarHBondContact O-N 3.41Å; L507-L510 PolarHBondContact O-N 3.48Å; L507-S511 VanDerWaalsContact O-CB 3.28Å; L507-S511 WeakPolarHBondContact O-CB 3.4Å; L507-S511 PolarHBondContact O-N 3.3Å; L507-S511 PolarHBondContact O-OG 2.99Å
508A96.9Very high94.1Very high0 Ų029 Ų290%016%0.156CC..Hα-helixtrans-61.9-46176.600000111.2V211 A472 P504 I505 S511 G512V211-A508 HydrophobicContact CB-CB 3.9Å; V211-A508 HydrophobicContact CG1-CB 4.17Å; V211-A508 HydrophobicContact CG2-CB 3.85Å; A472-A508 HydrophobicContact CB-CB 3.69Å; P504-A508 WeakPolarHBondContact O-CB 3.27Å; P504-A508 PolarHBondContact O-N 3.03Å; I505-A508 PolarHBondContact O-N 2.99Å; A508-S511 PolarHBondContact O-OG 3.45Å; A508-G512 PolarHBondContact O-N 3.45Å
509G94.9Very high94.3Very high5 Ų530.3 Ų30.35%0.05216%0.163CC..Hα-helixtrans-65.8-43.8177.700000112.7V204 S208 I505 F506 F513V204-G509 WeakPolarHBondContact CG1-O 3.48Å; S208-G509 WeakPolarHBondContact OG-CA 3.46Å; S208-G509 PolarHBondContact OG-N 3.19Å; I505-G509 PolarHBondContact O-N 3.28Å; F506-G509 PolarHBondContact O-N 3.41Å; G509-F513 WeakPolarHBondContact O-CB 3.49Å; G509-F513 PolarHBondContact O-N 2.83Å
510L95.5Very high94.4Very high72 Ų7235.8 Ų35.838%0.37720%0.199SC..Hα-helixtrans-67.9-48.4-179.9-179.164.3000111.9F506 L507 F513 L514F506-L510 HydrophobicContact CE1-CB 4.5Å; F506-L510 HydrophobicContact CE1-CD2 3.81Å; F506-L510 HydrophobicContact CZ-CD2 3.99Å; F506-L510 VanDerWaalsContact O-CB 3.24Å; F506-L510 WeakPolarHBondContact O-CB 3.36Å; F506-L510 PolarHBondContact O-N 2.95Å; L507-L510 PolarHBondContact O-N 3.48Å; L510-F513 PolarHBondContact O-N 3.1Å; L510-L514 HydrophobicContact CD1-CD1 4.09Å; L510-L514 HydrophobicContact CD1-CG 4.23Å; L510-L514 HydrophobicContact CG-CD1 4.08Å; L510-L514 WeakPolarHBondContact O-CB 3.35Å; L510-L514 VanDerWaalsContact O-CG 3.28Å; L510-L514 WeakPolarHBondContact O-CG 3.39Å; L510-L514 PolarHBondContact O-N 3.23Å
511S96.4Very high94.1Very high20 Ų2036 Ų3614%0.1421%0.207CC..Hα-helixtrans-64.1-45.7178.2560000111.5S468 L507 A508 F513 L514 L515S468-S511 WeakPolarHBondContact CA-OG 3.35Å; S468-S511 WeakPolarHBondContact CB-OG 3.5Å; S468-S511 PolarHBondContact OG-OG 2.94Å; L507-S511 VanDerWaalsContact O-CB 3.28Å; L507-S511 WeakPolarHBondContact O-CB 3.4Å; L507-S511 PolarHBondContact O-N 3.3Å; L507-S511 PolarHBondContact O-OG 2.99Å; A508-S511 PolarHBondContact O-OG 3.45Å; S511-F513 PolarHBondContact O-N 2.86Å; S511-L514 PolarHBondContact O-N 2.87Å; S511-L515 WeakPolarHBondContact O-CB 3.36Å; S511-L515 WeakPolarHBondContact O-CG 3.4Å; S511-L515 PolarHBondContact O-N 3.47Å
512G95.5Very high93.9Very high0 Ų038 Ų380%022%0.221CC..Hα-helixtrans-58.1-48174.100000111.5S468 A508 L514 L515 E516S468-G512 WeakPolarHBondContact OG-CA 3.47Å; S468-G512 PolarHBondContact OG-N 2.93Å; A508-G512 PolarHBondContact O-N 3.45Å; G512-L514 PolarHBondContact O-N 2.82Å; G512-L515 PolarHBondContact O-N 2.92Å; G512-E516 WeakPolarHBondContact O-CB 3.35Å; G512-E516 PolarHBondContact O-N 3.26Å
513F94.9Very high93.7Very high61 Ų6143.1 Ų43.127%0.26825%0.245SC..Hα-helixtrans-60.7-47.2179.1178.7-93.1000112.8V196 H199 V204 G509 L510 S511 N517V196-F513 HydrophobicContact CG1-CE2 4.18Å; H199-F513 HydrophobicContact CB-CE2 3.89Å; V204-F513 HydrophobicContact CG1-CB 4.05Å; V204-F513 HydrophobicContact CG2-CB 4.35Å; G509-F513 WeakPolarHBondContact O-CB 3.49Å; G509-F513 PolarHBondContact O-N 2.83Å; L510-F513 PolarHBondContact O-N 3.1Å; S511-F513 PolarHBondContact O-N 2.86Å; F513-N517 WeakPolarHBondContact CE2-ND2 3.43Å; F513-N517 WeakPolarHBondContact O-CB 3.38Å; F513-N517 PolarHBondContact O-N 2.87Å; F513-N517 PolarHBondContact O-ND2 3.37Å
514L95.7Very high93.3Very high89 Ų8948.1 Ų48.147%0.46627%0.271SS..Hα-helixtrans-64-49179.9-71.9173.7000110.9L510 S511 G512 N517 T518L510-L514 HydrophobicContact CD1-CD1 4.09Å; L510-L514 HydrophobicContact CD1-CG 4.23Å; L510-L514 HydrophobicContact CG-CD1 4.08Å; L510-L514 WeakPolarHBondContact O-CB 3.35Å; L510-L514 VanDerWaalsContact O-CG 3.28Å; L510-L514 WeakPolarHBondContact O-CG 3.39Å; L510-L514 PolarHBondContact O-N 3.23Å; S511-L514 PolarHBondContact O-N 2.87Å; G512-L514 PolarHBondContact O-N 2.82Å; L514-N517 PolarHBondContact O-N 3.23Å; L514-T518 VanDerWaalsContact O-CB 3.28Å; L514-T518 WeakPolarHBondContact O-CB 3.11Å; L514-T518 WeakPolarHBondContact O-CG2 3.31Å; L514-T518 PolarHBondContact O-N 3.49Å; L514-T518 PolarHBondContact O-OG1 2.98Å
