A0A060W409_ONCMY Loading...

Osteoclast stimulatory transmembrane protein

AlphaFold DB , UniProt , Accession A0A060W409, Species ONCMY (Oncorhynchus mykiss, Rainbow trout), Gene ocstamp, Length 509 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
1M40.9Very low33.4Very low245 Ų245178.5 Ų178.5100%1.20790%0.897SS**  0105.30-84.4166.49000107.7
2T28.3Very low33.3Very low126 Ų126177.3 Ų177.377%0.77389%0.894SS**  trans-121.7120.4-163.621.60000110.4H4T2-H4 PolarHBondContact O-N 3.04Å
3V32.8Very low32.9Very low144 Ų144178 Ų17887%0.87389%0.892SS**SBendtrans50.644.7137.4-155.70000118.1
4H34.5Very low32.6Very low175 Ų175176.4 Ų176.481%0.8189%0.887SS**SBendtrans-125.6-6165.8-135.1-46.3000116T2T2-H4 PolarHBondContact O-N 3.04Å
5D38Very low32.6Very low167 Ų167171.9 Ų171.989%0.89388%0.875SS**SBendtrans-104.617.3-171.7-71.6-32000115.8
6K35.7Very low32.9Very low200 Ų200169.1 Ų169.187%0.8787%0.872SS**SBendtrans-110.516.2-171-132.4178.7-174.3-178.20117
7F32.8Very low32.6Very low214 Ų214166.1 Ų166.194%0.93987%0.869SS**SBendtrans-121.64.6-178.8-103.2-80.7000116.2
8L31Very low32.2Very low167 Ų167165.2 Ų165.287%0.87487%0.865SS**SBendtrans-10815.6-174.8-118.2138.4000115
9Y31.5Very low31.9Very low234 Ų234165.4 Ų165.492%0.91887%0.867SS**SBendtrans-130.731.1-172.2-108.6-83.2000115.4
10Q31.5Very low31.5Very low194 Ų194163.2 Ų163.291%0.90787%0.865SS**SBendtrans-145.855.1179.3-148.8167.31.900113.8
11A30.6Very low31.2Very low98 Ų98162 Ų16281%0.8186%0.863SS**SBendtrans-148.527.1170.900000114.5
12L31.7Very low30.5Very low164 Ų164156.5 Ų156.586%0.85984%0.844SS**  trans-141.8131.9174.4-96.4140.6000109.1
13Q28.2Very low30.4Very low186 Ų186156.2 Ų156.287%0.86985%0.847SS**  trans95.9120-179.1-61.4169.3-18.400113.1
14L28.9Very low30Very low155 Ų155158.3 Ų158.381%0.81285%0.847SS**  cis-169.6-17024.4-90143.5000107.5
15P33.3Very low29.6Very low110 Ų110154.1 Ų154.171%0.71484%0.843SS**  -125.8-170.8-59.841-23.1000111.6
16P36.9Very low29.1Very low126 Ų126153.6 Ų153.682%0.81884%0.839SS**  trans-95.8156.5-169.736.9-28.6000113.9
17S27.3Very low28.7Very low119 Ų119151.7 Ų151.783%0.83284%0.837SS**  trans-150.7121.9162.269.20000112.1
18D26.7Very low28.9Very low150 Ų150146.7 Ų146.780%0.80283%0.827SS**  trans-63.1142.7167.4-67-52.6000112.2
19N26.3Very low28.9Very low169 Ų169150.6 Ų150.690%0.90483%0.83SS**  -176.8138.4124.9-92.6-27.4000113
20C23.3Very low28.8Very low121 Ų121150.4 Ų150.482%0.81883%0.828SS**  trans-48.5151176.8-108.20000115.9
21V25.1Very low28.5Very low137 Ų137150.6 Ų150.683%0.8383%0.831SS**  -174.2128.1107.3165.20000109.4
22T27Very low28.4Very low131 Ų131154.8 Ų154.880%0.80483%0.831SS**  trans-67.2135.2167.443.20000112.6
23S24.6Very low28.4Very low119 Ų119151.3 Ų151.383%0.83282%0.82SS**  trans-152.9122.3145.5-163.60000111.8
24H25.7Very low28.5Very low188 Ų188150.4 Ų150.487%0.8782%0.82SS**  trans-62.9138.7166.3-89.4-107000111.3
25A26.5Very low28.6Very low88 Ų88148.7 Ų148.773%0.72782%0.816SS**  trans-174.6111.9143.100000113.4
26L27.3Very low28.4Very low156 Ų156147.9 Ų147.982%0.81782%0.818SS**  trans50.7106.1132.1-65.6156.7000122.2
27L26.9Very low28Very low159 Ų159147.9 Ų147.983%0.83282%0.82SS**  trans67.3160.2130.2-85.7158.2000120.6
28P36.9Very low28Very low110 Ų110150.7 Ų150.771%0.71482%0.822SS**  -116.4155.8-124.739.1-24.1000114.1
29R30.3Very low28.3Very low248 Ų248147.2 Ų147.294%0.93682%0.822SS**  trans-138.4114.9166.9-88.7-173.9179.2179.91.1113.9
30R29.9Very low28.4Very low231 Ų231148.2 Ų148.287%0.87282%0.818SS**  trans18.7107.9144.2-82.7179.5168.2175.4-3.9116.5K32R30-K32 PolarHBondContact O-N 3.43Å
31M26.1Very low29Very low197 Ų197146.3 Ų146.397%0.9782%0.82SS**  trans-71.594.3159.4-146.8172.1-174.400108.7
32K28.6Very low29.3Very low186 Ų186148 Ų14881%0.80982%0.816SS**  trans-64.8132.9165.9-83.6179.6175.8178.80108.5R30R30-K32 PolarHBondContact O-N 3.43Å
33S30.3Very low29.8Very low91 Ų91147.8 Ų147.864%0.63682%0.82SS**  trans-53145.6175.5175.70000112.1T35S33-T35 PolarHBondContact O-N 2.9Å; S33-T35 PolarHBondContact OG-OG1 3.22Å
34I30Very low30.5Very low168 Ų168148.5 Ų148.586%0.86281%0.814SS**G310 helixtrans-63.421.9-178.7-67.6162.3000113.4A36I34-A36 VanDerWaalsContact C-N 3.35Å
35T31.2Very low31.3Very low119 Ų119149.7 Ų149.773%0.7381%0.81SS**G310 helixtrans-88.50.5-178.6-260000113.1S33S33-T35 PolarHBondContact O-N 2.9Å; S33-T35 PolarHBondContact OG-OG1 3.22Å
36A28.9Very low32.4Very low93 Ų93154.2 Ų154.277%0.76982%0.816SS**G310 helixtrans-101.45.5-170.800000116I34I34-A36 VanDerWaalsContact C-N 3.35Å
37C28.8Very low33.8Very low126 Ų126154.9 Ų154.985%0.85182%0.815SS**SBendtrans-108.614.6-178.8-740000115.4
38M28.5Very low35.4Very low177 Ų177150.1 Ų150.187%0.87279%0.794SS**SBendtrans-124.494.7165.1-71.2-176.117700108.5F40M38-F40 VanDerWaalsContact C-N 3.31Å; M38-F40 PolarHBondContact O-N 3.09Å
39G32Very low36.9Very low78 Ų78154 Ų15480%0.80480%0.795SS**  trans-67.886.7173.600000110.8
40F28.7Very low39.3Very low189 Ų189143.9 Ų143.983%0.82977%0.767SS**  trans-12799.9154.9-95.6-84.8000107.2M38 F42M38-F40 VanDerWaalsContact C-N 3.31Å; M38-F40 PolarHBondContact O-N 3.09Å; F40-F42 PolarHBondContact O-N 3.42Å; F40-F42 VanDerWaalsContact O-N 3.08Å
41G36.4Very low41.7Very low82 Ų82135.6 Ų135.685%0.84575%0.748SS**  trans-68.4100.1169.600000109.2
42F31Very low44.4Very low173 Ų173131.9 Ų131.976%0.75973%0.73SS**  trans-11489.2161.2-120-92.8000107.9F40 L44F40-F42 PolarHBondContact O-N 3.42Å; F40-F42 VanDerWaalsContact O-N 3.08Å; F42-L44 HydrophobicContact CD1-CB 4.2Å; F42-L44 HydrophobicContact CD1-CD1 4.03Å; F42-L44 HydrophobicContact CE1-CD1 3.94Å; F42-L44 PolarHBondContact O-N 3.36Å
43S37.9Very low47.2Very low125 Ų125128.7 Ų128.787%0.87472%0.716SS**  trans-76.774.5166.2179.80000108.7
44L39.5Very low50Low135 Ų135128.6 Ų128.671%0.70771%0.712SS**  trans-139.3115.4165.7-98.1107.4000110.4F42F42-L44 HydrophobicContact CD1-CB 4.2Å; F42-L44 HydrophobicContact CD1-CD1 4.03Å; F42-L44 HydrophobicContact CE1-CD1 3.94Å; F42-L44 PolarHBondContact O-N 3.36Å
45R41.3Very low52.9Low213 Ų213124.4 Ų124.480%0.80469%0.694SS**  trans75.267.3150-157.5171.7-128.8-131.41.5117.9P48R45-P48 HydrophobicContact CG-CG 3.47Å; R45-P48 VanDerWaalsContact CG-CG 3.47Å
46Q51Low55.7Low182 Ų182124.1 Ų124.185%0.8569%0.687SS**  trans-88.8-21.9169.6-117.7166-3.600114.5
47E55.1Low58.7Low171 Ų171125 Ų12580%0.79968%0.676SS**Hα-helixtrans-60.4-47.7-177-70.5-71.9126.200115.7W49 G50 A51E47-W49 PolarHBondContact O-N 3.03Å; E47-G50 PolarHBondContact O-N 2.96Å; E47-A51 PolarHBondContact O-N 3.17Å
48P61.2Low61.7Low59 Ų59124.2 Ų124.238%0.38366%0.655SS.*Hα-helixtrans-73-27.4-173.226.6-32.5000113.3R45 M52R45-P48 HydrophobicContact CG-CG 3.47Å; R45-P48 VanDerWaalsContact CG-CG 3.47Å; P48-M52 WeakPolarHBondContact O-CB 3.32Å; P48-M52 PolarHBondContact O-N 3.04Å
49W68.9Low64.8Low191 Ų191118.7 Ų118.772%0.72363%0.628SS**Hα-helixtrans-70.6-35.7178.9-169.9-96.9000111.9E47 K53E47-W49 PolarHBondContact O-N 3.03Å; W49-K53 WeakPolarHBondContact O-CB 2.98Å; W49-K53 PolarHBondContact O-N 2.91Å; W49-K53 VanDerWaalsContact O-N 3.07Å
50G79.4Confident67.7Low35 Ų35119.7 Ų119.736%0.36161%0.608SS.*Hα-helixtrans-64.1-48.4174.500000112E47 K53 T54E47-G50 PolarHBondContact O-N 2.96Å; G50-K53 PolarHBondContact O-N 3.36Å; G50-T54 PolarHBondContact O-N 3.35Å; G50-T54 VanDerWaalsContact O-N 3.14Å; G50-T54 PolarHBondContact O-OG1 3.44Å
51A80.8Confident70.8Confident57 Ų57113.1 Ų113.147%0.47158%0.581SS.*Hα-helixtrans-61.2-48.6177.400000111.9E47 K53 T54 T55E47-A51 PolarHBondContact O-N 3.17Å; A51-K53 VanDerWaalsContact C-N 3.34Å; A51-K53 PolarHBondContact O-N 3.1Å; A51-T54 PolarHBondContact O-N 3.42Å; A51-T55 PolarHBondContact O-N 3.25Å; A51-T55 PolarHBondContact O-OG1 2.93Å; A51-T55 VanDerWaalsContact O-OG1 3.06Å
52M81.9Confident73.5Confident119 Ų119109.2 Ų109.259%0.58654%0.541SS*.Hα-helixtrans-59.2-42.7179-177.1178.6168.600112.4P48 T55 L56P48-M52 WeakPolarHBondContact O-CB 3.32Å; P48-M52 PolarHBondContact O-N 3.04Å; M52-T55 PolarHBondContact O-N 2.86Å; M52-L56 WeakPolarHBondContact O-CB 3Å; M52-L56 PolarHBondContact O-N 3.35Å
53K87.9Confident76.6Confident120 Ų120101.7 Ų101.752%0.52251%0.508SS..Hα-helixtrans-62.5-44.8177.9-178.6-177.3175.6-171.90111.9W49 G50 A51 L56 Q57W49-K53 WeakPolarHBondContact O-CB 2.98Å; W49-K53 PolarHBondContact O-N 2.91Å; W49-K53 VanDerWaalsContact O-N 3.07Å; G50-K53 PolarHBondContact O-N 3.36Å; A51-K53 VanDerWaalsContact C-N 3.34Å; A51-K53 PolarHBondContact O-N 3.1Å; K53-L56 PolarHBondContact O-N 3.06Å; K53-Q57 WeakPolarHBondContact O-CB 3.35Å; K53-Q57 VanDerWaalsContact O-CG 3.29Å; K53-Q57 WeakPolarHBondContact O-CG 3.19Å; K53-Q57 PolarHBondContact O-N 2.9Å
54T90.4Very high79.2Confident89 Ų8995.7 Ų95.755%0.54647%0.466SS..Hα-helixtrans-65-43.5-179.9-510000111G50 A51 L56 Q57 Y58G50-T54 PolarHBondContact O-N 3.35Å; G50-T54 VanDerWaalsContact O-N 3.14Å; G50-T54 PolarHBondContact O-OG1 3.44Å; A51-T54 PolarHBondContact O-N 3.42Å; T54-L56 PolarHBondContact O-N 3.25Å; T54-Q57 PolarHBondContact O-N 2.91Å; T54-Y58 PolarHBondContact O-N 3.11Å
55T89.3Confident81.7Confident80 Ų8091.7 Ų91.749%0.49144%0.443SS..Hα-helixtrans-60.5-45.4175-56.10000111.6A51 M52 Q57 Y58 M59A51-T55 PolarHBondContact O-N 3.25Å; A51-T55 PolarHBondContact O-OG1 2.93Å; A51-T55 VanDerWaalsContact O-OG1 3.06Å; M52-T55 PolarHBondContact O-N 2.86Å; T55-Q57 VanDerWaalsContact C-N 3.32Å; T55-Q57 PolarHBondContact O-N 3.08Å; T55-Y58 PolarHBondContact O-N 3.14Å; T55-M59 HydrophobicContact CG2-CG 4.46Å; T55-M59 HydrophobicContact CG2-SD 4.11Å; T55-M59 WeakPolarHBondContact O-CB 3.44Å; T55-M59 VanDerWaalsContact O-CG 3.3Å; T55-M59 WeakPolarHBondContact O-CG 3.32Å; T55-M59 PolarHBondContact O-N 3.44Å
56L90.5Very high84Confident112 Ų11285.4 Ų85.459%0.58643%0.43SS*.Hα-helixtrans-64.6-37.2179.2-158.677.6000112.1M52 K53 T54 W60M52-L56 WeakPolarHBondContact O-CB 3Å; M52-L56 PolarHBondContact O-N 3.35Å; K53-L56 PolarHBondContact O-N 3.06Å; T54-L56 PolarHBondContact O-N 3.25Å; L56-W60 VanDerWaalsContact O-CB 3.26Å; L56-W60 WeakPolarHBondContact O-CB 3.41Å; L56-W60 PolarHBondContact O-N 2.83Å
57Q91.2Very high85.7Confident113 Ų11382.3 Ų82.353%0.52842%0.423SS..Hα-helixtrans-66.2-43.8175.1-75.7177.3-2500112K53 T54 T55 W60 D61K53-Q57 WeakPolarHBondContact O-CB 3.35Å; K53-Q57 VanDerWaalsContact O-CG 3.29Å; K53-Q57 WeakPolarHBondContact O-CG 3.19Å; K53-Q57 PolarHBondContact O-N 2.9Å; T54-Q57 PolarHBondContact O-N 2.91Å; T55-Q57 VanDerWaalsContact C-N 3.32Å; T55-Q57 PolarHBondContact O-N 3.08Å; Q57-W60 PolarHBondContact O-N 3.04Å; Q57-D61 PolarHBondContact O-N 2.68Å
58Y92.8Very high87.3Confident108 Ų10876.4 Ų76.442%0.42440%0.396SS..Hα-helixtrans-60.1-50.9174.6171.8-103.6000111.2T54 T55 W60 D61 V62 T75T54-Y58 PolarHBondContact O-N 3.11Å; T55-Y58 PolarHBondContact O-N 3.14Å; Y58-W60 VanDerWaalsContact C-N 3.31Å; Y58-W60 PolarHBondContact O-N 2.81Å; Y58-D61 PolarHBondContact O-N 3.34Å; Y58-V62 HydrophobicContact CD2-CG2 4.26Å; Y58-V62 HydrophobicContact CE1-CG2 4.11Å; Y58-V62 HydrophobicContact CE2-CG2 3.83Å; Y58-V62 WeakPolarHBondContact O-CG2 3.37Å; Y58-V62 PolarHBondContact O-N 2.92Å; Y58-T75 HydrophobicContact CE1-CG2 4.36Å
59M93Very high88.6Confident61 Ų6176 Ų7630%0.340%0.398SS..Hα-helixtrans-55.1-44.2176.2-79.1179.2114.900112.6T55 Y63 M79T55-M59 HydrophobicContact CG2-CG 4.46Å; T55-M59 HydrophobicContact CG2-SD 4.11Å; T55-M59 WeakPolarHBondContact O-CB 3.44Å; T55-M59 VanDerWaalsContact O-CG 3.3Å; T55-M59 WeakPolarHBondContact O-CG 3.32Å; T55-M59 PolarHBondContact O-N 3.44Å; M59-Y63 VanDerWaalsContact O-CB 3.23Å; M59-Y63 WeakPolarHBondContact O-CB 3.28Å; M59-Y63 PolarHBondContact O-N 3.33Å; M59-M79 HydrophobicContact CB-CE 3.47Å; M59-M79 VanDerWaalsContact CB-CE 3.47Å; M59-M79 HydrophobicContact CE-CE 3.13Å; M59-M79 HydrophobicContact CE-SD 3.5Å; M59-M79 VanDerWaalsContact CE-SD 3.5Å; M59-M79 HydrophobicContact CG-CE 3.62Å; M59-M79 HydrophobicContact SD-CE 3.69Å
60W94.4Very high89.5Confident100 Ų10071.4 Ų71.438%0.37940%0.4SS..Hα-helixtrans-66.9-40.9178.7-179.8-94.3000113L56 Q57 Y58 Y63 S64 T132 V460 S463 F464L56-W60 VanDerWaalsContact O-CB 3.26Å; L56-W60 WeakPolarHBondContact O-CB 3.41Å; L56-W60 PolarHBondContact O-N 2.83Å; Q57-W60 PolarHBondContact O-N 3.04Å; Y58-W60 VanDerWaalsContact C-N 3.31Å; Y58-W60 PolarHBondContact O-N 2.81Å; W60-Y63 PolarHBondContact O-N 2.88Å; W60-S64 WeakPolarHBondContact O-CB 3.45Å; W60-S64 PolarHBondContact O-N 2.85Å; W60-S64 PolarHBondContact O-OG 3.48Å; W60-T132 HydrophobicContact CH2-CG2 3.74Å; W60-T132 HydrophobicContact CZ3-CG2 3.91Å; W60-V460 HydrophobicContact CH2-CG1 4.37Å; W60-V460 HydrophobicContact CH2-CG2 4Å; W60-V460 HydrophobicContact CZ2-CG2 4.33Å; W60-S463 PolarHBondContact NE1-OG 3.4Å; W60-F464 HydrophobicContact CH2-CE2 4.35Å; W60-F464 HydrophobicContact CZ2-CE2 4.39Å
61D92.6Very high89.9Confident50 Ų5078.9 Ų78.927%0.26742%0.423SS..Hα-helixtrans-67.1-45178.1-174.861.5000111.1Q57 Y58 Y63 S64 K65 K466Q57-D61 PolarHBondContact O-N 2.68Å; Y58-D61 PolarHBondContact O-N 3.34Å; D61-Y63 VanDerWaalsContact C-N 3.35Å; D61-Y63 PolarHBondContact O-N 3.21Å; D61-S64 PolarHBondContact O-N 3.33Å; D61-S64 PolarHBondContact O-OG 3.1Å; D61-K65 WeakPolarHBondContact O-CD 3.36Å; D61-K65 VanDerWaalsContact O-CG 3.25Å; D61-K65 WeakPolarHBondContact O-CG 3.43Å; D61-K65 PolarHBondContact O-N 3.36Å; D61-K65 VanDerWaalsContact O-N 3.13Å; D61-K65 WeakPolarHBondContact OD2-CE 3.44Å; D61-K65 IonicContact OD2-NZ 2.87Å; D61-K65 PolarHBondContact OD2-NZ 3.32Å; D61-K466 IonicContact OD1-NZ 2.71Å; D61-K466 PolarHBondContact OD1-NZ 3.05Å