515L95.6Very high92.9Very high30 Ų3049.2 Ų49.216%0.15728%0.275CS..Hα-helixtrans-67.3-39.6-177.7-64.8172.2000111.8I464 F467 S511 G512 N517 T518 I519I464-L515 HydrophobicContact CG1-CB 3.99Å; I464-L515 HydrophobicContact CG2-CB 4.17Å; F467-L515 HydrophobicContact CB-CD1 4.4Å; F467-L515 HydrophobicContact CD1-CD1 3.55Å; F467-L515 HydrophobicContact CE1-CD1 4.2Å; F467-L515 HydrophobicContact CG-CD1 4.3Å; S511-L515 WeakPolarHBondContact O-CB 3.36Å; S511-L515 WeakPolarHBondContact O-CG 3.4Å; S511-L515 PolarHBondContact O-N 3.47Å; G512-L515 PolarHBondContact O-N 2.92Å; L515-N517 VanDerWaalsContact C-N 3.32Å; L515-N517 PolarHBondContact O-N 3.14Å; L515-T518 PolarHBondContact O-N 2.84Å; L515-I519 HydrophobicContact CB-CD1 4.09Å; L515-I519 HydrophobicContact CD2-CD1 4.07Å; L515-I519 VanDerWaalsContact O-CB 3.28Å; L515-I519 WeakPolarHBondContact O-CB 3.25Å; L515-I519 VanDerWaalsContact O-CG1 3.28Å; L515-I519 WeakPolarHBondContact O-CG1 3.38Å; L515-I519 PolarHBondContact O-N 3.47Å
516E93.3Very high92.5Very high2 Ų250.4 Ų50.41%0.00928%0.279CS..Hα-helixtrans-60.4-42.4177.8-174.855.8-146.100112.3L203 V204 R460 I464 G512 R526L203-E516 HydrophobicContact CB-CG 4.48Å; L203-E516 WeakPolarHBondContact CB-OE2 3.14Å; L203-E516 WeakPolarHBondContact CD1-OE2 3.25Å; V204-E516 HydrophobicContact CG2-CB 3.97Å; V204-E516 HydrophobicContact CG2-CG 4.16Å; R460-E516 IonicContact CZ-OE1 3.9Å; R460-E516 IonicContact CZ-OE2 2.83Å; R460-E516 IonicContact NH1-OE1 3.1Å; R460-E516 PolarHBondContact NH1-OE1 3.39Å; R460-E516 IonicContact NH1-OE2 3.61Å; R460-E516 PolarHBondContact NH2-O 3.49Å; R460-E516 IonicContact NH2-OE1 3.81Å; R460-E516 PolarHBondContact NH2-OE1 2.93Å; R460-E516 IonicContact NH2-OE2 3.71Å; R460-E516 PolarHBondContact NH2-OE2 2.81Å; I464-E516 WeakPolarHBondContact CD1-OE2 3.38Å; G512-E516 WeakPolarHBondContact O-CB 3.35Å; G512-E516 PolarHBondContact O-N 3.26Å; E516-R526 PolarHBondContact O-NH2 2.89Å; E516-R526 WeakPolarHBondContact OE1-CB 3.44Å; E516-R526 WeakPolarHBondContact OE1-CD 3.44Å; E516-R526 WeakPolarHBondContact OE1-CG 3.4Å; E516-R526 IonicContact OE1-NE 3.71Å
517N91.9Very high91.9Very high64 Ų6449.7 Ų49.734%0.34228%0.279SS..Hα-helixtrans-85.6-23.9-177-72.2-76.5000113.6F513 L514 L515F513-N517 WeakPolarHBondContact CE2-ND2 3.43Å; F513-N517 WeakPolarHBondContact O-CB 3.38Å; F513-N517 PolarHBondContact O-N 2.87Å; F513-N517 PolarHBondContact O-ND2 3.37Å; L514-N517 PolarHBondContact O-N 3.23Å; L515-N517 VanDerWaalsContact C-N 3.32Å; L515-N517 PolarHBondContact O-N 3.14Å
518T93.6Very high91Very high102 Ų10252 Ų5263%0.62629%0.291SS*.Hα-helixtrans-92.8-30.3-179.656.10000113.6L514 L515L514-T518 VanDerWaalsContact O-CB 3.28Å; L514-T518 WeakPolarHBondContact O-CB 3.11Å; L514-T518 WeakPolarHBondContact O-CG2 3.31Å; L514-T518 PolarHBondContact O-N 3.49Å; L514-T518 PolarHBondContact O-OG1 2.98Å; L515-T518 PolarHBondContact O-N 2.84Å
519I94.1Very high89.1Confident44 Ų4454.4 Ų54.423%0.22632%0.316CS..SBendtrans-85.4123.3179.6-57.7173.4000109.7R460 F463 I464 L515 R526R460-I519 HydrophobicContact CG-CG2 3.76Å; R460-I519 PolarHBondContact NE-O 3.46Å; R460-I519 PolarHBondContact NH2-O 2.78Å; F463-I519 HydrophobicContact CD1-CD1 4.24Å; I464-I519 HydrophobicContact CD1-CD1 4.25Å; I464-I519 HydrophobicContact CG1-CD1 3.88Å; L515-I519 HydrophobicContact CB-CD1 4.09Å; L515-I519 HydrophobicContact CD2-CD1 4.07Å; L515-I519 VanDerWaalsContact O-CB 3.28Å; L515-I519 WeakPolarHBondContact O-CB 3.25Å; L515-I519 VanDerWaalsContact O-CG1 3.28Å; L515-I519 WeakPolarHBondContact O-CG1 3.38Å; L515-I519 PolarHBondContact O-N 3.47Å; I519-R526 PolarHBondContact O-NH2 2.66Å; I519-R526 VanDerWaalsContact O-NH2 3.14Å
520P91.9Very high86.8Confident114 Ų11459.3 Ų59.374%0.7434%0.337SS*.  trans-61.6138.6-179.226.5-34.8000110.9R460R460-P520 WeakPolarHBondContact CD-O 3.1Å; R460-P520 PolarHBondContact NE-O 2.78Å
521G87.4Confident84.4Confident29 Ų2959.1 Ų59.130%0.29935%0.352SS..  trans-174.2156.9179.400000111E525 R526G521-E525 VanDerWaalsContact CA-OE2 3.31Å; G521-E525 WeakPolarHBondContact CA-OE2 3.44Å; G521-R526 PolarHBondContact O-NE 3.42Å
522T88.8Confident81.5Confident88 Ų8861.8 Ų61.854%0.5437%0.365SS..  trans-80.8153.7-175.767.40000112.2L524 E525 R526T522-L524 PolarHBondContact O-N 3.28Å; T522-L524 VanDerWaalsContact O-N 3.16Å; T522-E525 PolarHBondContact N-OE2 3.19Å; T522-E525 VanDerWaalsContact N-OE2 3.11Å; T522-E525 WeakPolarHBondContact O-CB 3.44Å; T522-E525 PolarHBondContact O-N 3.48Å; T522-E525 VanDerWaalsContact O-N 3.14Å; T522-E525 VanDerWaalsContact OG1-CB 3.25Å; T522-E525 WeakPolarHBondContact OG1-CB 3.35Å; T522-E525 PolarHBondContact OG1-N 3.44Å; T522-R526 WeakPolarHBondContact O-CG 3.14Å; T522-R526 PolarHBondContact O-N 2.72Å