62V94.3Very high90.5Very high1 Ų177.6 Ų77.61%0.00641%0.407CS..Hα-helixtrans-56-49.7171.9170.60000110.5Y58 S64 Q68 E72 T75 L76Y58-V62 HydrophobicContact CD2-CG2 4.26Å; Y58-V62 HydrophobicContact CE1-CG2 4.11Å; Y58-V62 HydrophobicContact CE2-CG2 3.83Å; Y58-V62 WeakPolarHBondContact O-CG2 3.37Å; Y58-V62 PolarHBondContact O-N 2.92Å; V62-S64 VanDerWaalsContact C-N 3.35Å; V62-S64 PolarHBondContact O-N 3.49Å; V62-Q68 PolarHBondContact O-NE2 3.13Å; V62-Q68 PolarHBondContact O-OE1 3.47Å; V62-E72 HydrophobicContact CG1-CB 4.12Å; V62-E72 HydrophobicContact CG2-CB 4.23Å; V62-E72 HydrophobicContact CG2-CG 4.03Å; V62-T75 HydrophobicContact CG1-CG2 4.2Å; V62-L76 HydrophobicContact CG1-CB 4.28Å
63Y94.4Very high91.1Very high14 Ų1474.5 Ų74.56%0.05540%0.395CS..Hα-helixtrans-66-33.2-176.2-175.3-106.1000114M59 W60 D61 L76 M79 I83 R128 T132 F464M59-Y63 VanDerWaalsContact O-CB 3.23Å; M59-Y63 WeakPolarHBondContact O-CB 3.28Å; M59-Y63 PolarHBondContact O-N 3.33Å; W60-Y63 PolarHBondContact O-N 2.88Å; D61-Y63 VanDerWaalsContact C-N 3.35Å; D61-Y63 PolarHBondContact O-N 3.21Å; Y63-L76 HydrophobicContact CD2-CD1 3.84Å; Y63-L76 HydrophobicContact CE2-CD1 4.46Å; Y63-M79 HydrophobicContact CD2-CB 4.26Å; Y63-I83 HydrophobicContact CE2-CD1 3.82Å; Y63-I83 WeakPolarHBondContact OH-CD1 3.39Å; Y63-R128 HydrophobicContact CE1-CB 4.27Å; Y63-R128 HydrophobicContact CE2-CB 4.37Å; Y63-R128 HydrophobicContact CE2-CG 4.13Å; Y63-R128 PolarHBondContact O-NH1 2.98Å; Y63-R128 PolarHBondContact OH-O 2.85Å; Y63-T132 WeakPolarHBondContact CE1-OG1 3.3Å; Y63-F464 AromaticContact CD1-CZ 3.73Å; Y63-F464 HydrophobicContact CD1-CZ 3.73Å; Y63-F464 HydrophobicContact CE1-CE1 4.4Å; Y63-F464 AromaticContact CE1-CZ 3.62Å; Y63-F464 HydrophobicContact CE1-CZ 3.62Å
64S94.1Very high91.3Very high0 Ų075.1 Ų75.10%040%0.403CS..Hα-helixtrans-89.4-15.5-176.7600000114.8W60 D61 V62 H125 S463 F464W60-S64 WeakPolarHBondContact O-CB 3.45Å; W60-S64 PolarHBondContact O-N 2.85Å; W60-S64 PolarHBondContact O-OG 3.48Å; D61-S64 PolarHBondContact O-N 3.33Å; D61-S64 PolarHBondContact O-OG 3.1Å; V62-S64 VanDerWaalsContact C-N 3.35Å; V62-S64 PolarHBondContact O-N 3.49Å; S64-H125 PolarHBondContact O-NE2 2.95Å; S64-S463 PolarHBondContact OG-OG 3.43Å; S64-S463 VanDerWaalsContact OG-OG 3.06Å; S64-F464 WeakPolarHBondContact O-CA 3.33Å
65K91.7Very high91.5Very high51 Ų5172.7 Ų72.722%0.22239%0.388CS..  trans-69.2140.2177.6-83.2164.9167.5166.10113D61 Q68 E72 H125 R128D61-K65 WeakPolarHBondContact O-CD 3.36Å; D61-K65 VanDerWaalsContact O-CG 3.25Å; D61-K65 WeakPolarHBondContact O-CG 3.43Å; D61-K65 PolarHBondContact O-N 3.36Å; D61-K65 VanDerWaalsContact O-N 3.13Å; D61-K65 WeakPolarHBondContact OD2-CE 3.44Å; D61-K65 IonicContact OD2-NZ 2.87Å; D61-K65 PolarHBondContact OD2-NZ 3.32Å; K65-Q68 PolarHBondContact O-NE2 3.44Å; K65-E72 IonicContact NZ-OE1 2.92Å; K65-E72 PolarHBondContact NZ-OE1 3.07Å; K65-H125 PolarHBondContact O-CD2 3.07Å; K65-R128 PolarHBondContact O-NH1 3.34Å; K65-R128 PolarHBondContact O-NH2 3.47Å
66P89.6Confident91.7Very high80 Ų8069 Ų6952%0.51937%0.366SS..SBendtrans-71.9-50177.627.6-32.3000112.6H125P66-H125 WeakPolarHBondContact CA-CD2 3.22Å
67T87Confident92Very high118 Ų11867.1 Ų67.172%0.72436%0.356SS*.SBendtrans-103.4141176.7490000110.1
68Q87.9Confident92.1Very high46 Ų4664.8 Ų64.822%0.21535%0.352CS..  trans-112.6140.3-175.1-61.1-65-4100110.4V62 K65 V73 L76V62-Q68 PolarHBondContact O-NE2 3.13Å; V62-Q68 PolarHBondContact O-OE1 3.47Å; K65-Q68 PolarHBondContact O-NE2 3.44Å; Q68-V73 HydrophobicContact CB-CG2 4.14Å; Q68-L76 HydrophobicContact CG-CD2 3.65Å
69A88.9Confident92.2Very high52 Ų5261.5 Ų61.543%0.4334%0.341SS..  trans-73.1151.8165.300000110K71 E72 V73A69-K71 PolarHBondContact O-N 3.05Å; A69-E72 HydrophobicContact CB-CG 4.27Å; A69-E72 PolarHBondContact N-OE2 3.27Å; A69-E72 WeakPolarHBondContact O-CB 3.4Å; A69-E72 PolarHBondContact O-N 3.49Å; A69-V73 PolarHBondContact O-N 3.1Å
70A87.7Confident92.3Very high94 Ų9458.6 Ų58.678%0.77733%0.327SS*.Hα-helixtrans-52.3-36-17800000113.6E72A70-E72 VanDerWaalsContact C-N 3.3Å; A70-E72 PolarHBondContact O-N 2.94Å
71K88.4Confident92.4Very high191 Ų19159 Ų5983%0.8333%0.331SS*.Hα-helixtrans-70.1-23.9178.2-60.8-178.7-179-179.70113.6A69A69-K71 PolarHBondContact O-N 3.05Å
72E92.7Very high92.6Very high30 Ų3060.7 Ų60.714%0.1434%0.339CS..Hα-helixtrans-91.5-18.6-177-62.3175.1150.600112V62 K65 A69 A70 L74 T75 L76V62-E72 HydrophobicContact CG1-CB 4.12Å; V62-E72 HydrophobicContact CG2-CB 4.23Å; V62-E72 HydrophobicContact CG2-CG 4.03Å; K65-E72 IonicContact NZ-OE1 2.92Å; K65-E72 PolarHBondContact NZ-OE1 3.07Å; A69-E72 HydrophobicContact CB-CG 4.27Å; A69-E72 PolarHBondContact N-OE2 3.27Å; A69-E72 WeakPolarHBondContact O-CB 3.4Å; A69-E72 PolarHBondContact O-N 3.49Å; A70-E72 VanDerWaalsContact C-N 3.3Å; A70-E72 PolarHBondContact O-N 2.94Å; E72-L74 PolarHBondContact O-N 3.43Å; E72-T75 WeakPolarHBondContact O-CB 3.5Å; E72-T75 PolarHBondContact O-N 2.97Å; E72-T75 VanDerWaalsContact O-N 3.08Å; E72-L76 PolarHBondContact O-N 3.28Å
73V93.8Very high92.5Very high55 Ų5563 Ų6333%0.33335%0.351SS..Hα-helixtrans-56.4-46.2-176.8174.60000112.4Q68 A69 T75 L76 L77 F122Q68-V73 HydrophobicContact CB-CG2 4.14Å; A69-V73 PolarHBondContact O-N 3.1Å; V73-T75 VanDerWaalsContact C-N 3.27Å; V73-T75 PolarHBondContact O-N 2.98Å; V73-L76 PolarHBondContact O-N 3.25Å; V73-L77 WeakPolarHBondContact O-CB 3.41Å; V73-L77 PolarHBondContact O-N 2.93Å; V73-F122 HydrophobicContact CG1-CE2 4.13Å; V73-F122 HydrophobicContact CG1-CZ 3.89Å
74L93.5Very high92.6Very high133 Ų13362.4 Ų62.470%0.69635%0.349SS*.Hα-helixtrans-62.6-37.9179.6-178.562.6000111.7E72 L77 S78E72-L74 PolarHBondContact O-N 3.43Å; L74-L77 PolarHBondContact O-N 3.03Å; L74-S78 WeakPolarHBondContact O-CB 3.41Å; L74-S78 PolarHBondContact O-N 3Å
75T93.2Very high92.7Very high38 Ų3867.4 Ų67.423%0.23337%0.374CS..Hα-helixtrans-66.8-45.3177.9-56.20000110.4Y58 V62 E72 V73 S78 M79Y58-T75 HydrophobicContact CE1-CG2 4.36Å; V62-T75 HydrophobicContact CG1-CG2 4.2Å; E72-T75 WeakPolarHBondContact O-CB 3.5Å; E72-T75 PolarHBondContact O-N 2.97Å; E72-T75 VanDerWaalsContact O-N 3.08Å; V73-T75 VanDerWaalsContact C-N 3.27Å; V73-T75 PolarHBondContact O-N 2.98Å; T75-S78 PolarHBondContact O-N 3.48Å; T75-M79 VanDerWaalsContact O-CG 3.28Å; T75-M79 WeakPolarHBondContact O-CG 3.49Å; T75-M79 PolarHBondContact O-N 2.86Å; T75-M79 VanDerWaalsContact O-N 3.09Å
76L94.9Very high92.9Very high3 Ų369 Ų692%0.01639%0.388CS..Hα-helixtrans-61.7-45.1176.1179.163.5000111.8V62 Y63 Q68 E72 V73 S78 M79 C80 F122V62-L76 HydrophobicContact CG1-CB 4.28Å; Y63-L76 HydrophobicContact CD2-CD1 3.84Å; Y63-L76 HydrophobicContact CE2-CD1 4.46Å; Q68-L76 HydrophobicContact CG-CD2 3.65Å; E72-L76 PolarHBondContact O-N 3.28Å; V73-L76 PolarHBondContact O-N 3.25Å; L76-S78 VanDerWaalsContact C-N 3.34Å; L76-S78 PolarHBondContact O-N 2.88Å; L76-M79 PolarHBondContact O-N 3.43Å; L76-C80 PolarHBondContact O-N 3.22Å; L76-C80 PolarHBondContact O-SG 3.38Å; L76-F122 HydrophobicContact CD2-CD2 4.13Å; L76-F122 HydrophobicContact CD2-CE2 4.22Å; L76-F122 HydrophobicContact CG-CD2 4.14Å; L76-F122 HydrophobicContact CG-CE2 4.38Å
77L95.1Very high93.1Very high72 Ų7267 Ų6738%0.37737%0.374SS..Hα-helixtrans-59.4-45.6178.9-178.664.2000111.2V73 L74 M79 C80 F81 L118 F122V73-L77 WeakPolarHBondContact O-CB 3.41Å; V73-L77 PolarHBondContact O-N 2.93Å; L74-L77 PolarHBondContact O-N 3.03Å; L77-M79 VanDerWaalsContact C-N 3.34Å; L77-M79 PolarHBondContact O-N 3.03Å; L77-C80 PolarHBondContact O-N 3.29Å; L77-F81 WeakPolarHBondContact O-CB 3.41Å; L77-F81 PolarHBondContact O-N 2.97Å; L77-L118 HydrophobicContact CD1-CD1 4.18Å; L77-F122 HydrophobicContact CB-CD2 4.32Å; L77-F122 HydrophobicContact CB-CE2 4.08Å; L77-F122 HydrophobicContact CD1-CD2 4.12Å; L77-F122 HydrophobicContact CD1-CE2 4.34Å
78S94.8Very high93.5Very high64 Ų6461.5 Ų61.545%0.44834%0.341SS..Hα-helixtrans-58.7-44.3175.9179.60000112L74 T75 L76 F81 I82L74-S78 WeakPolarHBondContact O-CB 3.41Å; L74-S78 PolarHBondContact O-N 3Å; T75-S78 PolarHBondContact O-N 3.48Å; L76-S78 VanDerWaalsContact C-N 3.34Å; L76-S78 PolarHBondContact O-N 2.88Å; S78-F81 WeakPolarHBondContact O-CB 3.46Å; S78-F81 PolarHBondContact O-N 2.94Å; S78-I82 WeakPolarHBondContact O-CG1 3.43Å; S78-I82 PolarHBondContact O-N 3.02Å
79M94.3Very high93.8Very high39 Ų3961.3 Ų61.319%0.19235%0.351CS..Hα-helixtrans-64.3-44.8177.8-68.2-68-126.300112.7M59 Y63 T75 L76 L77 F81 I82 I83M59-M79 HydrophobicContact CB-CE 3.47Å; M59-M79 VanDerWaalsContact CB-CE 3.47Å; M59-M79 HydrophobicContact CE-CE 3.13Å; M59-M79 HydrophobicContact CE-SD 3.5Å; M59-M79 VanDerWaalsContact CE-SD 3.5Å; M59-M79 HydrophobicContact CG-CE 3.62Å; M59-M79 HydrophobicContact SD-CE 3.69Å; Y63-M79 HydrophobicContact CD2-CB 4.26Å; T75-M79 VanDerWaalsContact O-CG 3.28Å; T75-M79 WeakPolarHBondContact O-CG 3.49Å; T75-M79 PolarHBondContact O-N 2.86Å; T75-M79 VanDerWaalsContact O-N 3.09Å; L76-M79 PolarHBondContact O-N 3.43Å; L77-M79 VanDerWaalsContact C-N 3.34Å; L77-M79 PolarHBondContact O-N 3.03Å; M79-F81 VanDerWaalsContact C-N 3.29Å; M79-F81 PolarHBondContact O-N 3.27Å; M79-I82 PolarHBondContact O-N 3.44Å; M79-I83 WeakPolarHBondContact O-CG1 3.43Å; M79-I83 PolarHBondContact O-N 3.48Å; M79-I83 VanDerWaalsContact O-N 3.07Å
80C95.7Very high93.9Very high0 Ų064.4 Ų64.40%036%0.36CS..Hα-helixtrans-63.5-36.8175.9-69.90000111.6L76 L77 I83 A84 L118L76-C80 PolarHBondContact O-N 3.22Å; L76-C80 PolarHBondContact O-SG 3.38Å; L77-C80 PolarHBondContact O-N 3.29Å; C80-I83 PolarHBondContact O-N 3.11Å; C80-A84 VanDerWaalsContact O-CB 3.32Å; C80-A84 WeakPolarHBondContact O-CB 3.38Å; C80-A84 PolarHBondContact O-N 3.46Å; C80-L118 HydrophobicContact CB-CD1 3.8Å
81F96.5Very high94.1Very high107 Ų10761.6 Ų61.647%0.46933%0.332SS..Hα-helixtrans-63.4-45.6175.4-178.9-97000111.9L77 S78 M79 I83 A84 M85 L118L77-F81 WeakPolarHBondContact O-CB 3.41Å; L77-F81 PolarHBondContact O-N 2.97Å; S78-F81 WeakPolarHBondContact O-CB 3.46Å; S78-F81 PolarHBondContact O-N 2.94Å; M79-F81 VanDerWaalsContact C-N 3.29Å; M79-F81 PolarHBondContact O-N 3.27Å; F81-I83 VanDerWaalsContact C-N 3.35Å; F81-I83 PolarHBondContact O-N 2.89Å; F81-A84 PolarHBondContact O-N 3.4Å; F81-M85 HydrophobicContact CD1-CG 4.1Å; F81-M85 HydrophobicContact CD2-CG 4.44Å; F81-M85 HydrophobicContact CE1-CG 3.65Å; F81-M85 HydrophobicContact CE2-CG 4.03Å; F81-M85 HydrophobicContact CE2-SD 4.26Å; F81-M85 HydrophobicContact CG-CG 4.47Å; F81-M85 HydrophobicContact CZ-CG 3.62Å; F81-M85 HydrophobicContact CZ-SD 3.97Å; F81-M85 WeakPolarHBondContact O-CB 3.38Å; F81-M85 WeakPolarHBondContact O-CG 3.34Å; F81-M85 PolarHBondContact O-N 2.97Å; F81-L118 HydrophobicContact CB-CD1 4.08Å; F81-L118 HydrophobicContact CD2-CD2 4.12Å
82I95.3Very high94.4Very high87 Ų8756.3 Ų56.345%0.44631%0.307SS..Hα-helixtrans-60.1-46.2176.2-66.9166.4000110.6S78 M79 A84 M85 V86S78-I82 WeakPolarHBondContact O-CG1 3.43Å; S78-I82 PolarHBondContact O-N 3.02Å; M79-I82 PolarHBondContact O-N 3.44Å; I82-A84 VanDerWaalsContact C-N 3.34Å; I82-A84 PolarHBondContact O-N 2.95Å; I82-M85 PolarHBondContact O-N 3Å; I82-V86 HydrophobicContact CG2-CG2 4.32Å; I82-V86 WeakPolarHBondContact O-CB 3.31Å; I82-V86 VanDerWaalsContact O-CG2 3.27Å; I82-V86 WeakPolarHBondContact O-CG2 3.44Å; I82-V86 PolarHBondContact O-N 3.48Å
83I93.7Very high94.3Very high49 Ų4960 Ų6025%0.25132%0.324SS..Hα-helixtrans-61.3-44.1178.2-67.2168.5000111Y63 M79 C80 F81 T87Y63-I83 HydrophobicContact CE2-CD1 3.82Å; Y63-I83 WeakPolarHBondContact OH-CD1 3.39Å; M79-I83 WeakPolarHBondContact O-CG1 3.43Å; M79-I83 PolarHBondContact O-N 3.48Å; M79-I83 VanDerWaalsContact O-N 3.07Å; C80-I83 PolarHBondContact O-N 3.11Å; F81-I83 VanDerWaalsContact C-N 3.35Å; F81-I83 PolarHBondContact O-N 2.89Å; I83-T87 HydrophobicContact CG2-CG2 4.47Å; I83-T87 WeakPolarHBondContact O-CB 3.45Å; I83-T87 WeakPolarHBondContact O-CG2 3.47Å; I83-T87 PolarHBondContact O-N 2.88Å; I83-T87 PolarHBondContact O-OG1 3.14Å
84A96.5Very high94Very high2 Ų259.9 Ų59.92%0.01732%0.318CS..Hα-helixtrans-61.8-47.4177.800000111.9C80 F81 I82 T87 G88 S114 I117 L118C80-A84 VanDerWaalsContact O-CB 3.32Å; C80-A84 WeakPolarHBondContact O-CB 3.38Å; C80-A84 PolarHBondContact O-N 3.46Å; F81-A84 PolarHBondContact O-N 3.4Å; I82-A84 VanDerWaalsContact C-N 3.34Å; I82-A84 PolarHBondContact O-N 2.95Å; A84-T87 PolarHBondContact O-N 3.27Å; A84-T87 PolarHBondContact O-OG1 3.02Å; A84-G88 PolarHBondContact O-N 3.38Å; A84-S114 WeakPolarHBondContact CB-O 3.46Å; A84-I117 HydrophobicContact CB-CB 4.49Å; A84-I117 HydrophobicContact CB-CG2 4.19Å; A84-L118 HydrophobicContact CB-CB 3.88Å
85M96.3Very high93.7Very high105 Ų10554.9 Ų54.952%0.51729%0.291SS..Hα-helixtrans-63.7-44.9178.8-73-60-64.600112.4F81 I82 G88 G89F81-M85 HydrophobicContact CD1-CG 4.1Å; F81-M85 HydrophobicContact CD2-CG 4.44Å; F81-M85 HydrophobicContact CE1-CG 3.65Å; F81-M85 HydrophobicContact CE2-CG 4.03Å; F81-M85 HydrophobicContact CE2-SD 4.26Å; F81-M85 HydrophobicContact CG-CG 4.47Å; F81-M85 HydrophobicContact CZ-CG 3.62Å; F81-M85 HydrophobicContact CZ-SD 3.97Å; F81-M85 WeakPolarHBondContact O-CB 3.38Å; F81-M85 WeakPolarHBondContact O-CG 3.34Å; F81-M85 PolarHBondContact O-N 2.97Å; I82-M85 PolarHBondContact O-N 3Å; M85-G88 PolarHBondContact O-N 2.97Å; M85-G89 PolarHBondContact O-N 3.41Å
86V95.1Very high93.6Very high85 Ų8554.5 Ų54.552%0.51529%0.289SS..Hα-helixtrans-63.1-47.7178.8170.60000110.7I82 L90I82-V86 HydrophobicContact CG2-CG2 4.32Å; I82-V86 WeakPolarHBondContact O-CB 3.31Å; I82-V86 VanDerWaalsContact O-CG2 3.27Å; I82-V86 WeakPolarHBondContact O-CG2 3.44Å; I82-V86 PolarHBondContact O-N 3.48Å; V86-L90 HydrophobicContact CG1-CD1 4.29Å; V86-L90 WeakPolarHBondContact O-CG 3.34Å; V86-L90 PolarHBondContact O-N 2.93Å; V86-L90 VanDerWaalsContact O-N 3.12Å
87T93Very high93.1Very high37 Ų3760.1 Ų60.123%0.22732%0.315CS..Hα-helixtrans-71.4-33.6-178.856.10000112.5I83 A84 L90 L91I83-T87 HydrophobicContact CG2-CG2 4.47Å; I83-T87 WeakPolarHBondContact O-CB 3.45Å; I83-T87 WeakPolarHBondContact O-CG2 3.47Å; I83-T87 PolarHBondContact O-N 2.88Å; I83-T87 PolarHBondContact O-OG1 3.14Å; A84-T87 PolarHBondContact O-N 3.27Å; A84-T87 PolarHBondContact O-OG1 3.02Å; T87-L90 PolarHBondContact O-N 3.26Å; T87-L91 PolarHBondContact O-N 3.15Å
88G95.4Very high92.3Very high3 Ų359.8 Ų59.83%0.03131%0.313CS..Hα-helixtrans-64.2-45.6172.400000113.6A84 M85 L90 L91 Y92 S114A84-G88 PolarHBondContact O-N 3.38Å; M85-G88 PolarHBondContact O-N 2.97Å; G88-L90 VanDerWaalsContact C-N 3.32Å; G88-L90 PolarHBondContact O-N 3.44Å; G88-L91 WeakPolarHBondContact O-CB 3.39Å; G88-L91 PolarHBondContact O-N 3.33Å; G88-Y92 PolarHBondContact O-N 3.38Å; G88-S114 VanDerWaalsContact CA-OG 3.23Å; G88-S114 WeakPolarHBondContact CA-OG 3.29Å
89G94.7Very high91.6Very high42 Ų4259 Ų5943%0.43330%0.304SS..Hα-helixtrans-62.1-39.9175.500000112.4M85 Y92 H93M85-G89 PolarHBondContact O-N 3.41Å; G89-Y92 PolarHBondContact O-N 2.72Å; G89-H93 WeakPolarHBondContact O-CB 3.16Å; G89-H93 PolarHBondContact O-N 3.47Å
90L92.1Very high91.1Very high117 Ų11766.6 Ų66.661%0.61333%0.33SS*.Hα-helixtrans-62.2-42.5173.1-72.5170000112V86 T87 G88 W94V86-L90 HydrophobicContact CG1-CD1 4.29Å; V86-L90 WeakPolarHBondContact O-CG 3.34Å; V86-L90 PolarHBondContact O-N 2.93Å; V86-L90 VanDerWaalsContact O-N 3.12Å; T87-L90 PolarHBondContact O-N 3.26Å; G88-L90 VanDerWaalsContact C-N 3.32Å; G88-L90 PolarHBondContact O-N 3.44Å; L90-W94 VanDerWaalsContact O-CB 3.25Å; L90-W94 WeakPolarHBondContact O-CB 3.35Å; L90-W94 PolarHBondContact O-N 2.69Å
91L91.8Very high90.6Very high35 Ų3573 Ų7318%0.18336%0.355CS..Hα-helixtrans-64.3-44176.2178.861000111.6T87 G88 W94 M95 Y113T87-L91 PolarHBondContact O-N 3.15Å; G88-L91 WeakPolarHBondContact O-CB 3.39Å; G88-L91 PolarHBondContact O-N 3.33Å; L91-W94 HydrophobicContact CD1-CE3 3.7Å; L91-W94 HydrophobicContact CD1-CZ3 4.05Å; L91-W94 PolarHBondContact O-N 3.4Å; L91-M95 HydrophobicContact CD1-CG 4.21Å; L91-M95 HydrophobicContact CD1-SD 4.33Å; L91-M95 HydrophobicContact CG-SD 4.39Å; L91-M95 WeakPolarHBondContact O-CG 3.42Å; L91-M95 PolarHBondContact O-N 3.09Å; L91-Y113 HydrophobicContact CB-CD1 4.48Å; L91-Y113 HydrophobicContact CD2-CD1 3.68Å; L91-Y113 HydrophobicContact CD2-CD2 3.95Å; L91-Y113 HydrophobicContact CD2-CE1 4.39Å; L91-Y113 HydrophobicContact CD2-CG 3.43Å; L91-Y113 VanDerWaalsContact CD2-CG 3.43Å
92Y94Very high90.4Very high80 Ų8073.1 Ų73.131%0.31436%0.361SS..Hα-helixtrans-58.2-51.7176.1176.7-101.7000111.4G88 G89 W94 M95 T96 S103 A110G88-Y92 PolarHBondContact O-N 3.38Å; G89-Y92 PolarHBondContact O-N 2.72Å; Y92-W94 VanDerWaalsContact C-N 3.26Å; Y92-W94 PolarHBondContact O-N 2.96Å; Y92-M95 PolarHBondContact O-N 3.05Å; Y92-M95 VanDerWaalsContact O-N 3.13Å; Y92-T96 PolarHBondContact O-N 2.98Å; Y92-T96 PolarHBondContact O-OG1 3.29Å; Y92-S103 PolarHBondContact OH-OG 3Å; Y92-A110 HydrophobicContact CD2-CB 4.44Å
93H90.8Very high90.2Very high108 Ų10871.8 Ų71.850%0.536%0.359SS..Hα-helixtrans-59.3-40.6177.5-176.7-74.7000111.4G89 E97G89-H93 WeakPolarHBondContact O-CB 3.16Å; G89-H93 PolarHBondContact O-N 3.47Å; H93-E97 VanDerWaalsContact O-CB 3.31Å; H93-E97 WeakPolarHBondContact O-CB 3.32Å; H93-E97 PolarHBondContact O-N 3.29Å
94W87.4Confident90.2Very high51 Ų5171.3 Ų71.319%0.19337%0.366CS..Iπ-helixtrans-66.5-36.4177.2-176.249.1000112.6L90 L91 Y92 I98 L99 A266L90-W94 VanDerWaalsContact O-CB 3.25Å; L90-W94 WeakPolarHBondContact O-CB 3.35Å; L90-W94 PolarHBondContact O-N 2.69Å; L91-W94 HydrophobicContact CD1-CE3 3.7Å; L91-W94 HydrophobicContact CD1-CZ3 4.05Å; L91-W94 PolarHBondContact O-N 3.4Å; Y92-W94 VanDerWaalsContact C-N 3.26Å; Y92-W94 PolarHBondContact O-N 2.96Å; W94-I98 VanDerWaalsContact CD1-CG2 3.41Å; W94-I98 HydrophobicContact CG-CB 4.43Å; W94-I98 HydrophobicContact CG-CD1 4.46Å; W94-I98 CarbonylContact O-C 3.56Å; W94-I98 VanDerWaalsContact O-C 3.29Å; W94-I98 WeakPolarHBondContact O-CA 3.4Å; W94-I98 WeakPolarHBondContact O-CB 3.32Å; W94-I98 PolarHBondContact O-N 3.16Å; W94-L99 PolarHBondContact O-N 2.81Å; W94-A266 VanDerWaalsContact CH2-CA 3.41Å; W94-A266 HydrophobicContact CH2-CB 3.26Å; W94-A266 HydrophobicContact CZ2-CB 3.44Å; W94-A266 VanDerWaalsContact CZ2-CB 3.44Å
95M87.7Confident90Very high28 Ų2874.6 Ų74.614%0.13839%0.386CS..Iπ-helixtrans-72.7-44.4175.7-72.3-172.863.300113.1L91 Y92 L99 R100 Y101 S106 A109L91-M95 HydrophobicContact CD1-CG 4.21Å; L91-M95 HydrophobicContact CD1-SD 4.33Å; L91-M95 HydrophobicContact CG-SD 4.39Å; L91-M95 WeakPolarHBondContact O-CG 3.42Å; L91-M95 PolarHBondContact O-N 3.09Å; Y92-M95 PolarHBondContact O-N 3.05Å; Y92-M95 VanDerWaalsContact O-N 3.13Å; M95-L99 HydrophobicContact CG-CD1 4.33Å; M95-L99 CarbonylContact O-C 3.29Å; M95-L99 WeakPolarHBondContact O-CA 3.49Å; M95-L99 WeakPolarHBondContact O-CB 3.33Å; M95-L99 PolarHBondContact O-N 2.62Å; M95-L99 VanDerWaalsContact O-N 3.16Å; M95-R100 PolarHBondContact O-N 3.09Å; M95-R100 VanDerWaalsContact O-N 3.09Å; M95-Y101 HydrophobicContact CE-CD2 4.2Å; M95-Y101 HydrophobicContact CE-CG 4.35Å; M95-Y101 PolarHBondContact O-N 3Å; M95-Y101 VanDerWaalsContact O-N 3.14Å; M95-S106 WeakPolarHBondContact CB-OG 3.35Å; M95-A109 HydrophobicContact CE-CB 3.92Å; M95-A109 HydrophobicContact SD-CB 3.71Å
96T89.8Confident90Very high31 Ų3169.6 Ų69.619%0.1936%0.362CS..Iπ-helixtrans-75.4-57.7-176.1-52.60000111.9Y92 R100 S106Y92-T96 PolarHBondContact O-N 2.98Å; Y92-T96 PolarHBondContact O-OG1 3.29Å; T96-R100 VanDerWaalsContact O-CA 3.23Å; T96-R100 WeakPolarHBondContact O-CA 3.34Å; T96-R100 PolarHBondContact O-N 2.78Å; T96-S106 WeakPolarHBondContact OG1-CB 3.48Å
97E84.8Confident89.9Confident120 Ų12068 Ų6856%0.56135%0.354SS*.Iπ-helixtrans-77.5-42.3-175-62.8-59.8146.500111.3H93H93-E97 VanDerWaalsContact O-CB 3.31Å; H93-E97 WeakPolarHBondContact O-CB 3.32Å; H93-E97 PolarHBondContact O-N 3.29Å
98I78.5Confident90.1Very high65 Ų6570.3 Ų70.333%0.33337%0.368SS..Iπ-helixtrans-97.8-22.2-169.5-59.5164.7000111.8W94 R262W94-I98 VanDerWaalsContact CD1-CG2 3.41Å; W94-I98 HydrophobicContact CG-CB 4.43Å; W94-I98 HydrophobicContact CG-CD1 4.46Å; W94-I98 CarbonylContact O-C 3.56Å; W94-I98 VanDerWaalsContact O-C 3.29Å; W94-I98 WeakPolarHBondContact O-CA 3.4Å; W94-I98 WeakPolarHBondContact O-CB 3.32Å; W94-I98 PolarHBondContact O-N 3.16Å; I98-R262 HydrophobicContact CG2-CB 4.37Å; I98-R262 HydrophobicContact CG2-CG 3.67Å; I98-R262 WeakPolarHBondContact O-CD 3.43Å; I98-R262 WeakPolarHBondContact O-CG 3.33Å; I98-R262 PolarHBondContact O-NE 3.24Å; I98-R262 PolarHBondContact O-NH1 2.88Å; I98-R262 PolarHBondContact O-NH2 2.93Å; I98-R262 VanDerWaalsContact O-NH2 3.14Å
99L80.8Confident90Very high49 Ų4971.9 Ų71.926%0.25738%0.381SS..Hα-helixtrans-108.8-8.6172.2-69.4163.4000112.7W94 M95 Y101 R262W94-L99 PolarHBondContact O-N 2.81Å; M95-L99 HydrophobicContact CG-CD1 4.33Å; M95-L99 CarbonylContact O-C 3.29Å; M95-L99 WeakPolarHBondContact O-CA 3.49Å; M95-L99 WeakPolarHBondContact O-CB 3.33Å; M95-L99 PolarHBondContact O-N 2.62Å; M95-L99 VanDerWaalsContact O-N 3.16Å; L99-Y101 HydrophobicContact CB-CD2 3.44Å; L99-Y101 VanDerWaalsContact CB-CD2 3.44Å; L99-Y101 HydrophobicContact CB-CE2 3.72Å; L99-Y101 HydrophobicContact CD1-CD2 4.29Å; L99-Y101 HydrophobicContact CD1-CE2 4.13Å; L99-Y101 HydrophobicContact CG-CD2 4.45Å; L99-Y101 HydrophobicContact CG-CE2 4.4Å; L99-Y101 PolarHBondContact O-N 3.39Å; L99-R262 HydrophobicContact CD2-CB 3.89Å; L99-R262 HydrophobicContact CD2-CG 4.49Å; L99-R262 PolarHBondContact O-NH1 3.44Å
100R84.3Confident90.1Very high198 Ų19870.2 Ų70.275%0.74736%0.363SS*.  trans56.832.6-177.5-58.518073.6173.93.9112.5M95 T96M95-R100 PolarHBondContact O-N 3.09Å; M95-R100 VanDerWaalsContact O-N 3.09Å; T96-R100 VanDerWaalsContact O-CA 3.23Å; T96-R100 WeakPolarHBondContact O-CA 3.34Å; T96-R100 PolarHBondContact O-N 2.78Å
101Y85Confident90.3Very high134 Ų13468.2 Ų68.253%0.52536%0.358SS..  trans-73.2154.3168.9-82-75.3000110.6M95 L99 S106M95-Y101 HydrophobicContact CE-CD2 4.2Å; M95-Y101 HydrophobicContact CE-CG 4.35Å; M95-Y101 PolarHBondContact O-N 3Å; M95-Y101 VanDerWaalsContact O-N 3.14Å; L99-Y101 HydrophobicContact CB-CD2 3.44Å; L99-Y101 VanDerWaalsContact CB-CD2 3.44Å; L99-Y101 HydrophobicContact CB-CE2 3.72Å; L99-Y101 HydrophobicContact CD1-CD2 4.29Å; L99-Y101 HydrophobicContact CD1-CE2 4.13Å; L99-Y101 HydrophobicContact CG-CD2 4.45Å; L99-Y101 HydrophobicContact CG-CE2 4.4Å; L99-Y101 PolarHBondContact O-N 3.39Å; Y101-S106 WeakPolarHBondContact CB-OG 3.4Å
102D91.4Very high90.5Very high110 Ų11071.6 Ų71.659%0.58838%0.376SS*.  trans-58.1144.8174.5176.966.9000111.3G104 T105 S106D102-G104 VanDerWaalsContact C-N 3.27Å; D102-G104 PolarHBondContact O-N 3.09Å; D102-G104 WeakPolarHBondContact OD2-CA 3.48Å; D102-G104 PolarHBondContact OD2-N 2.97Å; D102-T105 HydrophobicContact CB-CG2 4.38Å; D102-T105 PolarHBondContact O-N 3.18Å; D102-T105 PolarHBondContact O-OG1 3.03Å; D102-S106 WeakPolarHBondContact O-CB 3.23Å; D102-S106 PolarHBondContact O-N 3.31Å; D102-S106 PolarHBondContact O-OG 3.26Å
103S92.1Very high90.6Very high58 Ų5871.6 Ų71.641%0.40638%0.375SS..Hα-helixtrans-60.7-35.9-176-175.60000112.4Y92 S107Y92-S103 PolarHBondContact OH-OG 3Å; S103-S107 WeakPolarHBondContact O-CB 3.46Å; S103-S107 PolarHBondContact O-N 3.29Å
104G93.9Very high90.9Very high39 Ų3967.3 Ų67.340%0.40236%0.358SS..Hα-helixtrans-66.3-45.2177.800000112.1D102 T108D102-G104 VanDerWaalsContact C-N 3.27Å; D102-G104 PolarHBondContact O-N 3.09Å; D102-G104 WeakPolarHBondContact OD2-CA 3.48Å; D102-G104 PolarHBondContact OD2-N 2.97Å; G104-T108 WeakPolarHBondContact O-CB 3.46Å; G104-T108 PolarHBondContact O-N 2.93Å; G104-T108 PolarHBondContact O-OG1 3.11Å
105T92.2Very high91.4Very high72 Ų7268.6 Ų68.644%0.44237%0.371SS..Hα-helixtrans-65.6-43.6177.9630000112D102 T108 A109D102-T105 HydrophobicContact CB-CG2 4.38Å; D102-T105 PolarHBondContact O-N 3.18Å; D102-T105 PolarHBondContact O-OG1 3.03Å; T105-T108 PolarHBondContact O-N 2.98Å; T105-A109 WeakPolarHBondContact O-CB 3.38Å; T105-A109 PolarHBondContact O-N 3.06Å
106S94.4Very high91.8Very high0 Ų069.8 Ų69.80%038%0.382CS..Hα-helixtrans-65.2-43.1178.7-57.90000111.9M95 T96 Y101 D102 A110M95-S106 WeakPolarHBondContact CB-OG 3.35Å; T96-S106 WeakPolarHBondContact OG1-CB 3.48Å; Y101-S106 WeakPolarHBondContact CB-OG 3.4Å; D102-S106 WeakPolarHBondContact O-CB 3.23Å; D102-S106 PolarHBondContact O-N 3.31Å; D102-S106 PolarHBondContact O-OG 3.26Å; S106-A110 VanDerWaalsContact O-CB 3.29Å; S106-A110 WeakPolarHBondContact O-CB 3.18Å; S106-A110 PolarHBondContact O-N 2.94Å
107S94.9Very high92.1Very high51 Ų5169.2 Ų69.236%0.35738%0.378SS..Hα-helixtrans-63.3-46.4177.5-177.40000111.3S103 A109 A110 C111S103-S107 WeakPolarHBondContact O-CB 3.46Å; S103-S107 PolarHBondContact O-N 3.29Å; S107-A109 PolarHBondContact O-N 3Å; S107-A110 PolarHBondContact O-N 3.01Å; S107-C111 WeakPolarHBondContact O-CB 3.25Å; S107-C111 PolarHBondContact O-N 2.71Å; S107-C111 PolarHBondContact O-SG 3.41Å; S107-C111 VanDerWaalsContact O-SG 3.35Å
108T95.3Very high92.6Very high85 Ų8564.9 Ų64.952%0.52136%0.358SS..Hα-helixtrans-60.5-47.6178.7-55.50000111.5G104 T105 C111 I112G104-T108 WeakPolarHBondContact O-CB 3.46Å; G104-T108 PolarHBondContact O-N 2.93Å; G104-T108 PolarHBondContact O-OG1 3.11Å; T105-T108 PolarHBondContact O-N 2.98Å; T108-C111 PolarHBondContact O-N 2.79Å; T108-I112 HydrophobicContact CG2-CD1 3.98Å; T108-I112 WeakPolarHBondContact O-CG1 3.46Å; T108-I112 PolarHBondContact O-N 3.43Å
109A94.6Very high93.4Very high36 Ų3667.6 Ų67.630%0.29837%0.368SS..Hα-helixtrans-62.2-43.5177.800000112.3M95 T105 S107 I112 Y113M95-A109 HydrophobicContact CE-CB 3.92Å; M95-A109 HydrophobicContact SD-CB 3.71Å; T105-A109 WeakPolarHBondContact O-CB 3.38Å; T105-A109 PolarHBondContact O-N 3.06Å; S107-A109 PolarHBondContact O-N 3Å; A109-I112 PolarHBondContact O-N 3.18Å; A109-Y113 WeakPolarHBondContact O-CB 3.42Å; A109-Y113 PolarHBondContact O-N 2.87Å
110A96.3Very high94.1Very high8 Ų869.3 Ų69.37%0.06638%0.377CS..Hα-helixtrans-64.2-39.5177.500000112.7Y92 S106 S107 Y113 S114Y92-A110 HydrophobicContact CD2-CB 4.44Å; S106-A110 VanDerWaalsContact O-CB 3.29Å; S106-A110 WeakPolarHBondContact O-CB 3.18Å; S106-A110 PolarHBondContact O-N 2.94Å; S107-A110 PolarHBondContact O-N 3.01Å; A110-Y113 PolarHBondContact O-N 2.63Å; A110-S114 WeakPolarHBondContact O-CB 3.5Å; A110-S114 PolarHBondContact O-N 3.19Å; A110-S114 PolarHBondContact O-OG 3.32Å