523Q85.7Confident78.4Confident115 Ų11562.8 Ų62.854%0.53737%0.371SS..THydrogen-bonded Turntrans-56.6-33.3178.7-70.2-73.54.900113.3G527 L528 G529Q523-G527 PolarHBondContact O-N 2.89Å; Q523-L528 PolarHBondContact O-N 2.92Å; Q523-G529 PolarHBondContact O-N 3.22Å
524L84.3Confident75.3Confident105 Ų10564.5 Ų64.555%0.5539%0.391SS..THydrogen-bonded Turntrans-70.2-47.7176.4-70.4175000111.6T522 R526 G527 Q530T522-L524 PolarHBondContact O-N 3.28Å; T522-L524 VanDerWaalsContact O-N 3.16Å; L524-R526 PolarHBondContact O-N 3.01Å; L524-G527 PolarHBondContact O-N 3.41Å; L524-Q530 HydrophobicContact CD2-CG 3.91Å
525E86.9Confident72Confident34 Ų3466 Ų6616%0.15940%0.403CS..THydrogen-bonded Turntrans-57.1-37.3176.1-178.8-174.1-173.600111.5D455 S458 N461 G521 T522 G527D455-E525 HydrophobicContact CB-CG 4.39Å; D455-E525 PolarHBondContact N-O 3.41Å; D455-E525 VanDerWaalsContact N-O 3.15Å; S458-E525 VanDerWaalsContact CB-OE1 3.28Å; S458-E525 WeakPolarHBondContact CB-OE1 3.44Å; S458-E525 PolarHBondContact OG-OE1 3.11Å; N461-E525 PolarHBondContact ND2-O 3.3Å; G521-E525 VanDerWaalsContact CA-OE2 3.31Å; G521-E525 WeakPolarHBondContact CA-OE2 3.44Å; T522-E525 PolarHBondContact N-OE2 3.19Å; T522-E525 VanDerWaalsContact N-OE2 3.11Å; T522-E525 WeakPolarHBondContact O-CB 3.44Å; T522-E525 PolarHBondContact O-N 3.48Å; T522-E525 VanDerWaalsContact O-N 3.14Å; T522-E525 VanDerWaalsContact OG1-CB 3.25Å; T522-E525 WeakPolarHBondContact OG1-CB 3.35Å; T522-E525 PolarHBondContact OG1-N 3.44Å; E525-G527 VanDerWaalsContact C-N 3.28Å; E525-G527 PolarHBondContact O-N 3.48Å
526R86.1Confident68.9Low38 Ų3870 Ų7014%0.14342%0.42CS..THydrogen-bonded Turntrans-72.9-16.6177.3-62-177.4-179.3-158.4-8.5114.2P202 R460 E516 I519 G521 T522 L524 L528P202-R526 WeakPolarHBondContact CD-O 3.3Å; R460-R526 VanDerWaalsContact NH2-NE 3.17Å; E516-R526 PolarHBondContact O-NH2 2.89Å; E516-R526 WeakPolarHBondContact OE1-CB 3.44Å; E516-R526 WeakPolarHBondContact OE1-CD 3.44Å; E516-R526 WeakPolarHBondContact OE1-CG 3.4Å; E516-R526 IonicContact OE1-NE 3.71Å; I519-R526 PolarHBondContact O-NH2 2.66Å; I519-R526 VanDerWaalsContact O-NH2 3.14Å; G521-R526 PolarHBondContact O-NE 3.42Å; T522-R526 WeakPolarHBondContact O-CG 3.14Å; T522-R526 PolarHBondContact O-N 2.72Å; L524-R526 PolarHBondContact O-N 3.01Å; R526-L528 HydrophobicContact CB-CB 4.35Å; R526-L528 HydrophobicContact CB-CD1 3.88Å; R526-L528 HydrophobicContact CB-CG 3.9Å
527G83.2Confident65.7Low11 Ų1172.8 Ų72.811%0.11344%0.437CS..THydrogen-bonded Turntrans73.725.4-171.500000114.3L453 Q523 L524 E525L453-G527 WeakPolarHBondContact O-CA 3.39Å; Q523-G527 PolarHBondContact O-N 2.89Å; L524-G527 PolarHBondContact O-N 3.41Å; E525-G527 VanDerWaalsContact C-N 3.28Å; E525-G527 PolarHBondContact O-N 3.48Å
528L79.3Confident62.7Low70 Ų7073 Ų7337%0.36645%0.447SS..  trans-101-12.3-178.7-69.9175.7000113.1Q523 R526Q523-L528 PolarHBondContact O-N 2.92Å; R526-L528 HydrophobicContact CB-CB 4.35Å; R526-L528 HydrophobicContact CB-CD1 3.88Å; R526-L528 HydrophobicContact CB-CG 3.9Å
529G56.6Low59.6Low50 Ų5074.6 Ų74.652%0.51545%0.448SS..SBendtrans-102.7-7.9-179.500000115.9Q523Q523-G529 PolarHBondContact O-N 3.22Å
530Q46.3Very low56.6Low108 Ų10877.8 Ų77.851%0.50546%0.461SS..  trans-106.1111.1-178.2-73.1-176.7-3.500110.3L524L524-Q530 HydrophobicContact CD2-CG 3.91Å
531G44.9Very low53.6Low67 Ų6776.9 Ų76.969%0.69146%0.464SS*.SBendtrans-53.8143.8141.400000107.9
532L35.1Very low50.8Low77 Ų7785.9 Ų85.940%0.40349%0.489SS..SBendtrans-21137.9-174.3-119.872.3000115.7F536 T537L532-F536 HydrophobicContact CB-CB 4.22Å; L532-F536 HydrophobicContact CD2-CB 3.82Å; L532-F536 HydrophobicContact CD2-CD1 4.21Å; L532-F536 HydrophobicContact CD2-CD2 3.94Å; L532-F536 HydrophobicContact CD2-CG 3.73Å; L532-T537 WeakPolarHBondContact O-CG2 3.11Å
533P31.5Very low48Very low21 Ų2186.7 Ų86.714%0.13649%0.488CS..  trans-56.4156.7-174.616.6-27.6000114.6Y452 V535 F536Y452-P533 HydrophobicContact CD1-CG 4.09Å; Y452-P533 HydrophobicContact CE1-CB 4.29Å; Y452-P533 HydrophobicContact CE1-CG 3.31Å; P533-V535 PolarHBondContact O-N 2.94Å; P533-F536 PolarHBondContact O-N 2.96Å
534S28.6Very low45.4Very low97 Ų9785.4 Ų85.468%0.67849%0.489SS*.Hα-helixtrans-57-4.9-162.354.90000118.7F536 T537S534-F536 VanDerWaalsContact C-N 3.35Å; S534-T537 VanDerWaalsContact CA-OG1 3.27Å; S534-T537 WeakPolarHBondContact CA-OG1 3.13Å; S534-T537 PolarHBondContact O-OG1 3.49Å