111C96.6Very high94.6Very high74 Ų7459.9 Ų59.950%0.534%0.341SS..Hα-helixtrans-63.3-49.4174.8-760000111.7S107 T108 Y113 S114 V115S107-C111 WeakPolarHBondContact O-CB 3.25Å; S107-C111 PolarHBondContact O-N 2.71Å; S107-C111 PolarHBondContact O-SG 3.41Å; S107-C111 VanDerWaalsContact O-SG 3.35Å; T108-C111 PolarHBondContact O-N 2.79Å; C111-Y113 VanDerWaalsContact C-N 3.31Å; C111-Y113 PolarHBondContact O-N 3.48Å; C111-S114 PolarHBondContact O-N 3.27Å; C111-V115 WeakPolarHBondContact O-CG2 3.42Å; C111-V115 PolarHBondContact O-N 2.9Å
112I96.8Very high95Very high107 Ų10756.3 Ų56.355%0.54933%0.328SS..Hα-helixtrans-58.4-46.1177.6-67.9167.2000110.4T108 A109 S116T108-I112 HydrophobicContact CG2-CD1 3.98Å; T108-I112 WeakPolarHBondContact O-CG1 3.46Å; T108-I112 PolarHBondContact O-N 3.43Å; A109-I112 PolarHBondContact O-N 3.18Å; I112-S116 WeakPolarHBondContact O-CB 3.48Å; I112-S116 PolarHBondContact O-N 3.4Å; I112-S116 PolarHBondContact O-OG 3.23Å
113Y95.7Very high95.1Very high79 Ų7956.9 Ų56.931%0.3133%0.331SS..Hα-helixtrans-60.3-47.1176.4170.1-93.6000112L91 A109 A110 C111 V115 S116 I117L91-Y113 HydrophobicContact CB-CD1 4.48Å; L91-Y113 HydrophobicContact CD2-CD1 3.68Å; L91-Y113 HydrophobicContact CD2-CD2 3.95Å; L91-Y113 HydrophobicContact CD2-CE1 4.39Å; L91-Y113 HydrophobicContact CD2-CG 3.43Å; L91-Y113 VanDerWaalsContact CD2-CG 3.43Å; A109-Y113 WeakPolarHBondContact O-CB 3.42Å; A109-Y113 PolarHBondContact O-N 2.87Å; A110-Y113 PolarHBondContact O-N 2.63Å; C111-Y113 VanDerWaalsContact C-N 3.31Å; C111-Y113 PolarHBondContact O-N 3.48Å; Y113-V115 PolarHBondContact O-N 3.31Å; Y113-S116 WeakPolarHBondContact O-CB 3.38Å; Y113-S116 PolarHBondContact O-N 2.92Å; Y113-I117 HydrophobicContact CD1-CG1 4.3Å; Y113-I117 HydrophobicContact CD2-CG1 4.11Å; Y113-I117 HydrophobicContact CE1-CG1 3.84Å; Y113-I117 HydrophobicContact CE2-CD1 3.99Å; Y113-I117 HydrophobicContact CE2-CG1 3.64Å; Y113-I117 HydrophobicContact CG-CG1 4.42Å; Y113-I117 VanDerWaalsContact CZ-CG1 3.49Å; Y113-I117 WeakPolarHBondContact O-CG1 3.3Å; Y113-I117 PolarHBondContact O-N 3.29Å
114S96.9Very high95.2Very high19 Ų1956.6 Ų56.613%0.13333%0.329CS..Hα-helixtrans-62.8-46.3-177.7-56.70000111.5A84 G88 A110 C111 S116 I117 L118A84-S114 WeakPolarHBondContact CB-O 3.46Å; G88-S114 VanDerWaalsContact CA-OG 3.23Å; G88-S114 WeakPolarHBondContact CA-OG 3.29Å; A110-S114 WeakPolarHBondContact O-CB 3.5Å; A110-S114 PolarHBondContact O-N 3.19Å; A110-S114 PolarHBondContact O-OG 3.32Å; C111-S114 PolarHBondContact O-N 3.27Å; S114-S116 VanDerWaalsContact C-N 3.32Å; S114-S116 PolarHBondContact O-N 3.27Å; S114-I117 PolarHBondContact O-N 3.35Å; S114-L118 WeakPolarHBondContact O-CB 3.32Å; S114-L118 PolarHBondContact O-N 3.48Å
115V97.3Very high95.2Very high77 Ų7755.8 Ų55.847%0.46731%0.314SS..Hα-helixtrans-61.2-44.2176.2174.10000110.3C111 Y113 L118 F119C111-V115 WeakPolarHBondContact O-CG2 3.42Å; C111-V115 PolarHBondContact O-N 2.9Å; Y113-V115 PolarHBondContact O-N 3.31Å; V115-L118 WeakPolarHBondContact O-CB 3.15Å; V115-L118 PolarHBondContact O-N 2.96Å; V115-F119 HydrophobicContact CG1-CD2 3.65Å; V115-F119 HydrophobicContact CG1-CE2 3.52Å; V115-F119 WeakPolarHBondContact O-CD2 3.45Å; V115-F119 PolarHBondContact O-N 3.48Å; V115-F119 VanDerWaalsContact O-N 3.08Å
116S95.8Very high95.3Very high53 Ų5355.5 Ų55.537%0.37131%0.313SS..Hα-helixtrans-61.2-47.5177.5-58.10000111.9I112 Y113 S114 L118 F119 L120I112-S116 WeakPolarHBondContact O-CB 3.48Å; I112-S116 PolarHBondContact O-N 3.4Å; I112-S116 PolarHBondContact O-OG 3.23Å; Y113-S116 WeakPolarHBondContact O-CB 3.38Å; Y113-S116 PolarHBondContact O-N 2.92Å; S114-S116 VanDerWaalsContact C-N 3.32Å; S114-S116 PolarHBondContact O-N 3.27Å; S116-L118 VanDerWaalsContact C-N 3.34Å; S116-L118 PolarHBondContact O-N 2.98Å; S116-F119 PolarHBondContact O-N 3.03Å; S116-L120 VanDerWaalsContact O-CB 3.24Å; S116-L120 WeakPolarHBondContact O-CB 3.27Å; S116-L120 WeakPolarHBondContact O-CG 3.39Å; S116-L120 PolarHBondContact O-N 3.42Å
117I95.6Very high95.3Very high19 Ų1957.8 Ų57.810%0.09733%0.325CS..Hα-helixtrans-64.2-38178.2-71.1-63.5000111.7A84 Y113 S114 S121 L131A84-I117 HydrophobicContact CB-CB 4.49Å; A84-I117 HydrophobicContact CB-CG2 4.19Å; Y113-I117 HydrophobicContact CD1-CG1 4.3Å; Y113-I117 HydrophobicContact CD2-CG1 4.11Å; Y113-I117 HydrophobicContact CE1-CG1 3.84Å; Y113-I117 HydrophobicContact CE2-CD1 3.99Å; Y113-I117 HydrophobicContact CE2-CG1 3.64Å; Y113-I117 HydrophobicContact CG-CG1 4.42Å; Y113-I117 VanDerWaalsContact CZ-CG1 3.49Å; Y113-I117 WeakPolarHBondContact O-CG1 3.3Å; Y113-I117 PolarHBondContact O-N 3.29Å; S114-I117 PolarHBondContact O-N 3.35Å; I117-S121 WeakPolarHBondContact O-CB 3.48Å; I117-S121 PolarHBondContact O-N 3.07Å; I117-S121 PolarHBondContact O-OG 3.16Å; I117-L131 HydrophobicContact CG2-CD1 4.45Å
118L96.8Very high95.3Very high30 Ų3055.5 Ų55.516%0.15731%0.309CS..Hα-helixtrans-59-56175.917457.6000111L77 C80 F81 A84 S114 V115 S116 F122L77-L118 HydrophobicContact CD1-CD1 4.18Å; C80-L118 HydrophobicContact CB-CD1 3.8Å; F81-L118 HydrophobicContact CB-CD1 4.08Å; F81-L118 HydrophobicContact CD2-CD2 4.12Å; A84-L118 HydrophobicContact CB-CB 3.88Å; S114-L118 WeakPolarHBondContact O-CB 3.32Å; S114-L118 PolarHBondContact O-N 3.48Å; V115-L118 WeakPolarHBondContact O-CB 3.15Å; V115-L118 PolarHBondContact O-N 2.96Å; S116-L118 VanDerWaalsContact C-N 3.34Å; S116-L118 PolarHBondContact O-N 2.98Å; L118-F122 VanDerWaalsContact O-CB 3.24Å; L118-F122 WeakPolarHBondContact O-CB 3.36Å; L118-F122 PolarHBondContact O-N 2.89Å
119F95.7Very high95.3Very high121 Ų12151.5 Ų51.553%0.53128%0.284SS..Hα-helixtrans-64.7-47.4-178.7-76.9-66.6000111.9V115 S116 S121 F122 L123V115-F119 HydrophobicContact CG1-CD2 3.65Å; V115-F119 HydrophobicContact CG1-CE2 3.52Å; V115-F119 WeakPolarHBondContact O-CD2 3.45Å; V115-F119 PolarHBondContact O-N 3.48Å; V115-F119 VanDerWaalsContact O-N 3.08Å; S116-F119 PolarHBondContact O-N 3.03Å; F119-S121 PolarHBondContact O-N 3.4Å; F119-F122 PolarHBondContact O-N 3.16Å; F119-L123 WeakPolarHBondContact O-CB 3.44Å; F119-L123 VanDerWaalsContact O-CG 3.28Å; F119-L123 WeakPolarHBondContact O-CG 3.32Å; F119-L123 PolarHBondContact O-N 2.88Å
120L94.9Very high95.4Very high85 Ų8550.3 Ų50.345%0.44527%0.274SS..Hα-helixtrans-64.8-39.9-179.2-67.6172.3000111.7S116 C124 L127S116-L120 VanDerWaalsContact O-CB 3.24Å; S116-L120 WeakPolarHBondContact O-CB 3.27Å; S116-L120 WeakPolarHBondContact O-CG 3.39Å; S116-L120 PolarHBondContact O-N 3.42Å; L120-C124 WeakPolarHBondContact O-CA 3.45Å; L120-C124 WeakPolarHBondContact O-CB 3.39Å; L120-C124 PolarHBondContact O-N 3.28Å; L120-L127 HydrophobicContact CB-CD2 3.38Å; L120-L127 HydrophobicContact CD1-CD2 4.45Å; L120-L127 HydrophobicContact CG-CD2 4.49Å
121S93.5Very high95.3Very high0 Ų051.4 Ų51.40%028%0.278CS..Hα-helixtrans-70.4-35.1177.6-56.50000111.7I117 F119 R128 L131I117-S121 WeakPolarHBondContact O-CB 3.48Å; I117-S121 PolarHBondContact O-N 3.07Å; I117-S121 PolarHBondContact O-OG 3.16Å; F119-S121 PolarHBondContact O-N 3.4Å; S121-R128 WeakPolarHBondContact O-CD 3.28Å; S121-R128 WeakPolarHBondContact O-CG 3.38Å; S121-R128 PolarHBondContact O-NE 3.28Å; S121-R128 VanDerWaalsContact O-NE 3.14Å; S121-L131 WeakPolarHBondContact OG-CD1 3.48Å
122F94.3Very high95.2Very high59 Ų5949.5 Ų49.526%0.25926%0.264SS..Hα-helixtrans-67.6-46.4176.4-177.8-103.7000111.9V73 L76 L77 L118 F119V73-F122 HydrophobicContact CG1-CE2 4.13Å; V73-F122 HydrophobicContact CG1-CZ 3.89Å; L76-F122 HydrophobicContact CD2-CD2 4.13Å; L76-F122 HydrophobicContact CD2-CE2 4.22Å; L76-F122 HydrophobicContact CG-CD2 4.14Å; L76-F122 HydrophobicContact CG-CE2 4.38Å; L77-F122 HydrophobicContact CB-CD2 4.32Å; L77-F122 HydrophobicContact CB-CE2 4.08Å; L77-F122 HydrophobicContact CD1-CD2 4.12Å; L77-F122 HydrophobicContact CD1-CE2 4.34Å; L118-F122 VanDerWaalsContact O-CB 3.24Å; L118-F122 WeakPolarHBondContact O-CB 3.36Å; L118-F122 PolarHBondContact O-N 2.89Å; F119-F122 PolarHBondContact O-N 3.16Å
123L93.8Very high95.1Very high123 Ų12344.4 Ų44.464%0.64424%0.238SC*.Hα-helixtrans-83.5-38.3-174.9-61.5174.3000113.3F119F119-L123 WeakPolarHBondContact O-CB 3.44Å; F119-L123 VanDerWaalsContact O-CG 3.28Å; F119-L123 WeakPolarHBondContact O-CG 3.32Å; F119-L123 PolarHBondContact O-N 2.88Å
124C94.6Very high95Very high52 Ų5242 Ų4235%0.35123%0.23SC..  trans-100.5100.1-173-54.30000111.4L120 L127 R128L120-C124 WeakPolarHBondContact O-CA 3.45Å; L120-C124 WeakPolarHBondContact O-CB 3.39Å; L120-C124 PolarHBondContact O-N 3.28Å; C124-L127 HydrophobicContact CB-CB 3.96Å; C124-L127 WeakPolarHBondContact O-CB 3.42Å; C124-L127 PolarHBondContact O-N 3.34Å; C124-L127 VanDerWaalsContact O-N 3.16Å; C124-R128 PolarHBondContact O-N 3.17Å
125H93.5Very high94.7Very high21 Ų2147.5 Ų47.510%0.09726%0.257CS..Hα-helixtrans-54.6-44.2176.5172.4-95.3000114.9S64 K65 P66 L127 R128 F464 F465S64-H125 PolarHBondContact O-NE2 2.95Å; K65-H125 PolarHBondContact O-CD2 3.07Å; P66-H125 WeakPolarHBondContact CA-CD2 3.22Å; H125-L127 VanDerWaalsContact C-N 3.27Å; H125-L127 PolarHBondContact O-N 2.97Å; H125-R128 PolarHBondContact O-N 3.4Å; H125-F464 AromaticContact CD2-CD1 3.94Å; H125-F464 AromaticContact CE1-CD1 3.9Å; H125-F464 PolarHBondContact CE1-O 2.93Å; H125-F464 AromaticContact NE2-CD1 3.46Å; H125-F464 WeakPolarHBondContact NE2-CD1 3.17Å; H125-F464 PolarHBondContact NE2-O 3Å; H125-F465 AromaticContact CE1-CZ 3.97Å; H125-F465 AromaticContact ND1-CZ 3.84Å
126P94.4Very high94.6Very high66 Ų6644.5 Ų44.543%0.42924%0.239SC..Hα-helixtrans-63.4-32.2178.2-23.234.3000113.2C129 V130 L280 F465P126-C129 WeakPolarHBondContact O-CB 3.4Å; P126-C129 PolarHBondContact O-N 2.93Å; P126-V130 WeakPolarHBondContact O-CG2 3.47Å; P126-V130 PolarHBondContact O-N 3.15Å; P126-L280 HydrophobicContact CB-CD2 4.29Å; P126-L280 WeakPolarHBondContact O-CD2 3.38Å; P126-F465 HydrophobicContact CB-CZ 4.19Å; P126-F465 HydrophobicContact CG-CZ 4.18Å
127L94Very high94.5Very high48 Ų4842 Ų4225%0.25122%0.222SC..Hα-helixtrans-66.1-41.3-179.6-176.665.2000111.5L120 C124 H125 C129 V130 L131L120-L127 HydrophobicContact CB-CD2 3.38Å; L120-L127 HydrophobicContact CD1-CD2 4.45Å; L120-L127 HydrophobicContact CG-CD2 4.49Å; C124-L127 HydrophobicContact CB-CB 3.96Å; C124-L127 WeakPolarHBondContact O-CB 3.42Å; C124-L127 PolarHBondContact O-N 3.34Å; C124-L127 VanDerWaalsContact O-N 3.16Å; H125-L127 VanDerWaalsContact C-N 3.27Å; H125-L127 PolarHBondContact O-N 2.97Å; L127-C129 PolarHBondContact O-N 3.01Å; L127-V130 PolarHBondContact O-N 2.96Å; L127-V130 VanDerWaalsContact O-N 3.07Å; L127-L131 HydrophobicContact CD1-CG 4.45Å; L127-L131 HydrophobicContact CG-CD1 4.26Å; L127-L131 HydrophobicContact CG-CG 4.33Å; L127-L131 WeakPolarHBondContact O-CG 3.31Å; L127-L131 PolarHBondContact O-N 3.47Å
128R94.9Very high94.3Very high4 Ų443.8 Ų43.82%0.01523%0.231CC..Hα-helixtrans-54.4-42173.1-69.7-176.4-91.9154.1-7111.9Y63 K65 S121 C124 H125 T132 F464Y63-R128 HydrophobicContact CE1-CB 4.27Å; Y63-R128 HydrophobicContact CE2-CB 4.37Å; Y63-R128 HydrophobicContact CE2-CG 4.13Å; Y63-R128 PolarHBondContact O-NH1 2.98Å; Y63-R128 PolarHBondContact OH-O 2.85Å; K65-R128 PolarHBondContact O-NH1 3.34Å; K65-R128 PolarHBondContact O-NH2 3.47Å; S121-R128 WeakPolarHBondContact O-CD 3.28Å; S121-R128 WeakPolarHBondContact O-CG 3.38Å; S121-R128 PolarHBondContact O-NE 3.28Å; S121-R128 VanDerWaalsContact O-NE 3.14Å; C124-R128 PolarHBondContact O-N 3.17Å; H125-R128 PolarHBondContact O-N 3.4Å; R128-T132 WeakPolarHBondContact O-CB 3.25Å; R128-T132 PolarHBondContact O-N 3.11Å; R128-T132 PolarHBondContact O-OG1 3.13Å; R128-F464 HydrophobicContact CB-CE1 3.58Å; R128-F464 HydrophobicContact CB-CZ 4.17Å
129C95.7Very high94.1Very high0 Ų043 Ų430%023%0.231CC..Hα-helixtrans-63.2-48.6176-167.20000110.9P126 L127 L131 T132 M133 L280 F464 F465P126-C129 WeakPolarHBondContact O-CB 3.4Å; P126-C129 PolarHBondContact O-N 2.93Å; L127-C129 PolarHBondContact O-N 3.01Å; C129-L131 PolarHBondContact O-N 3.12Å; C129-T132 PolarHBondContact O-N 2.99Å; C129-M133 WeakPolarHBondContact O-CB 3.3Å; C129-M133 WeakPolarHBondContact O-CG 3.26Å; C129-M133 PolarHBondContact O-N 2.81Å; C129-L280 HydrophobicContact CB-CD1 4.44Å; C129-L280 HydrophobicContact CB-CD2 3.83Å; C129-F464 HydrophobicContact CB-CB 4.11Å; C129-F464 HydrophobicContact CB-CD1 3.58Å; C129-F464 HydrophobicContact CB-CD2 4.12Å; C129-F464 HydrophobicContact CB-CE1 3.99Å; C129-F464 HydrophobicContact CB-CE2 4.45Å; C129-F464 HydrophobicContact CB-CG 3.66Å; C129-F464 HydrophobicContact CB-CZ 4.38Å; C129-F465 HydrophobicContact CB-CE2 4.3Å
130V96.1Very high93.9Very high12 Ų1237.4 Ų37.47%0.07321%0.206CC..Hα-helixtrans-58-48.6177.9175.30000111.5P126 L127 T132 M133 I134 I273 A277 L280P126-V130 WeakPolarHBondContact O-CG2 3.47Å; P126-V130 PolarHBondContact O-N 3.15Å; L127-V130 PolarHBondContact O-N 2.96Å; L127-V130 VanDerWaalsContact O-N 3.07Å; V130-T132 VanDerWaalsContact C-N 3.31Å; V130-T132 PolarHBondContact O-N 3.21Å; V130-M133 WeakPolarHBondContact O-CA 3.46Å; V130-M133 WeakPolarHBondContact O-CB 3.39Å; V130-M133 PolarHBondContact O-N 3.46Å; V130-I134 WeakPolarHBondContact O-CG1 3.35Å; V130-I134 PolarHBondContact O-N 3.39Å; V130-I134 VanDerWaalsContact O-N 3.15Å; V130-I273 HydrophobicContact CG1-CG2 4.4Å; V130-A277 HydrophobicContact CG1-CB 4.31Å; V130-A277 HydrophobicContact CG2-CB 4.19Å; V130-L280 HydrophobicContact CG2-CB 4.4Å; V130-L280 HydrophobicContact CG2-CD2 3.6Å