535V26.5Very low43.1Very low121 Ų12187.8 Ų87.873%0.73350%0.497SS*.Hα-helixtrans-80-23.2170-177.80000111.1P533P533-V535 PolarHBondContact O-N 2.94Å
536F30.9Very low40.5Very low114 Ų11493.4 Ų93.450%0.552%0.521SS..Hα-helixtrans-98.1-20.8175.4-71.8-82.9000113.4L532 P533 S534 A538 Q539 E540L532-F536 HydrophobicContact CB-CB 4.22Å; L532-F536 HydrophobicContact CD2-CB 3.82Å; L532-F536 HydrophobicContact CD2-CD1 4.21Å; L532-F536 HydrophobicContact CD2-CD2 3.94Å; L532-F536 HydrophobicContact CD2-CG 3.73Å; P533-F536 PolarHBondContact O-N 2.96Å; S534-F536 VanDerWaalsContact C-N 3.35Å; F536-A538 VanDerWaalsContact C-N 3.27Å; F536-A538 PolarHBondContact O-N 3.23Å; F536-Q539 WeakPolarHBondContact O-CA 3.43Å; F536-Q539 VanDerWaalsContact O-CB 3.3Å; F536-Q539 WeakPolarHBondContact O-CB 3.18Å; F536-Q539 PolarHBondContact O-N 3.12Å; F536-E540 PolarHBondContact O-N 3.13Å
537T26.9Very low38Very low60 Ų6093.2 Ų93.237%0.36853%0.525SS..Hα-helixtrans-69.6-21.2176.358.90000113.5L532 S534 Q539 E540 A541L532-T537 WeakPolarHBondContact O-CG2 3.11Å; S534-T537 VanDerWaalsContact CA-OG1 3.27Å; S534-T537 WeakPolarHBondContact CA-OG1 3.13Å; S534-T537 PolarHBondContact O-OG1 3.49Å; T537-Q539 PolarHBondContact O-N 3.15Å; T537-E540 PolarHBondContact O-N 3.48Å; T537-A541 WeakPolarHBondContact O-CB 3.45Å; T537-A541 PolarHBondContact O-N 2.94Å
538A28.8Very low35.8Very low68 Ų68103 Ų10356%0.56256%0.559SS**Hα-helixtrans-66.9-25.316900000112.5F536F536-A538 VanDerWaalsContact C-N 3.27Å; F536-A538 PolarHBondContact O-N 3.23Å
539Q28.4Very low34Very low136 Ų136105.7 Ų105.764%0.63657%0.569SS**Hα-helixtrans-86-37.9172.6-16287.9-6.700110.8F536 T537 R542 M543F536-Q539 WeakPolarHBondContact O-CA 3.43Å; F536-Q539 VanDerWaalsContact O-CB 3.3Å; F536-Q539 WeakPolarHBondContact O-CB 3.18Å; F536-Q539 PolarHBondContact O-N 3.12Å; T537-Q539 PolarHBondContact O-N 3.15Å; Q539-R542 CarbonylContact O-C 3.47Å; Q539-R542 PolarHBondContact O-N 3.46Å; Q539-M543 VanDerWaalsContact O-CG 3.28Å; Q539-M543 WeakPolarHBondContact O-CG 3.44Å; Q539-M543 PolarHBondContact O-N 2.81Å; Q539-M543 VanDerWaalsContact O-N 3.07Å
540E29.8Very low33.5Very low110 Ų110110 Ų11051%0.51457%0.574SS.*Hα-helixtrans-77.3-35.1-176.2-147.8132.2-158.600113.1F536 T537 R542 M543F536-E540 PolarHBondContact O-N 3.13Å; T537-E540 PolarHBondContact O-N 3.48Å; E540-R542 PolarHBondContact O-N 3.24Å; E540-M543 WeakPolarHBondContact O-CB 3.42Å; E540-M543 PolarHBondContact O-N 3.35Å
541A30.1Very low33.3Very low96 Ų96106 Ų10679%0.79356%0.56SS**THydrogen-bonded Turntrans-71.7-13168.800000112.9T537T537-A541 WeakPolarHBondContact O-CB 3.45Å; T537-A541 PolarHBondContact O-N 2.94Å
542R28.1Very low33.6Very low217 Ų217105.2 Ų105.282%0.81955%0.547SS*.THydrogen-bonded Turntrans-99.6-2.3170.5-82.6-172.1-172.8-179.54.5113.5Q539 E540 P544Q539-R542 CarbonylContact O-C 3.47Å; Q539-R542 PolarHBondContact O-N 3.46Å; E540-R542 PolarHBondContact O-N 3.24Å; R542-P544 VanDerWaalsContact O-CD 3.31Å; R542-P544 WeakPolarHBondContact O-CD 3.33Å
543M28.9Very low34.9Very low106 Ų106106.9 Ų106.952%0.52255%0.552SS.*SBendtrans-77.8120.2177.6-81.7-97.3-103.100109.1Q539 E540 P547Q539-M543 VanDerWaalsContact O-CG 3.28Å; Q539-M543 WeakPolarHBondContact O-CG 3.44Å; Q539-M543 PolarHBondContact O-N 2.81Å; Q539-M543 VanDerWaalsContact O-N 3.07Å; E540-M543 WeakPolarHBondContact O-CB 3.42Å; E540-M543 PolarHBondContact O-N 3.35Å; M543-P547 HydrophobicContact CB-CG 4.06Å; M543-P547 HydrophobicContact CE-CB 3.83Å; M543-P547 HydrophobicContact CE-CG 4.26Å; M543-P547 HydrophobicContact CG-CG 4.43Å; M543-P547 HydrophobicContact SD-CB 3.67Å; M543-P547 HydrophobicContact SD-CG 3.5Å; M543-P547 VanDerWaalsContact SD-CG 3.5Å
544P32.2Very low37Very low87 Ų87107.4 Ų107.457%0.56556%0.555SS**  trans-59.9163174.817-24000111.3R542 K546 P547R542-P544 VanDerWaalsContact O-CD 3.31Å; R542-P544 WeakPolarHBondContact O-CD 3.33Å; P544-K546 PolarHBondContact O-N 2.9Å; P544-K546 VanDerWaalsContact O-N 3.08Å; P544-P547 HydrophobicContact CG-CG 4.09Å; P544-P547 WeakPolarHBondContact O-CD 3.48Å; P544-P547 WeakPolarHBondContact O-CG 3.42Å
545Q36.7Very low39.4Very low155 Ų155103.1 Ų103.172%0.72452%0.524SS*.Hα-helixtrans-55.8-28.1176.2-75.2175-25.500113.2R548 E549Q545-R548 WeakPolarHBondContact O-CB 3.45Å; Q545-R548 PolarHBondContact O-N 3.46Å; Q545-R548 VanDerWaalsContact O-N 3.13Å; Q545-E549 PolarHBondContact O-N 3.44Å; Q545-E549 VanDerWaalsContact O-N 3.16Å
546K30.9Very low41.8Very low152 Ų152102.9 Ų102.966%0.66151%0.51SS*.Hα-helixtrans-54.5-48.2179.3-103.5176.1175.9170.70115.7P544 R548 E549 K550P544-K546 PolarHBondContact O-N 2.9Å; P544-K546 VanDerWaalsContact O-N 3.08Å; K546-R548 VanDerWaalsContact C-N 3.34Å; K546-E549 PolarHBondContact O-N 2.91Å; K546-K550 WeakPolarHBondContact O-CG 3.47Å; K546-K550 PolarHBondContact O-N 3.37Å
547P33.9Very low44Very low34 Ų3497.8 Ų97.822%0.22149%0.488CS..Hα-helixtrans-64.8-30.4174.413-28.1000114.3M543 P544 K550 A551M543-P547 HydrophobicContact CB-CG 4.06Å; M543-P547 HydrophobicContact CE-CB 3.83Å; M543-P547 HydrophobicContact CE-CG 4.26Å; M543-P547 HydrophobicContact CG-CG 4.43Å; M543-P547 HydrophobicContact SD-CB 3.67Å; M543-P547 HydrophobicContact SD-CG 3.5Å; M543-P547 VanDerWaalsContact SD-CG 3.5Å; P544-P547 HydrophobicContact CG-CG 4.09Å; P544-P547 WeakPolarHBondContact O-CD 3.48Å; P544-P547 WeakPolarHBondContact O-CG 3.42Å; P547-K550 PolarHBondContact O-N 3.2Å; P547-A551 WeakPolarHBondContact O-CB 3.48Å; P547-A551 PolarHBondContact O-N 3.02Å
548R36.6Very low46.2Very low217 Ų21795.8 Ų95.882%0.81948%0.476SS*.Hα-helixtrans-67.9-40.7175.5-161.7174.9-178.7-178.7-1.7111.5Q545 K546 A551 A552Q545-R548 WeakPolarHBondContact O-CB 3.45Å; Q545-R548 PolarHBondContact O-N 3.46Å; Q545-R548 VanDerWaalsContact O-N 3.13Å; K546-R548 VanDerWaalsContact C-N 3.34Å; R548-A551 PolarHBondContact O-N 3.08Å; R548-A552 PolarHBondContact O-N 3.37Å; R548-A552 VanDerWaalsContact O-N 3.16Å
549E43Very low47.7Very low126 Ų126100.2 Ų100.259%0.58948%0.483SS*.Hα-helixtrans-64.7-41171.3-68.2179.7146.800112.7Q545 K546 A551 A552 Q553Q545-E549 PolarHBondContact O-N 3.44Å; Q545-E549 VanDerWaalsContact O-N 3.16Å; K546-E549 PolarHBondContact O-N 2.91Å; E549-A551 VanDerWaalsContact C-N 3.3Å; E549-A551 PolarHBondContact O-N 2.88Å; E549-A552 PolarHBondContact O-N 3.44Å; E549-Q553 PolarHBondContact O-N 3Å
550K44.4Very low49.3Very low140 Ų14098.1 Ų98.161%0.60948%0.481SS*.Hα-helixtrans-62.9-35.4174.5-78.7-179.4176.8-177.20112.5K546 P547 Q553K546-K550 WeakPolarHBondContact O-CG 3.47Å; K546-K550 PolarHBondContact O-N 3.37Å; P547-K550 PolarHBondContact O-N 3.2Å; K550-Q553 WeakPolarHBondContact O-CB 3.49Å; K550-Q553 PolarHBondContact O-N 3.43Å
551A42.6Very low51Low26 Ų2694.3 Ų94.322%0.21546%0.464CS..Hα-helixtrans-70.5-39.1178.600000112.1P353 P547 R548 E549 Q553 V554P353-A551 HydrophobicContact CG-CB 3.79Å; P547-A551 WeakPolarHBondContact O-CB 3.48Å; P547-A551 PolarHBondContact O-N 3.02Å; R548-A551 PolarHBondContact O-N 3.08Å; E549-A551 VanDerWaalsContact C-N 3.3Å; E549-A551 PolarHBondContact O-N 2.88Å; A551-Q553 PolarHBondContact O-N 2.91Å; A551-V554 PolarHBondContact O-N 2.74Å
552A51.1Low52.5Low50 Ų5092.5 Ų92.541%0.41344%0.439SS..Hα-helixtrans-65.6-27.2169.600000112.6R548 E549 V554R548-A552 PolarHBondContact O-N 3.37Å; R548-A552 VanDerWaalsContact O-N 3.16Å; E549-A552 PolarHBondContact O-N 3.44Å; A552-V554 VanDerWaalsContact C-N 3.29Å; A552-V554 PolarHBondContact O-N 3.1Å
553Q62.4Low54Low112 Ų11288.3 Ų88.352%0.52343%0.433SS..Hα-helixtrans-66.9-26179-150.3168.920.900113.4E549 K550 A551 Y555 R556E549-Q553 PolarHBondContact O-N 3Å; K550-Q553 WeakPolarHBondContact O-CB 3.49Å; K550-Q553 PolarHBondContact O-N 3.43Å; A551-Q553 PolarHBondContact O-N 2.91Å; Q553-Y555 VanDerWaalsContact C-N 3.3Å; Q553-Y555 PolarHBondContact O-N 3.48Å; Q553-R556 PolarHBondContact O-N 2.73Å
554V75.5Confident55.6Low32 Ų3288 Ų8819%0.19443%0.433CS..THydrogen-bonded Turntrans-62.6-36.1-178.4179.30000112.2R107 L352 A551 A552R107-V554 VanDerWaalsContact CB-O 3.31Å; R107-V554 WeakPolarHBondContact CB-O 3.1Å; L352-V554 HydrophobicContact CD1-CG1 4.16Å; L352-V554 HydrophobicContact CD2-CG2 4.17Å; A551-V554 PolarHBondContact O-N 2.74Å; A552-V554 VanDerWaalsContact C-N 3.29Å; A552-V554 PolarHBondContact O-N 3.1Å
555Y80.4Confident56.9Low6 Ų684.8 Ų84.82%0.02441%0.412CS..THydrogen-bonded Turntrans-94-7.7-176.7-60.7-77000114.1S106 L108 P353 P355 P356 A359 R362 Q553S106-Y555 WeakPolarHBondContact O-CD1 3.37Å; L108-Y555 HydrophobicContact CD1-CE1 4.21Å; L108-Y555 HydrophobicContact CD2-CE1 3.8Å; L108-Y555 HydrophobicContact CG-CE1 3.82Å; P353-Y555 HydrophobicContact CG-CE2 4.15Å; P353-Y555 PolarHBondContact O-OH 3.04Å; P355-Y555 HydrophobicContact CB-CE1 3.96Å; P356-Y555 HydrophobicContact CG-CD2 4.3Å; P356-Y555 HydrophobicContact CG-CG 4.09Å; A359-Y555 HydrophobicContact CB-CD1 3.73Å; A359-Y555 HydrophobicContact CB-CE1 4.45Å; A359-Y555 HydrophobicContact CB-CG 4.32Å; R362-Y555 PolarHBondContact NH2-O 3.33Å; Q553-Y555 VanDerWaalsContact C-N 3.3Å; Q553-Y555 PolarHBondContact O-N 3.48Å