131L93.9Very high93.7Very high31 Ų3138.3 Ų38.316%0.16221%0.207CC..Hα-helixtrans-58.1-43.9178.8-69.2175.8000111.7I117 S121 L127 C129 M133 I134I117-L131 HydrophobicContact CG2-CD1 4.45Å; S121-L131 WeakPolarHBondContact OG-CD1 3.48Å; L127-L131 HydrophobicContact CD1-CG 4.45Å; L127-L131 HydrophobicContact CG-CD1 4.26Å; L127-L131 HydrophobicContact CG-CG 4.33Å; L127-L131 WeakPolarHBondContact O-CG 3.31Å; L127-L131 PolarHBondContact O-N 3.47Å; C129-L131 PolarHBondContact O-N 3.12Å; L131-M133 PolarHBondContact O-N 3.29Å; L131-I134 HydrophobicContact CD2-CD1 4.03Å; L131-I134 PolarHBondContact O-N 3.06Å
132T94.6Very high93.5Very high33 Ų3338.4 Ų38.420%0.20221%0.207CC..Hα-helixtrans-66.6-29.4176.6-520000112.4W60 Y63 R128 C129 V130 P136 V460W60-T132 HydrophobicContact CH2-CG2 3.74Å; W60-T132 HydrophobicContact CZ3-CG2 3.91Å; Y63-T132 WeakPolarHBondContact CE1-OG1 3.3Å; R128-T132 WeakPolarHBondContact O-CB 3.25Å; R128-T132 PolarHBondContact O-N 3.11Å; R128-T132 PolarHBondContact O-OG1 3.13Å; C129-T132 PolarHBondContact O-N 2.99Å; V130-T132 VanDerWaalsContact C-N 3.31Å; V130-T132 PolarHBondContact O-N 3.21Å; T132-P136 WeakPolarHBondContact O-CD 3.42Å; T132-V460 HydrophobicContact CG2-CG1 3.92Å; T132-V460 HydrophobicContact CG2-CG2 4.32Å
133M94.6Very high93.3Very high0 Ų035.7 Ų35.70%020%0.196CC..Hα-helixtrans-79-16.1179.2-75.5-173.872.600114C129 V130 L131 L135 P136 T137 Y279 L280 R457 V460 S461C129-M133 WeakPolarHBondContact O-CB 3.3Å; C129-M133 WeakPolarHBondContact O-CG 3.26Å; C129-M133 PolarHBondContact O-N 2.81Å; V130-M133 WeakPolarHBondContact O-CA 3.46Å; V130-M133 WeakPolarHBondContact O-CB 3.39Å; V130-M133 PolarHBondContact O-N 3.46Å; L131-M133 PolarHBondContact O-N 3.29Å; M133-L135 VanDerWaalsContact C-N 3.33Å; M133-L135 PolarHBondContact O-N 3.12Å; M133-P136 VanDerWaalsContact O-CD 3.23Å; M133-P136 WeakPolarHBondContact O-CD 3.47Å; M133-P136 WeakPolarHBondContact O-CG 3.34Å; M133-T137 VanDerWaalsContact O-CB 3.28Å; M133-T137 WeakPolarHBondContact O-CB 2.94Å; M133-T137 PolarHBondContact O-N 3.49Å; M133-T137 PolarHBondContact O-OG1 3.34Å; M133-Y279 HydrophobicContact CE-CD1 3.06Å; M133-Y279 HydrophobicContact CE-CE1 3.5Å; M133-Y279 HydrophobicContact CE-CG 3.79Å; M133-Y279 HydrophobicContact SD-CD1 4.23Å; M133-L280 HydrophobicContact SD-CB 4.4Å; M133-L280 HydrophobicContact SD-CD1 4.46Å; M133-R457 HydrophobicContact CE-CB 3.7Å; M133-R457 HydrophobicContact CE-CG 3.86Å; M133-V460 HydrophobicContact CG-CB 4.28Å; M133-V460 HydrophobicContact CG-CG1 3.78Å; M133-S461 PolarHBondContact SD-OG 3.43Å
134I93.6Very high93.2Very high29 Ų2930.8 Ų30.815%0.14917%0.169CC..Hα-helixtrans-57.4-47.3178.4-66.3169.2000110.7V130 L131 T137 L138 L272 I273V130-I134 WeakPolarHBondContact O-CG1 3.35Å; V130-I134 PolarHBondContact O-N 3.39Å; V130-I134 VanDerWaalsContact O-N 3.15Å; L131-I134 HydrophobicContact CD2-CD1 4.03Å; L131-I134 PolarHBondContact O-N 3.06Å; I134-T137 WeakPolarHBondContact O-CB 3.28Å; I134-T137 PolarHBondContact O-N 3.25Å; I134-T137 VanDerWaalsContact O-N 3.16Å; I134-L138 PolarHBondContact O-N 2.83Å; I134-L272 HydrophobicContact CG2-CB 4.41Å; I134-L272 HydrophobicContact CG2-CD1 4.35Å; I134-I273 HydrophobicContact CD1-CG1 3.79Å; I134-I273 HydrophobicContact CG1-CG1 4.36Å
135L92.1Very high93Very high134 Ų13433.8 Ų33.870%0.70218%0.176SC*.Hα-helixtrans-61.3-52-178.8-176.966.2000113.3M133 T137 L138 G139M133-L135 VanDerWaalsContact C-N 3.33Å; M133-L135 PolarHBondContact O-N 3.12Å; L135-T137 VanDerWaalsContact C-N 3.26Å; L135-T137 PolarHBondContact O-N 3.09Å; L135-L138 HydrophobicContact CD1-CD1 4.41Å; L135-L138 WeakPolarHBondContact O-CB 3.43Å; L135-L138 PolarHBondContact O-N 3Å; L135-G139 PolarHBondContact O-N 3.35Å
136P93.9Very high92.9Very high14 Ų1435.4 Ų35.49%0.09119%0.185CC..Hα-helixtrans-69.9-22174.529.1-36.5000112.5T132 M133 G139 T140 A453 I456 R457T132-P136 WeakPolarHBondContact O-CD 3.42Å; M133-P136 VanDerWaalsContact O-CD 3.23Å; M133-P136 WeakPolarHBondContact O-CD 3.47Å; M133-P136 WeakPolarHBondContact O-CG 3.34Å; P136-G139 PolarHBondContact O-N 3.19Å; P136-T140 WeakPolarHBondContact O-CG2 3.3Å; P136-A453 WeakPolarHBondContact O-CB 2.79Å; P136-I456 HydrophobicContact CB-CB 4.13Å; P136-I456 HydrophobicContact CB-CG2 3.74Å; P136-I456 HydrophobicContact CG-CG2 4.07Å; P136-R457 HydrophobicContact CB-CG 3.77Å; P136-R457 HydrophobicContact CG-CG 3.83Å
137T93.8Very high92.7Very high0 Ų033.2 Ų33.20%017%0.169CC..Hα-helixtrans-68.4-35.6171.2-64.30000112M133 I134 L135 G139 T140 Q142 L272 E275 S276 R457M133-T137 VanDerWaalsContact O-CB 3.28Å; M133-T137 WeakPolarHBondContact O-CB 2.94Å; M133-T137 PolarHBondContact O-N 3.49Å; M133-T137 PolarHBondContact O-OG1 3.34Å; I134-T137 WeakPolarHBondContact O-CB 3.28Å; I134-T137 PolarHBondContact O-N 3.25Å; I134-T137 VanDerWaalsContact O-N 3.16Å; L135-T137 VanDerWaalsContact C-N 3.26Å; L135-T137 PolarHBondContact O-N 3.09Å; T137-G139 PolarHBondContact O-N 3.4Å; T137-T140 WeakPolarHBondContact O-CB 3.34Å; T137-T140 PolarHBondContact O-N 2.98Å; T137-T140 VanDerWaalsContact O-N 3.1Å; T137-T140 PolarHBondContact O-OG1 3.45Å; T137-Q142 HydrophobicContact CG2-CB 4.48Å; T137-Q142 HydrophobicContact CG2-CG 4.37Å; T137-L272 HydrophobicContact CG2-CD2 3.9Å; T137-E275 HydrophobicContact CG2-CB 4.18Å; T137-S276 WeakPolarHBondContact CB-OG 3.45Å; T137-S276 PolarHBondContact OG1-OG 2.92Å; T137-R457 WeakPolarHBondContact OG1-CD 3.49Å
138L92.3Very high92.6Very high58 Ų5832 Ų3230%0.30416%0.163SC..Hα-helixtrans-54.6-44.1169-77.9164.8000110.6I134 L135 T140 G143 F268 L272 M446I134-L138 PolarHBondContact O-N 2.83Å; L135-L138 HydrophobicContact CD1-CD1 4.41Å; L135-L138 WeakPolarHBondContact O-CB 3.43Å; L135-L138 PolarHBondContact O-N 3Å; L138-T140 PolarHBondContact O-N 2.86Å; L138-G143 WeakPolarHBondContact O-CA 3.32Å; L138-G143 PolarHBondContact O-N 3Å; L138-F268 HydrophobicContact CD2-CE1 3.78Å; L138-F268 HydrophobicContact CD2-CZ 4.37Å; L138-L272 HydrophobicContact CD1-CD1 4.48Å; L138-L272 HydrophobicContact CD2-CD1 3.38Å; L138-L272 HydrophobicContact CD2-CD2 4.1Å; L138-L272 HydrophobicContact CD2-CG 4.35Å; L138-L272 HydrophobicContact CG-CD1 3.75Å; L138-L272 HydrophobicContact CG-CD2 4.31Å; L138-M446 WeakPolarHBondContact O-CE 3.48Å
139G91.3Very high92.3Very high14 Ų1434.1 Ų34.114%0.14418%0.179CC..THydrogen-bonded Turntrans-60.91.4176.800000116.5L135 P136 T137 M446 E450 A453L135-G139 PolarHBondContact O-N 3.35Å; P136-G139 PolarHBondContact O-N 3.19Å; T137-G139 PolarHBondContact O-N 3.4Å; G139-M446 VanDerWaalsContact CA-CE 3.48Å; G139-E450 WeakPolarHBondContact O-CA 3.31Å; G139-A453 VanDerWaalsContact O-CB 3.3Å; G139-A453 WeakPolarHBondContact O-CB 3.45Å
140T91.6Very high92Very high2 Ų235.6 Ų35.61%0.01219%0.188CC..THydrogen-bonded Turntrans-107.2-171.6-176.872.10000112.8P136 T137 L138 Q142 G143 R144 A453P136-T140 WeakPolarHBondContact O-CG2 3.3Å; T137-T140 WeakPolarHBondContact O-CB 3.34Å; T137-T140 PolarHBondContact O-N 2.98Å; T137-T140 VanDerWaalsContact O-N 3.1Å; T137-T140 PolarHBondContact O-OG1 3.45Å; L138-T140 PolarHBondContact O-N 2.86Å; T140-Q142 PolarHBondContact O-N 3.06Å; T140-Q142 PolarHBondContact OG1-N 2.67Å; T140-G143 PolarHBondContact O-N 3.46Å; T140-R144 PolarHBondContact O-N 3.08Å; T140-A453 HydrophobicContact CG2-CB 3.99Å
141K90.6Very high91.8Very high104 Ų10435.2 Ų35.245%0.45219%0.186SC..Hα-helixtrans-45.6-29.2168.568.5179.7-175.6175.90114.5R144 K145 E450K141-R144 VanDerWaalsContact CB-NH2 3.33Å; K141-K145 WeakPolarHBondContact O-CG 3.34Å; K141-K145 PolarHBondContact O-N 2.81Å; K141-E450 PolarHBondContact N-OE1 3.48Å
142Q90.7Very high91.6Very high2 Ų236.5 Ų36.51%0.00919%0.194CC..Hα-helixtrans-70.5-49.3-179.1-50.4-54.910.500112.2T137 T140 R144 K145 L146 F268 Y271 L272 E275T137-Q142 HydrophobicContact CG2-CB 4.48Å; T137-Q142 HydrophobicContact CG2-CG 4.37Å; T140-Q142 PolarHBondContact O-N 3.06Å; T140-Q142 PolarHBondContact OG1-N 2.67Å; Q142-R144 VanDerWaalsContact C-N 3.25Å; Q142-R144 PolarHBondContact O-N 3.36Å; Q142-K145 WeakPolarHBondContact O-CB 3.45Å; Q142-K145 PolarHBondContact O-N 3.46Å; Q142-K145 VanDerWaalsContact O-N 3.14Å; Q142-L146 PolarHBondContact O-N 3.4Å; Q142-F268 WeakPolarHBondContact O-CE2 3.38Å; Q142-F268 VanDerWaalsContact O-CZ 3.26Å; Q142-F268 WeakPolarHBondContact O-CZ 3.48Å; Q142-Y271 HydrophobicContact CB-CE1 4.16Å; Q142-Y271 VanDerWaalsContact CD-CE1 3.5Å; Q142-Y271 HydrophobicContact CG-CE1 4.08Å; Q142-Y271 PolarHBondContact NE2-OH 3.19Å; Q142-Y271 VanDerWaalsContact OE1-CE1 3.23Å; Q142-Y271 PolarHBondContact OE1-OH 3.07Å; Q142-L272 HydrophobicContact CB-CD2 4.1Å; Q142-E275 HydrophobicContact CG-CB 4.46Å; Q142-E275 HydrophobicContact CG-CG 4.09Å; Q142-E275 PolarHBondContact NE2-OE1 3.23Å; Q142-E275 VanDerWaalsContact NE2-OE1 3.17Å; Q142-E275 PolarHBondContact NE2-OE2 3.49Å
143G90.3Very high91.3Very high3 Ų336 Ų363%0.03119%0.19CC..Hα-helixtrans-65-30.2174.200000113.1L138 T140 K145 L146 I147L138-G143 WeakPolarHBondContact O-CA 3.32Å; L138-G143 PolarHBondContact O-N 3Å; T140-G143 PolarHBondContact O-N 3.46Å; G143-K145 PolarHBondContact O-N 2.97Å; G143-L146 WeakPolarHBondContact O-CB 3.41Å; G143-L146 PolarHBondContact O-N 3.5Å; G143-I147 WeakPolarHBondContact O-CG1 3.49Å; G143-I147 PolarHBondContact O-N 2.96Å
144R91.3Very high90.9Very high20 Ų2037.3 Ų37.38%0.07520%0.198CC..Hα-helixtrans-63.4-40.3171.9-175.5172.460.3-105.91.4112.7T140 K141 Q142 L146 I147 I148 V340 E450T140-R144 PolarHBondContact O-N 3.08Å; K141-R144 VanDerWaalsContact CB-NH2 3.33Å; Q142-R144 VanDerWaalsContact C-N 3.25Å; Q142-R144 PolarHBondContact O-N 3.36Å; R144-L146 VanDerWaalsContact C-N 3.27Å; R144-L146 PolarHBondContact O-N 3.17Å; R144-I147 PolarHBondContact O-N 3.26Å; R144-I148 HydrophobicContact CG-CD1 3.95Å; R144-I148 HydrophobicContact CG-CG1 4.42Å; R144-I148 WeakPolarHBondContact O-CG1 3.48Å; R144-I148 PolarHBondContact O-N 3.05Å; R144-V340 VanDerWaalsContact CD-CG2 3.46Å; R144-V340 HydrophobicContact CG-CG2 4.29Å; R144-E450 IonicContact CZ-OE2 2.98Å; R144-E450 IonicContact NH1-OE2 3.4Å; R144-E450 PolarHBondContact NH1-OE2 2.83Å; R144-E450 IonicContact NH2-OE2 2.67Å; R144-E450 PolarHBondContact NH2-OE2 2.97Å
145K90.6Very high90.9Very high115 Ų11536.5 Ų36.550%0.519%0.194SC..Hα-helixtrans-59.9-38.6173.3-74.2177.3179.6179.90111.8K141 Q142 G143 I148 S149K141-K145 WeakPolarHBondContact O-CG 3.34Å; K141-K145 PolarHBondContact O-N 2.81Å; Q142-K145 WeakPolarHBondContact O-CB 3.45Å; Q142-K145 PolarHBondContact O-N 3.46Å; Q142-K145 VanDerWaalsContact O-N 3.14Å; G143-K145 PolarHBondContact O-N 2.97Å; K145-I148 PolarHBondContact O-N 2.99Å; K145-S149 VanDerWaalsContact O-CB 3.26Å; K145-S149 WeakPolarHBondContact O-CB 3.36Å; K145-S149 PolarHBondContact O-N 2.92Å
146L89.7Confident90.6Very high54 Ų5432.4 Ų32.428%0.28317%0.174SC..Hα-helixtrans-60.2-51.8172.8174.570.4000110.9Q142 G143 R144 I148 S149 T150 F268Q142-L146 PolarHBondContact O-N 3.4Å; G143-L146 WeakPolarHBondContact O-CB 3.41Å; G143-L146 PolarHBondContact O-N 3.5Å; R144-L146 VanDerWaalsContact C-N 3.27Å; R144-L146 PolarHBondContact O-N 3.17Å; L146-I148 VanDerWaalsContact C-N 3.29Å; L146-I148 PolarHBondContact O-N 3.25Å; L146-S149 WeakPolarHBondContact O-CB 3.26Å; L146-S149 PolarHBondContact O-N 3.43Å; L146-S149 VanDerWaalsContact O-N 3.13Å; L146-T150 WeakPolarHBondContact O-CB 3.29Å; L146-T150 PolarHBondContact O-N 2.98Å; L146-T150 PolarHBondContact O-OG1 3.46Å; L146-T150 VanDerWaalsContact O-OG1 3.06Å; L146-F268 HydrophobicContact CB-CD1 3.91Å; L146-F268 HydrophobicContact CB-CD2 3.94Å; L146-F268 HydrophobicContact CB-CE1 3.52Å; L146-F268 HydrophobicContact CB-CE2 3.62Å; L146-F268 HydrophobicContact CB-CG 4.09Å; L146-F268 HydrophobicContact CB-CZ 3.41Å; L146-F268 VanDerWaalsContact CB-CZ 3.41Å; L146-F268 HydrophobicContact CD1-CB 4.15Å; L146-F268 HydrophobicContact CD1-CD1 3.75Å; L146-F268 HydrophobicContact CD1-CD2 4.27Å; L146-F268 HydrophobicContact CD1-CE1 4.22Å; L146-F268 HydrophobicContact CD1-CG 3.76Å; L146-F268 HydrophobicContact CD2-CD1 3.56Å; L146-F268 HydrophobicContact CD2-CE1 3.39Å; L146-F268 HydrophobicContact CD2-CG 4.4Å; L146-F268 HydrophobicContact CD2-CZ 4.18Å; L146-F268 HydrophobicContact CG-CD1 3.92Å; L146-F268 HydrophobicContact CG-CE1 3.87Å; L146-F268 HydrophobicContact CG-CG 4.29Å; L146-F268 HydrophobicContact CG-CZ 4.28Å
147I91.5Very high90.2Very high20 Ų2032.7 Ų32.710%0.10318%0.175CC..Hα-helixtrans-57-45.2-179.3-66.3163.1000110.9G143 R144 T150 S151 L439 V442 M446G143-I147 WeakPolarHBondContact O-CG1 3.49Å; G143-I147 PolarHBondContact O-N 2.96Å; R144-I147 PolarHBondContact O-N 3.26Å; I147-T150 PolarHBondContact O-N 2.83Å; I147-S151 WeakPolarHBondContact O-CB 3.43Å; I147-S151 PolarHBondContact O-N 3.43Å; I147-S151 PolarHBondContact O-OG 3.33Å; I147-L439 HydrophobicContact CG2-CB 4.09Å; I147-L439 HydrophobicContact CG2-CD2 4.27Å; I147-L439 VanDerWaalsContact CG2-O 3.31Å; I147-L439 WeakPolarHBondContact CG2-O 3.29Å; I147-V442 HydrophobicContact CD1-CG1 3.77Å; I147-M446 HydrophobicContact CD1-CG 3.99Å