556R75.9Confident58.1Low116 Ų11682.7 Ų82.744%0.43841%0.412SS..PPolyproline II helixtrans-66.7143.5179.9-79.6-172177.9151.40.6111.5R107 Q553R107-R556 PolarHBondContact NE-O 3.14Å; R107-R556 PolarHBondContact NH2-O 3.21Å; Q553-R556 PolarHBondContact O-N 2.73Å
557L76.9Confident59.4Low7 Ų780.3 Ų80.34%0.03741%0.414CS..PPolyproline II helixtrans-65.7161.8175.6-80.7155.6000112.2M104 I561 Q562M104-L557 HydrophobicContact CG-CD2 4.49Å; L557-I561 HydrophobicContact CD1-CG2 4.27Å; L557-I561 HydrophobicContact CD2-CG2 4.1Å; L557-Q562 HydrophobicContact CB-CG 3.9Å; L557-Q562 PolarHBondContact O-NE2 3.44Å
558P72.9Confident60.9Low19 Ų1981.2 Ų81.212%0.12342%0.416CS..PPolyproline II helixtrans-57141166.3-20.431.2000111.5P560 I561 Q562P558-P560 VanDerWaalsContact C-CD 3.4Å; P558-P560 HydrophobicContact CB-CG 4.38Å; P558-I561 HydrophobicContact CB-CD1 4.45Å; P558-I561 HydrophobicContact CG-CD1 4.14Å; P558-I561 PolarHBondContact O-N 3.48Å; P558-Q562 PolarHBondContact O-N 3.11Å
559F61.3Low62.2Low161 Ų16174.7 Ų74.771%0.70640%0.402SS*.Hα-helixtrans-43.1-46.1179.7-78.8-78.1000115.9I561 Q562F559-I561 PolarHBondContact O-N 3.45Å; F559-Q562 PolarHBondContact O-N 3.43Å
560P61.7Low63Low92 Ų9276.8 Ų76.860%0.59741%0.411SS*.Hα-helixtrans-64.8-25.6-179.223.3-33.8000113.7P558P558-P560 VanDerWaalsContact C-CD 3.4Å; P558-P560 HydrophobicContact CB-CG 4.38Å
561I65.4Low63.7Low30 Ų3074.7 Ų74.715%0.15441%0.412CS..Hα-helixtrans-89.2-28.3-178.3-58.5169.8000111W103 M104 L557 P558 F559 N563 L564 C565W103-I561 HydrophobicContact CH2-CD1 3.92Å; W103-I561 HydrophobicContact CZ2-CD1 4Å; W103-I561 HydrophobicContact CZ3-CD1 4.48Å; M104-I561 HydrophobicContact CE-CD1 4.06Å; M104-I561 HydrophobicContact CE-CG2 4.47Å; M104-I561 HydrophobicContact CG-CD1 3.72Å; M104-I561 HydrophobicContact SD-CD1 3.69Å; L557-I561 HydrophobicContact CD1-CG2 4.27Å; L557-I561 HydrophobicContact CD2-CG2 4.1Å; P558-I561 HydrophobicContact CB-CD1 4.45Å; P558-I561 HydrophobicContact CG-CD1 4.14Å; P558-I561 PolarHBondContact O-N 3.48Å; F559-I561 PolarHBondContact O-N 3.45Å; I561-N563 PolarHBondContact O-N 2.91Å; I561-L564 WeakPolarHBondContact O-CB 3.29Å; I561-L564 PolarHBondContact O-N 3.09Å; I561-L564 VanDerWaalsContact O-N 3.07Å; I561-C565 PolarHBondContact O-N 3.39Å
562Q61.5Low64.6Low58 Ų5876.1 Ų76.127%0.27142%0.416SS..Hα-helixtrans-58.7-38.4174.2-68.3-177.519.500111.7L557 P558 F559 L564 C565L557-Q562 HydrophobicContact CB-CG 3.9Å; L557-Q562 PolarHBondContact O-NE2 3.44Å; P558-Q562 PolarHBondContact O-N 3.11Å; F559-Q562 PolarHBondContact O-N 3.43Å; Q562-L564 PolarHBondContact O-N 2.59Å; Q562-C565 WeakPolarHBondContact O-CB 3.02Å; Q562-C565 PolarHBondContact O-N 3.18Å
563N60.2Low65.3Low128 Ų12880.1 Ų80.168%0.68442%0.42SS*.THydrogen-bonded Turntrans-67.6-17.3178.8-68-7000113.5I561 P566I561-N563 PolarHBondContact O-N 2.91Å; N563-P566 WeakPolarHBondContact O-CD 3.47Å
564L61.3Low65.3Low101 Ų10177.2 Ų77.253%0.52941%0.412SS..THydrogen-bonded Turntrans-90.8-19.4177.7-73.6156.4000112.6I561 Q562 P566 C567 I568I561-L564 WeakPolarHBondContact O-CB 3.29Å; I561-L564 PolarHBondContact O-N 3.09Å; I561-L564 VanDerWaalsContact O-N 3.07Å; Q562-L564 PolarHBondContact O-N 2.59Å; L564-P566 VanDerWaalsContact C-N 3.35Å; L564-C567 WeakPolarHBondContact O-CA 3.4Å; L564-C567 WeakPolarHBondContact O-CB 3.36Å; L564-C567 PolarHBondContact O-N 3.37Å; L564-I568 WeakPolarHBondContact O-CG1 3.46Å; L564-I568 PolarHBondContact O-N 3.1Å
565C60.8Low64.9Low18 Ų1876.9 Ų76.912%0.12241%0.409CS..G310 helixtrans-53.7-37.6179.3-82.80000115.3I561 Q562 C567 I568 C576I561-C565 PolarHBondContact O-N 3.39Å; Q562-C565 WeakPolarHBondContact O-CB 3.02Å; Q562-C565 PolarHBondContact O-N 3.18Å; C565-C567 PolarHBondContact O-N 2.88Å; C565-I568 PolarHBondContact O-N 3.25Å; C565-C576 VanDerWaalsContact CA-SG 3.55Å; C565-C576 HydrophobicContact CB-CB 3.72Å; C565-C576 WeakPolarHBondContact CB-SG 3.35Å; C565-C576 WeakPolarHBondContact SG-CB 3.39Å; C565-C576 CovalentContact SG-SG 2.05Å; C565-C576 PolarHBondContact SG-SG 3.44Å
566P60.7Low64.3Low111 Ų11177.1 Ų77.172%0.72141%0.411SS*.G310 helixtrans-67.6-22.7175.4-15.929.5000113.3N563 L564N563-P566 WeakPolarHBondContact O-CD 3.47Å; L564-P566 VanDerWaalsContact C-N 3.35Å
567C58.5Low63.5Low103 Ų10374.2 Ų74.270%0.69641%0.407SS*.G310 helixtrans-92.5-2.4-177.3-56.60000113.1L564 C565L564-C567 WeakPolarHBondContact O-CA 3.4Å; L564-C567 WeakPolarHBondContact O-CB 3.36Å; L564-C567 PolarHBondContact O-N 3.37Å; C565-C567 PolarHBondContact O-N 2.88Å