148I91.1Very high89.9Confident23 Ų2334.2 Ų34.212%0.11819%0.186CC..Hα-helixtrans-63.9-46.1177.4-66.2168.4000110.5R144 K145 L146 T150 S151 V152 V340 Y343R144-I148 HydrophobicContact CG-CD1 3.95Å; R144-I148 HydrophobicContact CG-CG1 4.42Å; R144-I148 WeakPolarHBondContact O-CG1 3.48Å; R144-I148 PolarHBondContact O-N 3.05Å; K145-I148 PolarHBondContact O-N 2.99Å; L146-I148 VanDerWaalsContact C-N 3.29Å; L146-I148 PolarHBondContact O-N 3.25Å; I148-T150 PolarHBondContact O-N 3.22Å; I148-S151 WeakPolarHBondContact O-CB 3.26Å; I148-S151 PolarHBondContact O-N 2.93Å; I148-V152 WeakPolarHBondContact O-CG2 3.29Å; I148-V152 PolarHBondContact O-N 3.08Å; I148-V340 HydrophobicContact CD1-CG2 4.38Å; I148-Y343 HydrophobicContact CD1-CD2 4.08Å; I148-Y343 HydrophobicContact CD1-CE2 4.4Å; I148-Y343 HydrophobicContact CG2-CD1 3.83Å; I148-Y343 HydrophobicContact CG2-CD2 4.02Å; I148-Y343 HydrophobicContact CG2-CE1 3.98Å; I148-Y343 HydrophobicContact CG2-CE2 4.17Å; I148-Y343 HydrophobicContact CG2-CG 3.86Å
149S89.6Confident89.8Confident49 Ų4931.8 Ų31.834%0.34317%0.173SC..Hα-helixtrans-59.5-47.3177.6-171.60000111.6K145 L146 S151 V152 I153K145-S149 VanDerWaalsContact O-CB 3.26Å; K145-S149 WeakPolarHBondContact O-CB 3.36Å; K145-S149 PolarHBondContact O-N 2.92Å; L146-S149 WeakPolarHBondContact O-CB 3.26Å; L146-S149 PolarHBondContact O-N 3.43Å; L146-S149 VanDerWaalsContact O-N 3.13Å; S149-S151 VanDerWaalsContact C-N 3.3Å; S149-S151 PolarHBondContact O-N 3.11Å; S149-V152 PolarHBondContact O-N 2.93Å; S149-I153 WeakPolarHBondContact O-CB 3.2Å; S149-I153 WeakPolarHBondContact O-CD1 3.44Å; S149-I153 WeakPolarHBondContact O-CG1 3.44Å; S149-I153 PolarHBondContact O-N 3.24Å
150T88.8Confident89.7Confident31 Ų3134 Ų3419%0.1918%0.181CC..Hα-helixtrans-61.6-39.5176-57.30000111.3L146 I147 I148 I153 V154 L439L146-T150 WeakPolarHBondContact O-CB 3.29Å; L146-T150 PolarHBondContact O-N 2.98Å; L146-T150 PolarHBondContact O-OG1 3.46Å; L146-T150 VanDerWaalsContact O-OG1 3.06Å; I147-T150 PolarHBondContact O-N 2.83Å; I148-T150 PolarHBondContact O-N 3.22Å; T150-I153 PolarHBondContact O-N 3.14Å; T150-V154 WeakPolarHBondContact O-CG2 3.21Å; T150-V154 PolarHBondContact O-N 3.24Å; T150-L439 HydrophobicContact CG2-CD1 4.23Å
151S91.6Very high89.4Confident4 Ų434.6 Ų34.63%0.02819%0.185CC..Hα-helixtrans-61.5-44.6176.1-580000111.5I147 I148 S149 V154 L155I147-S151 WeakPolarHBondContact O-CB 3.43Å; I147-S151 PolarHBondContact O-N 3.43Å; I147-S151 PolarHBondContact O-OG 3.33Å; I148-S151 WeakPolarHBondContact O-CB 3.26Å; I148-S151 PolarHBondContact O-N 2.93Å; S149-S151 VanDerWaalsContact C-N 3.3Å; S149-S151 PolarHBondContact O-N 3.11Å; S151-V154 PolarHBondContact O-N 3.37Å; S151-L155 WeakPolarHBondContact O-CB 3.3Å; S151-L155 PolarHBondContact O-N 2.95Å
152V90.1Very high89.4Confident57 Ų5730.5 Ų30.535%0.34517%0.168SC..Hα-helixtrans-65.6-42.5176.6172.80000111.4I148 S149 V154 L155 V156I148-V152 WeakPolarHBondContact O-CG2 3.29Å; I148-V152 PolarHBondContact O-N 3.08Å; S149-V152 PolarHBondContact O-N 2.93Å; V152-V154 VanDerWaalsContact C-N 3.35Å; V152-V154 PolarHBondContact O-N 2.97Å; V152-L155 WeakPolarHBondContact O-CB 3.41Å; V152-L155 PolarHBondContact O-N 3.48Å; V152-V156 HydrophobicContact CG1-CG2 4.29Å; V152-V156 VanDerWaalsContact O-CG2 3.31Å; V152-V156 WeakPolarHBondContact O-CG2 3.42Å; V152-V156 PolarHBondContact O-N 3.05Å
153I87.5Confident89.4Confident23 Ų2331.5 Ų31.512%0.11817%0.173CC..Hα-helixtrans-58.8-47.8176.3-72164000110.4S149 T150 V156 L157 L264S149-I153 WeakPolarHBondContact O-CB 3.2Å; S149-I153 WeakPolarHBondContact O-CD1 3.44Å; S149-I153 WeakPolarHBondContact O-CG1 3.44Å; S149-I153 PolarHBondContact O-N 3.24Å; T150-I153 PolarHBondContact O-N 3.14Å; I153-V156 PolarHBondContact O-N 3.29Å; I153-L157 HydrophobicContact CB-CD1 4.46Å; I153-L157 HydrophobicContact CG2-CD1 3.39Å; I153-L157 HydrophobicContact CG2-CG 4.48Å; I153-L157 VanDerWaalsContact O-CB 3.24Å; I153-L157 WeakPolarHBondContact O-CB 3.23Å; I153-L157 WeakPolarHBondContact O-CD1 3.32Å; I153-L157 WeakPolarHBondContact O-CG 3.13Å; I153-L157 PolarHBondContact O-N 3.28Å; I153-L264 HydrophobicContact CD1-CD1 3.39Å; I153-L264 HydrophobicContact CG1-CD1 4.23Å
154V88.3Confident89.1Confident27 Ų2732.4 Ų32.416%0.16418%0.178CC..Hα-helixtrans-65.3-39.7177.2171.30000111.7T150 S151 V152 S158 V432 F435T150-V154 WeakPolarHBondContact O-CG2 3.21Å; T150-V154 PolarHBondContact O-N 3.24Å; S151-V154 PolarHBondContact O-N 3.37Å; V152-V154 VanDerWaalsContact C-N 3.35Å; V152-V154 PolarHBondContact O-N 2.97Å; V154-S158 VanDerWaalsContact O-CB 3.28Å; V154-S158 WeakPolarHBondContact O-CB 3.43Å; V154-S158 PolarHBondContact O-N 3.44Å; V154-V432 HydrophobicContact CG1-CG1 3.77Å; V154-F435 HydrophobicContact CG1-CD1 4.4Å; V154-F435 HydrophobicContact CG2-CD1 4.43Å; V154-F435 HydrophobicContact CG2-CE1 4.02Å
155L91.7Very high88.8Confident12 Ų1234.2 Ų34.26%0.06319%0.191CC..Iπ-helixtrans-57-51.7174.5-176.372.1000111.1S151 V152 I159 I160 I347 I350 L436S151-L155 WeakPolarHBondContact O-CB 3.3Å; S151-L155 PolarHBondContact O-N 2.95Å; V152-L155 WeakPolarHBondContact O-CB 3.41Å; V152-L155 PolarHBondContact O-N 3.48Å; L155-I159 HydrophobicContact CD1-CB 4.13Å; L155-I159 HydrophobicContact CD1-CD1 3.55Å; L155-I159 HydrophobicContact CD1-CG1 4.39Å; L155-I159 HydrophobicContact CD1-CG2 4.41Å; L155-I159 WeakPolarHBondContact O-CA 3.25Å; L155-I159 WeakPolarHBondContact O-CB 3.38Å; L155-I159 PolarHBondContact O-N 2.95Å; L155-I160 PolarHBondContact O-N 3.33Å; L155-I347 HydrophobicContact CD2-CG1 4.1Å; L155-I350 HydrophobicContact CD1-CB 3.96Å; L155-I350 HydrophobicContact CD1-CG2 3.71Å; L155-I350 HydrophobicContact CD2-CB 4.42Å; L155-I350 HydrophobicContact CD2-CG1 4.39Å; L155-I350 HydrophobicContact CD2-CG2 4.46Å; L155-I350 HydrophobicContact CG-CG2 4.16Å; L155-L436 HydrophobicContact CD1-CD2 4.37Å
156V87.5Confident88.8Confident48 Ų4828.8 Ų28.829%0.29117%0.167SC..Iπ-helixtrans-65-48.2-179173.70000111.1V152 I153 S158 I160 V161 L253V152-V156 HydrophobicContact CG1-CG2 4.29Å; V152-V156 VanDerWaalsContact O-CG2 3.31Å; V152-V156 WeakPolarHBondContact O-CG2 3.42Å; V152-V156 PolarHBondContact O-N 3.05Å; I153-V156 PolarHBondContact O-N 3.29Å; V156-S158 PolarHBondContact O-N 2.88Å; V156-I160 HydrophobicContact CB-CD1 4.32Å; V156-I160 HydrophobicContact CG2-CD1 3.93Å; V156-I160 WeakPolarHBondContact O-CB 3.38Å; V156-V161 PolarHBondContact O-N 2.97Å; V156-L253 HydrophobicContact CG1-CD2 4.27Å
157L84.5Confident88.5Confident20 Ų2030 Ų3011%0.10517%0.173CC..Iπ-helixtrans-85.2-11.3-167.3-61167.8000113.8I153 K257I153-L157 HydrophobicContact CB-CD1 4.46Å; I153-L157 HydrophobicContact CG2-CD1 3.39Å; I153-L157 HydrophobicContact CG2-CG 4.48Å; I153-L157 VanDerWaalsContact O-CB 3.24Å; I153-L157 WeakPolarHBondContact O-CB 3.23Å; I153-L157 WeakPolarHBondContact O-CD1 3.32Å; I153-L157 WeakPolarHBondContact O-CG 3.13Å; I153-L157 PolarHBondContact O-N 3.28Å; L157-K257 HydrophobicContact CB-CB 4.42Å; L157-K257 HydrophobicContact CB-CD 3.76Å; L157-K257 HydrophobicContact CB-CG 3.92Å; L157-K257 HydrophobicContact CD1-CB 4Å; L157-K257 HydrophobicContact CD1-CG 3.75Å; L157-K257 HydrophobicContact CD2-CB 3.89Å; L157-K257 HydrophobicContact CD2-CG 4.3Å; L157-K257 HydrophobicContact CG-CB 4.31Å; L157-K257 HydrophobicContact CG-CG 4.19Å; L157-K257 PolarHBondContact O-NZ 2.95Å
158S86.9Confident88Confident33 Ų3330.1 Ų30.123%0.23118%0.179CC..Iπ-helixtrans-119.3-54.7177.6-590000111.4V154 V156 N162 K257V154-S158 VanDerWaalsContact O-CB 3.28Å; V154-S158 WeakPolarHBondContact O-CB 3.43Å; V154-S158 PolarHBondContact O-N 3.44Å; V156-S158 PolarHBondContact O-N 2.88Å; S158-N162 VanDerWaalsContact O-CB 3.26Å; S158-N162 WeakPolarHBondContact O-CB 3.28Å; S158-N162 PolarHBondContact O-N 2.98Å; S158-K257 PolarHBondContact OG-NZ 2.94Å
159I91.4Very high87.6Confident7 Ų729.4 Ų29.44%0.03618%0.176CC..Iπ-helixtrans-78.7-48.1-173.5-62.2165.2000110.8L155 V161 N162 I163 I350 M351 D354 V432 L436L155-I159 HydrophobicContact CD1-CB 4.13Å; L155-I159 HydrophobicContact CD1-CD1 3.55Å; L155-I159 HydrophobicContact CD1-CG1 4.39Å; L155-I159 HydrophobicContact CD1-CG2 4.41Å; L155-I159 WeakPolarHBondContact O-CA 3.25Å; L155-I159 WeakPolarHBondContact O-CB 3.38Å; L155-I159 PolarHBondContact O-N 2.95Å; I159-V161 VanDerWaalsContact C-N 3.32Å; I159-V161 PolarHBondContact O-N 3.48Å; I159-N162 WeakPolarHBondContact O-CB 3.23Å; I159-N162 PolarHBondContact O-N 3.35Å; I159-N162 VanDerWaalsContact O-N 3.12Å; I159-I163 HydrophobicContact CG2-CD1 4.2Å; I159-I163 WeakPolarHBondContact O-CG1 3.43Å; I159-I163 PolarHBondContact O-N 3.17Å; I159-I350 HydrophobicContact CG2-CG2 3.87Å; I159-M351 HydrophobicContact CD1-CG 3.6Å; I159-M351 HydrophobicContact CD1-SD 4.49Å; I159-D354 HydrophobicContact CG2-CB 3.64Å; I159-V432 HydrophobicContact CD1-CG1 4.37Å; I159-V432 HydrophobicContact CG1-CG1 4.23Å; I159-L436 HydrophobicContact CD1-CD2 3.9Å
160I88.9Confident87.1Confident60 Ų6029.3 Ų29.331%0.30817%0.173SC..Iπ-helixtrans-65.2-39.5178.4-58.3-177.5000110.5L155 V156 N162 I163 T164 I350L155-I160 PolarHBondContact O-N 3.33Å; V156-I160 HydrophobicContact CB-CD1 4.32Å; V156-I160 HydrophobicContact CG2-CD1 3.93Å; V156-I160 WeakPolarHBondContact O-CB 3.38Å; I160-N162 VanDerWaalsContact C-N 3.32Å; I160-N162 PolarHBondContact O-N 3.44Å; I160-I163 PolarHBondContact O-N 2.82Å; I160-T164 WeakPolarHBondContact O-CB 3.42Å; I160-T164 PolarHBondContact O-N 3.38Å; I160-T164 PolarHBondContact O-OG1 3.41Å; I160-I350 HydrophobicContact CG1-CG2 4.25Å
161V85.9Confident86.6Confident15 Ų1531.1 Ų31.19%0.09118%0.18CC..Hα-helixtrans-60.4-41.6172.5175.20000111.1V156 I159 T164 V165 L253V156-V161 PolarHBondContact O-N 2.97Å; I159-V161 VanDerWaalsContact C-N 3.32Å; I159-V161 PolarHBondContact O-N 3.48Å; V161-T164 CarbonylContact O-C 3.56Å; V161-T164 WeakPolarHBondContact O-CA 3.39Å; V161-T164 WeakPolarHBondContact O-CB 3.48Å; V161-T164 PolarHBondContact O-N 3.42Å; V161-T164 VanDerWaalsContact O-N 3.15Å; V161-V165 HydrophobicContact CG1-CG2 4.49Å; V161-V165 WeakPolarHBondContact O-CG2 3.42Å; V161-V165 PolarHBondContact O-N 3.29Å; V161-L253 HydrophobicContact CG2-CB 4.06Å; V161-L253 HydrophobicContact CG2-CD1 4.07Å
162N89.4Confident85.9Confident18 Ų1833.1 Ų33.110%0.09619%0.189CC..Hα-helixtrans-64-45176.9-16666.2000112.7S158 I159 I160 T164 V165 N166 D354 S426S158-N162 VanDerWaalsContact O-CB 3.26Å; S158-N162 WeakPolarHBondContact O-CB 3.28Å; S158-N162 PolarHBondContact O-N 2.98Å; I159-N162 WeakPolarHBondContact O-CB 3.23Å; I159-N162 PolarHBondContact O-N 3.35Å; I159-N162 VanDerWaalsContact O-N 3.12Å; I160-N162 VanDerWaalsContact C-N 3.32Å; I160-N162 PolarHBondContact O-N 3.44Å; N162-T164 PolarHBondContact O-N 2.94Å; N162-V165 PolarHBondContact O-N 3.16Å; N162-N166 PolarHBondContact ND2-ND2 2.97Å; N162-N166 PolarHBondContact O-N 3.33Å; N162-N166 PolarHBondContact O-ND2 3.19Å; N162-D354 PolarHBondContact ND2-OD1 2.97Å; N162-D354 PolarHBondContact ND2-OD2 3.46Å; N162-S426 PolarHBondContact ND2-O 2.85Å; N162-S426 VanDerWaalsContact OD1-CB 3.23Å; N162-S426 WeakPolarHBondContact OD1-CB 3.21Å; N162-S426 PolarHBondContact OD1-O 3.45Å; N162-S426 PolarHBondContact OD1-OG 3.5Å
163I90.2Very high85.3Confident22 Ų2231 Ų3111%0.11318%0.176CC..Hα-helixtrans-54.2-44.8171.4-69.7167.3000109.8I159 I160 N166 M167 I350 L353 D354 V357I159-I163 HydrophobicContact CG2-CD1 4.2Å; I159-I163 WeakPolarHBondContact O-CG1 3.43Å; I159-I163 PolarHBondContact O-N 3.17Å; I160-I163 PolarHBondContact O-N 2.82Å; I163-N166 PolarHBondContact O-N 2.97Å; I163-M167 HydrophobicContact CG2-CG 4.25Å; I163-M167 WeakPolarHBondContact O-CB 3.49Å; I163-M167 VanDerWaalsContact O-CG 3.28Å; I163-M167 WeakPolarHBondContact O-CG 3.37Å; I163-M167 PolarHBondContact O-N 3.16Å; I163-I350 HydrophobicContact CD1-CG2 4.12Å; I163-L353 HydrophobicContact CD1-CD2 4.37Å; I163-L353 HydrophobicContact CD1-CG 4.39Å; I163-D354 HydrophobicContact CD1-CB 3.93Å; I163-D354 HydrophobicContact CG1-CB 3.63Å; I163-D354 WeakPolarHBondContact CG1-OD1 3.37Å; I163-V357 HydrophobicContact CG2-CG2 4.34Å
164T85.3Confident84.8Confident22 Ų2234.3 Ų34.314%0.13519%0.194CC..Hα-helixtrans-61.7-58.3180-53.60000108.1I160 V161 N162 N166 M167 G168 F246 N250I160-T164 WeakPolarHBondContact O-CB 3.42Å; I160-T164 PolarHBondContact O-N 3.38Å; I160-T164 PolarHBondContact O-OG1 3.41Å; V161-T164 CarbonylContact O-C 3.56Å; V161-T164 WeakPolarHBondContact O-CA 3.39Å; V161-T164 WeakPolarHBondContact O-CB 3.48Å; V161-T164 PolarHBondContact O-N 3.42Å; V161-T164 VanDerWaalsContact O-N 3.15Å; N162-T164 PolarHBondContact O-N 2.94Å; T164-N166 VanDerWaalsContact C-N 3.26Å; T164-N166 PolarHBondContact O-N 2.71Å; T164-M167 CarbonylContact O-C 3.57Å; T164-M167 WeakPolarHBondContact O-CA 3.46Å; T164-M167 WeakPolarHBondContact O-CB 3.35Å; T164-M167 PolarHBondContact O-N 2.89Å; T164-G168 PolarHBondContact O-N 2.9Å; T164-F246 VanDerWaalsContact CA-CZ 3.46Å; T164-F246 HydrophobicContact CG2-CD1 4.13Å; T164-F246 HydrophobicContact CG2-CD2 4.07Å; T164-F246 HydrophobicContact CG2-CE1 3.42Å; T164-F246 VanDerWaalsContact CG2-CE1 3.42Å; T164-F246 HydrophobicContact CG2-CE2 3.35Å; T164-F246 HydrophobicContact CG2-CG 4.43Å; T164-F246 HydrophobicContact CG2-CZ 3.01Å; T164-F246 WeakPolarHBondContact O-CE1 3.39Å; T164-F246 WeakPolarHBondContact O-CZ 3.44Å; T164-N250 WeakPolarHBondContact CB-OD1 3.37Å; T164-N250 WeakPolarHBondContact CG2-OD1 3.46Å