568I65.3Low62.5Low53 Ų5379.8 Ų79.827%0.27244%0.437SS..SBendtrans-78.8132.2-179.5-69.3177000109.5L564 C565 L572L564-I568 WeakPolarHBondContact O-CG1 3.46Å; L564-I568 PolarHBondContact O-N 3.1Å; C565-I568 PolarHBondContact O-N 3.25Å; I568-L572 HydrophobicContact CG2-CB 3.25Å; I568-L572 HydrophobicContact CG2-CD1 4.34Å; I568-L572 HydrophobicContact CG2-CG 4.42Å
569P64.1Low61.1Low80 Ų8083.4 Ų83.452%0.51946%0.46SS..  trans-60.5146.3179.923.6-32.9000111.5P571 L572P569-P571 VanDerWaalsContact C-N 3.33Å; P569-P571 HydrophobicContact CB-CG 4.47Å; P569-P571 WeakPolarHBondContact O-CD 3.26Å; P569-L572 HydrophobicContact CG-CD1 4.11Å; P569-L572 PolarHBondContact O-N 3.1Å
570Q59.8Low59.8Low169 Ų16984.3 Ų84.379%0.7947%0.466SS*.G310 helixtrans-40-43.5-176.2-72.6-175.3-14.400116.5L572 R573Q570-L572 PolarHBondContact O-N 3Å; Q570-R573 WeakPolarHBondContact O-CB 3.31Å; Q570-R573 PolarHBondContact O-N 3.39Å
571P58.4Low58.1Low97 Ų9787.2 Ų87.263%0.6348%0.477SS*.G310 helixtrans-63.8-21.3179.523.4-35.7000114.7P569P569-P571 VanDerWaalsContact C-N 3.33Å; P569-P571 HydrophobicContact CB-CG 4.47Å; P569-P571 WeakPolarHBondContact O-CD 3.26Å
572L61.7Low56.3Low55 Ų5592.6 Ų92.629%0.28851%0.513SS..G310 helixtrans-101.10.3-177.5-67.8178.2000113L189 I568 P569 Q570 C574 L575L189-L572 HydrophobicContact CB-CD2 3.91Å; L189-L572 HydrophobicContact CD1-CD2 4.37Å; L189-L572 HydrophobicContact CD2-CD2 3.76Å; L189-L572 HydrophobicContact CG-CD2 4.19Å; I568-L572 HydrophobicContact CG2-CB 3.25Å; I568-L572 HydrophobicContact CG2-CD1 4.34Å; I568-L572 HydrophobicContact CG2-CG 4.42Å; P569-L572 HydrophobicContact CG-CD1 4.11Å; P569-L572 PolarHBondContact O-N 3.1Å; Q570-L572 PolarHBondContact O-N 3Å; L572-C574 PolarHBondContact O-N 3.49Å; L572-L575 HydrophobicContact CB-CD1 4.45Å; L572-L575 HydrophobicContact CD2-CD1 4.17Å; L572-L575 WeakPolarHBondContact O-CB 3.45Å; L572-L575 WeakPolarHBondContact O-CG 3.34Å; L572-L575 PolarHBondContact O-N 3.05Å; L572-L575 VanDerWaalsContact O-N 3.14Å
573R66.4Low54.7Low135 Ų13592.3 Ų92.351%0.50953%0.527SS..G310 helixtrans-63.8-22.4-177.6-156.1174.8-174.7178.20.8112.9Q570 L575 C576Q570-R573 WeakPolarHBondContact O-CB 3.31Å; Q570-R573 PolarHBondContact O-N 3.39Å; R573-L575 PolarHBondContact O-N 3.29Å; R573-L575 VanDerWaalsContact O-N 3.08Å; R573-C576 PolarHBondContact O-N 3.12Å; R573-C576 VanDerWaalsContact O-N 3.15Å
574C63.3Low53.2Low51 Ų5194.3 Ų94.335%0.34554%0.537SS..G310 helixtrans-61.4-12.5174.2-640000114.4H358 L572H358-C574 VanDerWaalsContact CA-O 3.28Å; H358-C574 WeakPolarHBondContact CA-O 3.46Å; H358-C574 VanDerWaalsContact CB-O 3.3Å; H358-C574 WeakPolarHBondContact CB-O 3.04Å; L572-C574 PolarHBondContact O-N 3.49Å
575L67.1Low51.8Low25 Ų2598 Ų9813%0.13155%0.552CS.*G310 helixtrans-89.3-15.9178.6-58.3171.7000113.4L189 R362 L572 R573L189-L575 HydrophobicContact CD2-CD1 3.66Å; R362-L575 HydrophobicContact CB-CD2 4.03Å; R362-L575 HydrophobicContact CG-CD2 4.45Å; R362-L575 PolarHBondContact NH1-O 2.72Å; L572-L575 HydrophobicContact CB-CD1 4.45Å; L572-L575 HydrophobicContact CD2-CD1 4.17Å; L572-L575 WeakPolarHBondContact O-CB 3.45Å; L572-L575 WeakPolarHBondContact O-CG 3.34Å; L572-L575 PolarHBondContact O-N 3.05Å; L572-L575 VanDerWaalsContact O-N 3.14Å; R573-L575 PolarHBondContact O-N 3.29Å; R573-L575 VanDerWaalsContact O-N 3.08Å
576C66.3Low50.2Low11 Ų11106.3 Ų106.37%0.07459%0.589CS.*SBendtrans-102.8148.8-179-72.10000110.9C565 R573 L578C565-C576 VanDerWaalsContact CA-SG 3.55Å; C565-C576 HydrophobicContact CB-CB 3.72Å; C565-C576 WeakPolarHBondContact CB-SG 3.35Å; C565-C576 WeakPolarHBondContact SG-CB 3.39Å; C565-C576 CovalentContact SG-SG 2.05Å; C565-C576 PolarHBondContact SG-SG 3.44Å; R573-C576 PolarHBondContact O-N 3.12Å; R573-C576 VanDerWaalsContact O-N 3.15Å; C576-L578 PolarHBondContact O-N 3.39Å
577P60.8Low48.6Very low54 Ų54105.3 Ų105.335%0.35160%0.599SS.*PPolyproline II helixtrans-59.8129.3164.926.4-31000108.4
578L54.8Low46.9Very low125 Ų125103.5 Ų103.565%0.65460%0.597SS**PPolyproline II helixtrans-69.5142.5172.5-160.167.7000108.1C576 E580C576-L578 PolarHBondContact O-N 3.39Å; L578-E580 PolarHBondContact O-N 2.83Å
579P42.8Very low45Very low94 Ų94107 Ų10761%0.6163%0.626SS**PPolyproline II helixtrans-56.7128.1169-17.829.8000108.4D581P579-D581 PolarHBondContact O-N 3.37Å
580E34.8Very low43.1Very low181 Ų181108.8 Ų108.885%0.84664%0.641SS**PPolyproline II helixtrans-64.1127163.7-70.4-178.8155.600106.7L578 P582L578-E580 PolarHBondContact O-N 2.83Å; E580-P582 WeakPolarHBondContact O-CD 3.47Å