165V85.1Confident84.2Confident59 Ų5934.7 Ų34.736%0.35819%0.193SC..Hα-helixtrans-47.8-46176.3174.10000113.2V161 N162 G168 V169V161-V165 HydrophobicContact CG1-CG2 4.49Å; V161-V165 WeakPolarHBondContact O-CG2 3.42Å; V161-V165 PolarHBondContact O-N 3.29Å; N162-V165 PolarHBondContact O-N 3.16Å; V165-G168 WeakPolarHBondContact O-CA 3.44Å; V165-G168 PolarHBondContact O-N 3.19Å; V165-G168 VanDerWaalsContact O-N 3.11Å; V165-V169 PolarHBondContact O-N 3.37Å; V165-V169 VanDerWaalsContact O-N 3.15Å
166N88.9Confident83.3Confident0 Ų035.1 Ų35.10%020%0.197CC..Hα-helixtrans-65.7-39.3177-75-29.7000113.8N162 I163 T164 G168 V169 V170 V357 V361 S426N162-N166 PolarHBondContact ND2-ND2 2.97Å; N162-N166 PolarHBondContact O-N 3.33Å; N162-N166 PolarHBondContact O-ND2 3.19Å; I163-N166 PolarHBondContact O-N 2.97Å; T164-N166 VanDerWaalsContact C-N 3.26Å; T164-N166 PolarHBondContact O-N 2.71Å; N166-G168 PolarHBondContact O-N 3.25Å; N166-V169 WeakPolarHBondContact O-CB 3.48Å; N166-V169 PolarHBondContact O-N 3.44Å; N166-V169 VanDerWaalsContact O-N 3.14Å; N166-V170 PolarHBondContact O-N 3.33Å; N166-V357 HydrophobicContact CB-CG1 3.69Å; N166-V361 HydrophobicContact CB-CG2 4.22Å; N166-V361 WeakPolarHBondContact O-CG2 3.38Å; N166-S426 PolarHBondContact ND2-O 2.87Å; N166-S426 PolarHBondContact OD1-N 3.1Å; N166-S426 PolarHBondContact OD1-O 3.39Å
167M83.9Confident82.7Confident80 Ų8034.8 Ų34.839%0.39420%0.195SC..Hα-helixtrans-64.9-31171.5-72.8-61.5-62.900112I163 T164 V169 V170 M171 F246 V357I163-M167 HydrophobicContact CG2-CG 4.25Å; I163-M167 WeakPolarHBondContact O-CB 3.49Å; I163-M167 VanDerWaalsContact O-CG 3.28Å; I163-M167 WeakPolarHBondContact O-CG 3.37Å; I163-M167 PolarHBondContact O-N 3.16Å; T164-M167 CarbonylContact O-C 3.57Å; T164-M167 WeakPolarHBondContact O-CA 3.46Å; T164-M167 WeakPolarHBondContact O-CB 3.35Å; T164-M167 PolarHBondContact O-N 2.89Å; M167-V169 VanDerWaalsContact C-N 3.3Å; M167-V169 PolarHBondContact O-N 3.13Å; M167-V170 WeakPolarHBondContact O-CB 3.49Å; M167-V170 PolarHBondContact O-N 2.94Å; M167-V170 HydrophobicContact SD-CG2 4.46Å; M167-M171 PolarHBondContact O-N 3.33Å; M167-F246 HydrophobicContact CB-CE2 4.45Å; M167-F246 HydrophobicContact CB-CZ 3.89Å; M167-V357 HydrophobicContact CG-CG1 4.18Å; M167-V357 HydrophobicContact SD-CG1 4.11Å
168G81.3Confident82.1Confident23 Ų2334.8 Ų34.824%0.23720%0.197CC..Hα-helixtrans-61.1-38.6170.600000112.3T164 V165 N166 M171 H172T164-G168 PolarHBondContact O-N 2.9Å; V165-G168 WeakPolarHBondContact O-CA 3.44Å; V165-G168 PolarHBondContact O-N 3.19Å; V165-G168 VanDerWaalsContact O-N 3.11Å; N166-G168 PolarHBondContact O-N 3.25Å; G168-M171 PolarHBondContact O-N 2.66Å; G168-H172 WeakPolarHBondContact O-CB 3.27Å; G168-H172 PolarHBondContact O-N 3.26Å
169V82.1Confident81.4Confident8 Ų836.6 Ų36.65%0.04820%0.201CC..Hα-helixtrans-62.4-48.1172.7177.80000111V165 N166 M167 M171 H172 V173 V361 I423V165-V169 PolarHBondContact O-N 3.37Å; V165-V169 VanDerWaalsContact O-N 3.15Å; N166-V169 WeakPolarHBondContact O-CB 3.48Å; N166-V169 PolarHBondContact O-N 3.44Å; N166-V169 VanDerWaalsContact O-N 3.14Å; M167-V169 VanDerWaalsContact C-N 3.3Å; M167-V169 PolarHBondContact O-N 3.13Å; V169-M171 VanDerWaalsContact C-N 3.27Å; V169-M171 PolarHBondContact O-N 3.22Å; V169-H172 PolarHBondContact O-N 2.98Å; V169-V173 HydrophobicContact CG1-CG2 4.41Å; V169-V173 WeakPolarHBondContact O-CG2 3.33Å; V169-V173 PolarHBondContact O-N 3.42Å; V169-V361 HydrophobicContact CB-CG1 3.98Å; V169-V361 HydrophobicContact CG1-CG1 3.52Å; V169-I423 HydrophobicContact CG1-CB 4.13Å; V169-I423 HydrophobicContact CG2-CB 4.26Å; V169-I423 HydrophobicContact CG2-CG2 3.78Å
170V80.6Confident80.4Confident46 Ų4636.8 Ų36.828%0.27921%0.205SC..Hα-helixtrans-55-46.7175.5-178.30000110.7N166 M167 H172 V173 L174 V361N166-V170 PolarHBondContact O-N 3.33Å; M167-V170 WeakPolarHBondContact O-CB 3.49Å; M167-V170 PolarHBondContact O-N 2.94Å; M167-V170 HydrophobicContact SD-CG2 4.46Å; V170-H172 VanDerWaalsContact C-N 3.34Å; V170-H172 PolarHBondContact O-N 2.97Å; V170-V173 PolarHBondContact O-N 3.06Å; V170-L174 WeakPolarHBondContact O-CB 3.37Å; V170-L174 PolarHBondContact O-N 3.01Å; V170-V361 HydrophobicContact CG2-CG2 3.48Å; V170-V361 VanDerWaalsContact CG2-CG2 3.48Å
171M77.2Confident79.5Confident69 Ų6939 Ų3934%0.3421%0.213SC..Hα-helixtrans-64.6-39.5-178.6-167.362.766.600112M167 G168 V169 L174 K175 I242M167-M171 PolarHBondContact O-N 3.33Å; G168-M171 PolarHBondContact O-N 2.66Å; V169-M171 VanDerWaalsContact C-N 3.27Å; V169-M171 PolarHBondContact O-N 3.22Å; M171-L174 PolarHBondContact O-N 2.73Å; M171-L174 HydrophobicContact SD-CD2 4.24Å; M171-K175 WeakPolarHBondContact O-CB 3.35Å; M171-K175 PolarHBondContact O-N 2.95Å; M171-I242 HydrophobicContact CE-CG2 3.66Å; M171-I242 HydrophobicContact CG-CG2 3.73Å; M171-I242 HydrophobicContact SD-CD1 4.49Å; M171-I242 HydrophobicContact SD-CG2 3.68Å
172H77.5Confident78.8Confident47 Ų4739.3 Ų39.322%0.21821%0.214CC..Hα-helixtrans-64.6-45.5175.9-175-87.8000111.8G168 V169 V170 L174 K175 C176 I423G168-H172 WeakPolarHBondContact O-CB 3.27Å; G168-H172 PolarHBondContact O-N 3.26Å; V169-H172 PolarHBondContact O-N 2.98Å; V170-H172 VanDerWaalsContact C-N 3.34Å; V170-H172 PolarHBondContact O-N 2.97Å; H172-L174 VanDerWaalsContact C-N 3.33Å; H172-L174 PolarHBondContact O-N 3.39Å; H172-K175 WeakPolarHBondContact O-CB 3.22Å; H172-K175 PolarHBondContact O-N 3.37Å; H172-C176 WeakPolarHBondContact O-CB 3.47Å; H172-C176 PolarHBondContact O-N 3.01Å; H172-I423 HydrophobicContact CB-CD1 3.67Å; H172-I423 VanDerWaalsContact ND1-CD1 3.29Å; H172-I423 WeakPolarHBondContact ND1-CD1 3.3Å
173V77.7Confident78Confident12 Ų1242.7 Ų42.77%0.07323%0.229CC..Hα-helixtrans-62.9-41.3176.31780000110.7V169 V170 C176 T177 L368V169-V173 HydrophobicContact CG1-CG2 4.41Å; V169-V173 WeakPolarHBondContact O-CG2 3.33Å; V169-V173 PolarHBondContact O-N 3.42Å; V170-V173 PolarHBondContact O-N 3.06Å; V173-C176 WeakPolarHBondContact O-CB 3.46Å; V173-C176 PolarHBondContact O-N 2.86Å; V173-T177 WeakPolarHBondContact O-CB 3.49Å; V173-T177 PolarHBondContact O-N 3.26Å; V173-T177 PolarHBondContact O-OG1 2.79Å; V173-L368 HydrophobicContact CG1-CB 3.86Å; V173-L368 HydrophobicContact CG1-CD2 3.71Å; V173-L368 HydrophobicContact CG1-CG 4.37Å
174L76.3Confident77Confident93 Ų9342.3 Ų42.349%0.48723%0.229SC..Hα-helixtrans-61.1-47.3175.7-178.665000111.6V170 M171 H172 C176 T177 S178V170-L174 WeakPolarHBondContact O-CB 3.37Å; V170-L174 PolarHBondContact O-N 3.01Å; M171-L174 PolarHBondContact O-N 2.73Å; M171-L174 HydrophobicContact SD-CD2 4.24Å; H172-L174 VanDerWaalsContact C-N 3.33Å; H172-L174 PolarHBondContact O-N 3.39Å; L174-C176 PolarHBondContact O-N 2.91Å; L174-T177 PolarHBondContact O-N 3.46Å; L174-S178 VanDerWaalsContact O-CB 3.27Å; L174-S178 WeakPolarHBondContact O-CB 3.35Å; L174-S178 PolarHBondContact O-N 3.03Å; L174-S178 PolarHBondContact O-OG 3.05Å
175K75.2Confident76.3Confident34 Ų3445.1 Ų45.115%0.14824%0.243CC..Hα-helixtrans-56.4-50174.6169.3-176.8178.3-1640111.2M171 H172 T177 S178 E179 E243M171-K175 WeakPolarHBondContact O-CB 3.35Å; M171-K175 PolarHBondContact O-N 2.95Å; H172-K175 WeakPolarHBondContact O-CB 3.22Å; H172-K175 PolarHBondContact O-N 3.37Å; K175-T177 PolarHBondContact O-N 3.36Å; K175-S178 WeakPolarHBondContact CA-OG 3.36Å; K175-S178 PolarHBondContact O-N 3.26Å; K175-S178 PolarHBondContact O-OG 2.88Å; K175-E179 VanDerWaalsContact CE-OE1 3.3Å; K175-E179 WeakPolarHBondContact CE-OE1 3.29Å; K175-E179 HydrophobicContact CG-CG 4.42Å; K175-E179 WeakPolarHBondContact O-CB 3.36Å; K175-E179 WeakPolarHBondContact O-CG 3.4Å; K175-E179 PolarHBondContact O-N 2.77Å; K175-E243 IonicContact NZ-OE2 2.72Å; K175-E243 PolarHBondContact NZ-OE2 3.45Å
176C74.6Confident75.6Confident22 Ų2243.2 Ų43.215%0.14923%0.231CC..Hα-helixtrans-58.8-48.8178.8-106.50000113.2H172 V173 L174 S178 E179 G180 C421H172-C176 WeakPolarHBondContact O-CB 3.47Å; H172-C176 PolarHBondContact O-N 3.01Å; V173-C176 WeakPolarHBondContact O-CB 3.46Å; V173-C176 PolarHBondContact O-N 2.86Å; L174-C176 PolarHBondContact O-N 2.91Å; C176-S178 VanDerWaalsContact C-N 3.26Å; C176-S178 PolarHBondContact O-N 2.85Å; C176-E179 PolarHBondContact O-N 3.17Å; C176-G180 PolarHBondContact O-N 2.92Å; C176-C421 HydrophobicContact CB-CB 3.32Å; C176-C421 WeakPolarHBondContact CB-SG 3.27Å; C176-C421 VanDerWaalsContact SG-CA 3.53Å; C176-C421 WeakPolarHBondContact SG-CB 3.42Å; C176-C421 CovalentContact SG-SG 2.01Å; C176-C421 PolarHBondContact SG-SG 3.41Å
177T73.1Confident74.6Confident40 Ų4047.7 Ų47.725%0.24525%0.254CS..Hα-helixtrans-62.5-39.1179.4-53.40000110.8V173 L174 K175 G180 F181V173-T177 WeakPolarHBondContact O-CB 3.49Å; V173-T177 PolarHBondContact O-N 3.26Å; V173-T177 PolarHBondContact O-OG1 2.79Å; L174-T177 PolarHBondContact O-N 3.46Å; K175-T177 PolarHBondContact O-N 3.36Å; T177-G180 PolarHBondContact O-N 2.78Å; T177-F181 WeakPolarHBondContact O-CB 2.96Å; T177-F181 PolarHBondContact O-N 3.45Å
178S72.1Confident73.9Confident21 Ų2144.2 Ų44.215%0.14724%0.238CC..Hα-helixtrans-79.1-32.2-179.356.40000113.8L174 K175 C176 F181 V182 F235L174-S178 VanDerWaalsContact O-CB 3.27Å; L174-S178 WeakPolarHBondContact O-CB 3.35Å; L174-S178 PolarHBondContact O-N 3.03Å; L174-S178 PolarHBondContact O-OG 3.05Å; K175-S178 WeakPolarHBondContact CA-OG 3.36Å; K175-S178 PolarHBondContact O-N 3.26Å; K175-S178 PolarHBondContact O-OG 2.88Å; C176-S178 VanDerWaalsContact C-N 3.26Å; C176-S178 PolarHBondContact O-N 2.85Å; S178-F181 PolarHBondContact O-N 3.44Å; S178-V182 WeakPolarHBondContact O-CB 3.38Å; S178-V182 VanDerWaalsContact O-CG2 3.27Å; S178-V182 WeakPolarHBondContact O-CG2 3.1Å; S178-V182 PolarHBondContact O-N 3.31Å; S178-F235 VanDerWaalsContact CB-CE1 3.42Å; S178-F235 WeakPolarHBondContact OG-CE1 3.3Å; S178-F235 WeakPolarHBondContact OG-CZ 3.37Å
179E72.7Confident73.3Confident70 Ų7044.2 Ų44.233%0.32723%0.234SC..Hα-helixtrans-61.8-43.8166.7-78.6-179.1-179.200110.6K175 C176 F181 V182 H183K175-E179 VanDerWaalsContact CE-OE1 3.3Å; K175-E179 WeakPolarHBondContact CE-OE1 3.29Å; K175-E179 HydrophobicContact CG-CG 4.42Å; K175-E179 WeakPolarHBondContact O-CB 3.36Å; K175-E179 WeakPolarHBondContact O-CG 3.4Å; K175-E179 PolarHBondContact O-N 2.77Å; C176-E179 PolarHBondContact O-N 3.17Å; E179-F181 VanDerWaalsContact C-N 3.34Å; E179-F181 PolarHBondContact O-N 2.93Å; E179-V182 PolarHBondContact O-N 3.44Å; E179-H183 VanDerWaalsContact O-CB 3.32Å; E179-H183 WeakPolarHBondContact O-CB 3.36Å; E179-H183 PolarHBondContact O-N 3.29Å
180G71.4Confident72.7Confident11 Ų1150.8 Ų50.811%0.11327%0.265CS..Hα-helixtrans-61.9-39.5172.300000112.8C176 T177 H183 S184C176-G180 PolarHBondContact O-N 2.92Å; T177-G180 PolarHBondContact O-N 2.78Å; G180-H183 PolarHBondContact O-N 2.86Å; G180-S184 WeakPolarHBondContact O-CB 3.37Å; G180-S184 PolarHBondContact O-N 3.04Å; G180-S184 PolarHBondContact O-OG 3.16Å; G180-S184 VanDerWaalsContact O-OG 3.09Å
181F69.5Low72.4Confident107 Ų10751.2 Ų51.247%0.46927%0.265SS..Hα-helixtrans-65.1-48175.9-178.6-91.7000112.1T177 S178 E179 H183 S184 L185 F414T177-F181 WeakPolarHBondContact O-CB 2.96Å; T177-F181 PolarHBondContact O-N 3.45Å; S178-F181 PolarHBondContact O-N 3.44Å; E179-F181 VanDerWaalsContact C-N 3.34Å; E179-F181 PolarHBondContact O-N 2.93Å; F181-H183 VanDerWaalsContact C-N 3.34Å; F181-S184 PolarHBondContact O-N 3.07Å; F181-L185 HydrophobicContact CE1-CD1 3.76Å; F181-L185 HydrophobicContact CZ-CD1 4.05Å; F181-L185 WeakPolarHBondContact O-CB 3.45Å; F181-L185 PolarHBondContact O-N 3.43Å; F181-F414 HydrophobicContact CB-CE2 4.15Å; F181-F414 HydrophobicContact CB-CZ 4.11Å; F181-F414 HydrophobicContact CD2-CD2 4.42Å; F181-F414 AromaticContact CD2-CE2 3.35Å; F181-F414 HydrophobicContact CD2-CE2 3.35Å; F181-F414 AromaticContact CD2-CZ 3.58Å; F181-F414 HydrophobicContact CD2-CZ 3.58Å; F181-F414 HydrophobicContact CE2-CE2 4.03Å; F181-F414 HydrophobicContact CE2-CZ 4.48Å; F181-F414 HydrophobicContact CG-CE2 4.05Å; F181-F414 HydrophobicContact CG-CZ 4.29Å
182V71.6Confident72.1Confident21 Ų2153.2 Ų53.213%0.12727%0.272CS..Hα-helixtrans-62.1-44.1176.2170.10000109.8S178 E179 S184 L185 L186 F235S178-V182 WeakPolarHBondContact O-CB 3.38Å; S178-V182 VanDerWaalsContact O-CG2 3.27Å; S178-V182 WeakPolarHBondContact O-CG2 3.1Å; S178-V182 PolarHBondContact O-N 3.31Å; E179-V182 PolarHBondContact O-N 3.44Å; V182-S184 PolarHBondContact O-N 3.22Å; V182-L185 PolarHBondContact O-N 3.03Å; V182-L186 HydrophobicContact CG1-CD1 3.6Å; V182-L186 HydrophobicContact CG1-CG 4Å; V182-L186 WeakPolarHBondContact O-CB 3.12Å; V182-L186 WeakPolarHBondContact O-CG 3.33Å; V182-L186 PolarHBondContact O-N 3.14Å; V182-F235 HydrophobicContact CG2-CB 4.39Å; V182-F235 HydrophobicContact CG2-CD1 4.12Å; V182-F235 HydrophobicContact CG2-CD2 4.13Å; V182-F235 HydrophobicContact CG2-CG 3.9Å
183H70.9Confident71.9Confident89 Ų8955 Ų5541%0.41228%0.28SS..Hα-helixtrans-59.5-46.4177.8-169.955.4000111.8E179 G180 F181 L186 N187E179-H183 VanDerWaalsContact O-CB 3.32Å; E179-H183 WeakPolarHBondContact O-CB 3.36Å; E179-H183 PolarHBondContact O-N 3.29Å; G180-H183 PolarHBondContact O-N 2.86Å; F181-H183 VanDerWaalsContact C-N 3.34Å; H183-L186 PolarHBondContact O-N 2.88Å; H183-N187 PolarHBondContact NE2-ND2 2.8Å; H183-N187 VanDerWaalsContact NE2-ND2 3.15Å; H183-N187 WeakPolarHBondContact O-CB 3.28Å; H183-N187 VanDerWaalsContact O-CG 3.25Å; H183-N187 PolarHBondContact O-N 3.31Å