581D25.8Very low41.5Very low152 Ų152109.4 Ų109.481%0.81364%0.644SS**PPolyproline II helixtrans-60.1123.5172.9-79.9-40.9000108.1P579 G583P579-D581 PolarHBondContact O-N 3.37Å; D581-G583 PolarHBondContact O-N 2.88Å
582P27Very low40.2Very low143 Ų143110.7 Ų110.793%0.92965%0.652SS**SBendtrans-80.753.6-179.333.8-34.8000110.9E580E580-P582 WeakPolarHBondContact O-CD 3.47Å
583G28.5Very low38.5Very low53 Ų53117.7 Ų117.755%0.54668%0.683SS.*  trans-146.862-171.500000112.5D581D581-G583 PolarHBondContact O-N 2.88Å
584D28.9Very low36.7Very low169 Ų169120.3 Ų120.390%0.90470%0.701SS**SBendtrans-156.732.8154.8-86.2-32000110.2
585E31.8Very low35Very low179 Ų179125.9 Ų125.984%0.83672%0.724SS**  trans-116.473.3162.1-75.9-148.416200109.3
586E27.8Very low33.1Very low193 Ų193129.3 Ų129.390%0.90276%0.757SS**  trans-143.494.2148.5-103.2-176.1-17300108.3G588E586-G588 VanDerWaalsContact C-N 3.32Å; E586-G588 PolarHBondContact O-N 3.48Å
587G25.9Very low31.3Very low90 Ų90135.2 Ų135.293%0.92879%0.787SS**  trans-68.993.315900000108.9
588G23.1Very low29.6Very low65 Ų65141.1 Ų141.167%0.6782%0.815SS**  trans-99.1118162.400000109.2E586 S590E586-G588 VanDerWaalsContact C-N 3.32Å; E586-G588 PolarHBondContact O-N 3.48Å; G588-S590 PolarHBondContact O-N 3.03Å
589S26.8Very low28.4Very low125 Ų125143 Ų14387%0.87483%0.825SS**  trans-48.5129.417551.80000113.6
590S23.5Very low27.8Very low118 Ų118144.7 Ų144.783%0.82584%0.836SS**  trans-135106.5153.250.40000110G588G588-S590 PolarHBondContact O-N 3.03Å
591E25.4Very low27.3Very low183 Ų183140 Ų14086%0.85584%0.835SS**  trans-73.6163.8154.7-90.1-163.716200109.6
592P32.7Very low27.3Very low124 Ų124138.6 Ų138.681%0.80584%0.838SS**  trans-85.1133.8-148.633.7-31.4000111.8
593E26Very low27.3Very low201 Ų201135.2 Ų135.294%0.93983%0.829SS**  trans-111134.5167.8-113.1-173.5164.100111.9
594E28.3Very low27.3Very low190 Ų190142 Ų14289%0.88885%0.847SS**  trans-81.5145.7-166.2-161.4174.6-179.700111.4
595M27.2Very low27.3Very low168 Ų168139.4 Ų139.483%0.82884%0.839SS**  trans-37.7129.7169.9-173.8167.9172.400115.4
596A28.1Very low26.9Very low98 Ų98136.6 Ų136.681%0.8184%0.838SS**  trans-154129.7153.200000112.5
597D26.8Very low27.1Very low135 Ų135133.6 Ų133.672%0.72283%0.834SS**  trans-65.3152.8-174.9-62.7-60.6000115.9
598L26.4Very low27Very low177 Ų177138.4 Ų138.493%0.92783%0.833SS**  trans-147.1105.6145.5-77.2-178.7000111.4
599L28.2Very low27.1Very low166 Ų166140 Ų14087%0.86983%0.834SS**  trans-106144.4151-78.9170.2000108.1
600P31.2Very low27.1Very low129 Ų129139 Ų13984%0.83883%0.827SS**  trans-84.9142177.634.5-31000111.2
601G24.2Very low27.3Very low81 Ų81143.3 Ų143.384%0.83583%0.825SS**  trans-87.3177.8-164.400000117.8
602S25.3Very low27.5Very low123 Ų123142.1 Ų142.186%0.8682%0.82SS**  trans-152.2109.5158.561.50000110.3
603G26.6Very low27.2Very low72 Ų72139.5 Ų139.574%0.74282%0.815SS**  trans65.5102.6131.600000121.8
604E28.3Very low27.3Very low197 Ų197139.7 Ų139.792%0.92181%0.813SS**  trans84.6150.5132-75.5-169.4132.700122.4
605P30.2Very low27.5Very low114 Ų114140.9 Ų140.974%0.7481%0.81SS**  trans-119.5166.1-135.939.3-25.2000117
606C22.3Very low27.6Very low120 Ų120137.6 Ų137.681%0.81180%0.803SS**  trans-4.1156.3162-65.30000121.3
607P31.8Very low27.7Very low129 Ų129141.5 Ų141.584%0.83881%0.805SS**  -139.3164.488.430.9-12000116.5
608E24.8Very low28Very low191 Ų191148.5 Ų148.589%0.89383%0.829SS**  trans-53.5154.9176.2-59.9170.9127.900115.5
609S25.8Very low28.1Very low100 Ų100147.1 Ų147.170%0.69982%0.824SS**  trans175.4114.3132.7160.80000112.1
610S25.9Very low28.1Very low104 Ų104146.1 Ų146.173%0.72782%0.822SS**  23.5141129.524.50000122.4
611R28.1Very low28Very low207 Ų207147.1 Ų147.178%0.78182%0.821SS**  trans102.3127.9133.1-112.6-174.1171146.33.2119.9
612E29.4Very low28.2Very low159 Ų159150.9 Ų150.974%0.74382%0.82SS**  trans65.7129.5139.6-82.1159.4-158.600119.9
613G26.7Very low28.4Very low69 Ų69152.7 Ų152.771%0.71182%0.817SS**  trans-82.8173.2178.400000113.8
614F28.6Very low28.5Very low204 Ų204158.1 Ų158.190%0.89582%0.822SS**  trans-164.1152.1140.7-130.6-95.9000111
615R31.2Very low28.5Very low215 Ų215155.3 Ų155.381%0.81182%0.815SS**  trans-47.3156171.1-91.3168.5167.4176.3-2.6116.6
616S29.2Very low28.4Very low99 Ų99158.5 Ų158.569%0.69282%0.821SS**  trans85.7129.2133.4-860000122
617Q31Very low28.9Very low180 Ų180161.7 Ų161.784%0.84182%0.822SS**  trans69.7105.5141-72.9178-14.400118.2
618K34Very low28.6Very low283 Ų283164.6 Ų164.6100%1.2382%0.82SS**  -160.2088.6-114.4175.4-179.4176.40111.6

Retrieved 618 of 618 residues in 147.6 ms (Link to these results)