184S70.4Confident71.9Confident15 Ų1556.9 Ų56.911%0.10529%0.288CS..Hα-helixtrans-63.1-43176-65.30000112.6G180 F181 V182 N187 S188 F414 S415G180-S184 WeakPolarHBondContact O-CB 3.37Å; G180-S184 PolarHBondContact O-N 3.04Å; G180-S184 PolarHBondContact O-OG 3.16Å; G180-S184 VanDerWaalsContact O-OG 3.09Å; F181-S184 PolarHBondContact O-N 3.07Å; V182-S184 PolarHBondContact O-N 3.22Å; S184-N187 PolarHBondContact O-N 3.28Å; S184-S188 PolarHBondContact O-N 3.31Å; S184-F414 VanDerWaalsContact CB-CD2 3.44Å; S184-S415 PolarHBondContact OG-O 3.34Å
185L70.1Confident71.9Confident81 Ų8153.1 Ų53.142%0.42427%0.271SS..Hα-helixtrans-66-39.7178.4-172.3144.2000111.6F181 V182 S188 S189F181-L185 HydrophobicContact CE1-CD1 3.76Å; F181-L185 HydrophobicContact CZ-CD1 4.05Å; F181-L185 WeakPolarHBondContact O-CB 3.45Å; F181-L185 PolarHBondContact O-N 3.43Å; V182-L185 PolarHBondContact O-N 3.03Å; L185-S188 WeakPolarHBondContact CA-OG 3.41Å; L185-S188 CarbonylContact O-C 3.58Å; L185-S188 PolarHBondContact O-N 3.03Å; L185-S188 PolarHBondContact O-OG 3.07Å; L185-S189 PolarHBondContact O-N 3.03Å; L185-S189 VanDerWaalsContact O-N 3.11Å
186L69.8Low71.9Confident19 Ų1953.8 Ų53.810%0.09927%0.274CS..Hα-helixtrans-71.5-35.3176.8-65-179.8000112V182 H183 S188 S189 V228 K232V182-L186 HydrophobicContact CG1-CD1 3.6Å; V182-L186 HydrophobicContact CG1-CG 4Å; V182-L186 WeakPolarHBondContact O-CB 3.12Å; V182-L186 WeakPolarHBondContact O-CG 3.33Å; V182-L186 PolarHBondContact O-N 3.14Å; H183-L186 PolarHBondContact O-N 2.88Å; L186-S188 VanDerWaalsContact C-N 3.28Å; L186-S188 PolarHBondContact O-N 3.38Å; L186-S189 WeakPolarHBondContact O-CB 3.42Å; L186-S189 PolarHBondContact O-N 2.85Å; L186-S189 PolarHBondContact O-OG 3Å; L186-V228 HydrophobicContact CB-CG1 3.92Å; L186-V228 HydrophobicContact CD1-CG1 3.85Å; L186-V228 HydrophobicContact CD2-CB 3.86Å; L186-V228 HydrophobicContact CD2-CG1 3.33Å; L186-V228 HydrophobicContact CD2-CG2 3.89Å; L186-V228 HydrophobicContact CG-CG1 3.83Å; L186-K232 HydrophobicContact CD1-CB 3.72Å; L186-K232 HydrophobicContact CD1-CD 4.22Å; L186-K232 HydrophobicContact CD1-CG 4.1Å
187N68.2Low72Confident93 Ų9358.1 Ų58.150%0.49729%0.287SS..Hα-helixtrans-64.5-35.4170-70.1-10.1000111H183 S184 S189H183-N187 PolarHBondContact NE2-ND2 2.8Å; H183-N187 VanDerWaalsContact NE2-ND2 3.15Å; H183-N187 WeakPolarHBondContact O-CB 3.28Å; H183-N187 VanDerWaalsContact O-CG 3.25Å; H183-N187 PolarHBondContact O-N 3.31Å; S184-N187 PolarHBondContact O-N 3.28Å; N187-S189 PolarHBondContact O-N 3.45Å
188S68.9Low72.2Confident8 Ų857.1 Ų57.16%0.05628%0.28CS..Hα-helixtrans-69.6-14172.280.20000113.7S184 L185 L186 E190 L191 F192S184-S188 PolarHBondContact O-N 3.31Å; L185-S188 WeakPolarHBondContact CA-OG 3.41Å; L185-S188 CarbonylContact O-C 3.58Å; L185-S188 PolarHBondContact O-N 3.03Å; L185-S188 PolarHBondContact O-OG 3.07Å; L186-S188 VanDerWaalsContact C-N 3.28Å; L186-S188 PolarHBondContact O-N 3.38Å; S188-E190 PolarHBondContact O-N 3.39Å; S188-L191 WeakPolarHBondContact O-CB 3.21Å; S188-L191 PolarHBondContact O-N 3.4Å; S188-F192 WeakPolarHBondContact O-CD2 3.5Å; S188-F192 PolarHBondContact O-N 3.25Å; S188-F192 VanDerWaalsContact O-N 3.14Å
189S69.2Low72.4Confident22 Ų2258 Ų5815%0.15428%0.283CS..Hα-helixtrans-64.5-27.9178.378.40000112.7L185 L186 N187 L191 F192 Q193L185-S189 PolarHBondContact O-N 3.03Å; L185-S189 VanDerWaalsContact O-N 3.11Å; L186-S189 WeakPolarHBondContact O-CB 3.42Å; L186-S189 PolarHBondContact O-N 2.85Å; L186-S189 PolarHBondContact O-OG 3Å; N187-S189 PolarHBondContact O-N 3.45Å; S189-L191 VanDerWaalsContact C-N 3.31Å; S189-L191 PolarHBondContact O-N 3.27Å; S189-F192 PolarHBondContact O-N 3.41Å; S189-Q193 WeakPolarHBondContact O-CG 3.26Å; S189-Q193 PolarHBondContact O-N 3.36Å
190E70.3Confident72.5Confident147 Ų14756.2 Ų56.269%0.68728%0.276SS*.Hα-helixtrans-63.7-38.1172.3-67.6-169.5166.600111.6S188 Q193 E194S188-E190 PolarHBondContact O-N 3.39Å; E190-Q193 PolarHBondContact O-N 2.97Å; E190-E194 WeakPolarHBondContact O-CB 3.32Å; E190-E194 PolarHBondContact O-N 3.06Å
191L72.9Confident72.7Confident55 Ų5561 Ų6129%0.28829%0.291SS..Hα-helixtrans-66.3-41.7173.9-72.5161.5000111.6S188 S189 Q193 E194 A195 Y410 W412S188-L191 WeakPolarHBondContact O-CB 3.21Å; S188-L191 PolarHBondContact O-N 3.4Å; S189-L191 VanDerWaalsContact C-N 3.31Å; S189-L191 PolarHBondContact O-N 3.27Å; L191-Q193 VanDerWaalsContact C-N 3.32Å; L191-Q193 PolarHBondContact O-N 3.47Å; L191-E194 PolarHBondContact O-N 3Å; L191-A195 WeakPolarHBondContact O-CB 3.4Å; L191-A195 PolarHBondContact O-N 2.96Å; L191-Y410 HydrophobicContact CD2-CD1 4.28Å; L191-W412 HydrophobicContact CD1-CB 3.46Å; L191-W412 VanDerWaalsContact CD1-CB 3.46Å; L191-W412 HydrophobicContact CD1-CG 4.3Å
192F72Confident72.9Confident110 Ų11057.8 Ų57.848%0.48228%0.278SS..Hα-helixtrans-63.7-39.2174.4-79.6-75.8000112.1S188 S189 K196 I378S188-F192 WeakPolarHBondContact O-CD2 3.5Å; S188-F192 PolarHBondContact O-N 3.25Å; S188-F192 VanDerWaalsContact O-N 3.14Å; S189-F192 PolarHBondContact O-N 3.41Å; F192-K196 VanDerWaalsContact O-CB 3.29Å; F192-K196 WeakPolarHBondContact O-CB 3.39Å; F192-K196 PolarHBondContact O-N 3.48Å; F192-I378 HydrophobicContact CE1-CD1 3.63Å; F192-I378 HydrophobicContact CE2-CD1 4.41Å; F192-I378 HydrophobicContact CZ-CD1 3.44Å; F192-I378 VanDerWaalsContact CZ-CD1 3.44Å
193Q74Confident72.8Confident84 Ų8457 Ų5739%0.39327%0.273SS..Hα-helixtrans-65.4-39.8173.6-73-173.324.600111.6S189 E190 L191 K196 R197S189-Q193 WeakPolarHBondContact O-CG 3.26Å; S189-Q193 PolarHBondContact O-N 3.36Å; E190-Q193 PolarHBondContact O-N 2.97Å; L191-Q193 VanDerWaalsContact C-N 3.32Å; L191-Q193 PolarHBondContact O-N 3.47Å; Q193-K196 PolarHBondContact O-N 3.3Å; Q193-R197 WeakPolarHBondContact O-CB 3.44Å; Q193-R197 WeakPolarHBondContact O-CG 3.5Å; Q193-R197 PolarHBondContact O-N 3.33Å
194E76.9Confident72.7Confident52 Ų5256.6 Ų56.624%0.24327%0.273CS..Hα-helixtrans-68.5-43.2176.9-166.958.2-150.700112E190 L191 K196 R197 D198 R201E190-E194 WeakPolarHBondContact O-CB 3.32Å; E190-E194 PolarHBondContact O-N 3.06Å; L191-E194 PolarHBondContact O-N 3Å; E194-K196 VanDerWaalsContact C-N 3.29Å; E194-K196 PolarHBondContact O-N 3.5Å; E194-R197 PolarHBondContact O-N 2.9Å; E194-R197 VanDerWaalsContact O-N 3.16Å; E194-R197 IonicContact OE2-CZ 3.23Å; E194-R197 VanDerWaalsContact OE2-CZ 3.23Å; E194-R197 IonicContact OE2-NE 2.9Å; E194-R197 PolarHBondContact OE2-NE 3.21Å; E194-R197 IonicContact OE2-NH2 3.54Å; E194-R197 PolarHBondContact OE2-NH2 3.41Å; E194-D198 WeakPolarHBondContact O-CB 3.12Å; E194-D198 PolarHBondContact O-N 3.07Å; E194-R201 IonicContact OE1-CZ 3.76Å; E194-R201 IonicContact OE1-NH1 3.58Å; E194-R201 PolarHBondContact OE1-NH1 3.19Å; E194-R201 IonicContact OE1-NH2 2.71Å; E194-R201 PolarHBondContact OE1-NH2 3.29Å
195A76.6Confident72.6Confident14 Ų1463 Ų6312%0.11630%0.299CS..Hα-helixtrans-60-40.7173.700000111.9L191 L199 V380 Y410L191-A195 WeakPolarHBondContact O-CB 3.4Å; L191-A195 PolarHBondContact O-N 2.96Å; A195-L199 WeakPolarHBondContact O-CB 3.41Å; A195-L199 PolarHBondContact O-N 3.4Å; A195-V380 HydrophobicContact CB-CG2 4.45Å; A195-Y410 WeakPolarHBondContact CA-OH 3.43Å; A195-Y410 HydrophobicContact CB-CD1 4.41Å; A195-Y410 HydrophobicContact CB-CD2 4.07Å; A195-Y410 HydrophobicContact CB-CE1 4.04Å; A195-Y410 HydrophobicContact CB-CE2 3.68Å; A195-Y410 HydrophobicContact CB-CG 4.42Å
196K74.7Confident72.4Confident49 Ų4960.4 Ų60.421%0.21329%0.287CS..Hα-helixtrans-63.4-46.9172.8-174.3-178.567.61600111.4F192 Q193 E194 D198 L199 V200 D221F192-K196 VanDerWaalsContact O-CB 3.29Å; F192-K196 WeakPolarHBondContact O-CB 3.39Å; F192-K196 PolarHBondContact O-N 3.48Å; Q193-K196 PolarHBondContact O-N 3.3Å; E194-K196 VanDerWaalsContact C-N 3.29Å; E194-K196 PolarHBondContact O-N 3.5Å; K196-D198 PolarHBondContact O-N 3.39Å; K196-L199 PolarHBondContact O-N 2.85Å; K196-V200 HydrophobicContact CG-CG2 4.48Å; K196-V200 WeakPolarHBondContact O-CB 2.97Å; K196-V200 VanDerWaalsContact O-CG2 3.31Å; K196-V200 WeakPolarHBondContact O-CG2 3.36Å; K196-V200 PolarHBondContact O-N 3.42Å; K196-D221 WeakPolarHBondContact CD-OD1 3.42Å; K196-D221 WeakPolarHBondContact CE-OD1 3.23Å; K196-D221 IonicContact NZ-OD1 2.82Å; K196-D221 PolarHBondContact NZ-OD1 2.81Å
197R76.5Confident71.7Confident113 Ų11363.2 Ų63.243%0.42630%0.299SS..Hα-helixtrans-60.5-44.6177.8-78.8-169-70.7-120.42.1111.3Q193 E194 V200 R201Q193-R197 WeakPolarHBondContact O-CB 3.44Å; Q193-R197 WeakPolarHBondContact O-CG 3.5Å; Q193-R197 PolarHBondContact O-N 3.33Å; E194-R197 PolarHBondContact O-N 2.9Å; E194-R197 VanDerWaalsContact O-N 3.16Å; E194-R197 IonicContact OE2-CZ 3.23Å; E194-R197 VanDerWaalsContact OE2-CZ 3.23Å; E194-R197 IonicContact OE2-NE 2.9Å; E194-R197 PolarHBondContact OE2-NE 3.21Å; E194-R197 IonicContact OE2-NH2 3.54Å; E194-R197 PolarHBondContact OE2-NH2 3.41Å; R197-V200 PolarHBondContact O-N 3.34Å; R197-R201 WeakPolarHBondContact O-CB 3.41Å; R197-R201 WeakPolarHBondContact O-CG 3.4Å; R197-R201 PolarHBondContact O-N 3.01Å
198D78.4Confident70.8Confident18 Ų1867.8 Ų67.810%0.09632%0.317CS..Hα-helixtrans-61.9-44.4177.3-78.1-21.3000111.9E194 K196 R201 E202 L406 K408 Y410E194-D198 WeakPolarHBondContact O-CB 3.12Å; E194-D198 PolarHBondContact O-N 3.07Å; K196-D198 PolarHBondContact O-N 3.39Å; D198-R201 PolarHBondContact O-N 3.15Å; D198-R201 IonicContact OD1-CZ 3.9Å; D198-R201 IonicContact OD1-NH1 3.75Å; D198-R201 PolarHBondContact OD1-NH1 3.49Å; D198-E202 WeakPolarHBondContact O-CB 3.28Å; D198-E202 PolarHBondContact O-N 2.88Å; D198-L406 HydrophobicContact CB-CD2 4.32Å; D198-K408 IonicContact OD2-NZ 2.71Å; D198-K408 PolarHBondContact OD2-NZ 3.01Å; D198-Y410 WeakPolarHBondContact CB-OH 3.39Å; D198-Y410 PolarHBondContact OD2-OH 3.19Å
199L75.3Confident70.1Confident39 Ų3975.4 Ų75.420%0.20435%0.352CS..Hα-helixtrans-61.6-45.9175.8-177.667.4000112A195 K196 E202 A203 Y382 L406A195-L199 WeakPolarHBondContact O-CB 3.41Å; A195-L199 PolarHBondContact O-N 3.4Å; K196-L199 PolarHBondContact O-N 2.85Å; L199-E202 PolarHBondContact O-N 2.94Å; L199-A203 WeakPolarHBondContact O-CB 3.37Å; L199-A203 PolarHBondContact O-N 3.22Å; L199-Y382 HydrophobicContact CD1-CD1 3.59Å; L199-Y382 HydrophobicContact CD1-CD2 3.72Å; L199-Y382 HydrophobicContact CD1-CE1 4.06Å; L199-Y382 HydrophobicContact CD1-CE2 4.22Å; L199-Y382 HydrophobicContact CD1-CG 3.38Å; L199-L406 HydrophobicContact CB-CD2 4.45Å; L199-L406 HydrophobicContact CD1-CD2 4.43Å
200V75.4Confident69.4Low33 Ų3379.7 Ų79.720%0.237%0.37CS..Hα-helixtrans-66.7-43.5178.9171.80000110.9K196 R197 E202 A203 I204K196-V200 HydrophobicContact CG-CG2 4.48Å; K196-V200 WeakPolarHBondContact O-CB 2.97Å; K196-V200 VanDerWaalsContact O-CG2 3.31Å; K196-V200 WeakPolarHBondContact O-CG2 3.36Å; K196-V200 PolarHBondContact O-N 3.42Å; R197-V200 PolarHBondContact O-N 3.34Å; V200-E202 VanDerWaalsContact C-N 3.34Å; V200-E202 PolarHBondContact O-N 3.24Å; V200-A203 PolarHBondContact O-N 3.36Å; V200-I204 HydrophobicContact CG1-CD1 3.65Å; V200-I204 HydrophobicContact CG1-CG1 4.35Å; V200-I204 WeakPolarHBondContact O-CB 3.08Å; V200-I204 WeakPolarHBondContact O-CD1 3.24Å; V200-I204 WeakPolarHBondContact O-CG1 3.06Å; V200-I204 PolarHBondContact O-N 3.27Å
201R74.6Confident68.7Low112 Ų11279.3 Ų79.342%0.42337%0.372SS..Hα-helixtrans-58.1-47.3175.3-76.2173.8-161.5139.8-1.6110.9E194 R197 D198 I204 K205E194-R201 IonicContact OE1-CZ 3.76Å; E194-R201 IonicContact OE1-NH1 3.58Å; E194-R201 PolarHBondContact OE1-NH1 3.19Å; E194-R201 IonicContact OE1-NH2 2.71Å; E194-R201 PolarHBondContact OE1-NH2 3.29Å; R197-R201 WeakPolarHBondContact O-CB 3.41Å; R197-R201 WeakPolarHBondContact O-CG 3.4Å; R197-R201 PolarHBondContact O-N 3.01Å; D198-R201 PolarHBondContact O-N 3.15Å; D198-R201 IonicContact OD1-CZ 3.9Å; D198-R201 IonicContact OD1-NH1 3.75Å; D198-R201 PolarHBondContact OD1-NH1 3.49Å; R201-I204 PolarHBondContact O-N 2.94Å; R201-K205 WeakPolarHBondContact O-CG 3.12Å; R201-K205 PolarHBondContact O-N 3.24Å; R201-K205 VanDerWaalsContact O-N 3.12Å
202E73.9Confident68.1Low40 Ų4081.7 Ų81.719%0.18739%0.385CS..Hα-helixtrans-67.5-38.7-178.3-161.565.6-168.100111.8D198 L199 V200 I204 K205 A404 L406D198-E202 WeakPolarHBondContact O-CB 3.28Å; D198-E202 PolarHBondContact O-N 2.88Å; L199-E202 PolarHBondContact O-N 2.94Å; V200-E202 VanDerWaalsContact C-N 3.34Å; V200-E202 PolarHBondContact O-N 3.24Å; E202-I204 VanDerWaalsContact C-N 3.32Å; E202-I204 PolarHBondContact O-N 3.14Å; E202-K205 PolarHBondContact O-N 3.15Å; E202-K205 WeakPolarHBondContact OE2-CD 3.38Å; E202-K205 IonicContact OE2-NZ 3.45Å; E202-K205 PolarHBondContact OE2-NZ 3.45Å; E202-A404 HydrophobicContact CG-CB 3.99Å; E202-L406 HydrophobicContact CB-CB 4.49Å; E202-L406 HydrophobicContact CG-CB 4.19Å
203A70.8Confident67.7Low3 Ų379.1 Ų79.13%0.02538%0.375CS..Hα-helixtrans-69.3-26.4175.100000113.9L199 V200 L217 Y382L199-A203 WeakPolarHBondContact O-CB 3.37Å; L199-A203 PolarHBondContact O-N 3.22Å; V200-A203 PolarHBondContact O-N 3.36Å; A203-L217 HydrophobicContact CB-CD1 3.26Å; A203-Y382 HydrophobicContact CB-CE1 4.36Å
204I67.6Low67.2Low82 Ų8276.1 Ų76.142%0.42136%0.363SS..Hα-helixtrans-74.7-35173.5-70165.4000111.1V200 R201 E202 V206 E207V200-I204 HydrophobicContact CG1-CD1 3.65Å; V200-I204 HydrophobicContact CG1-CG1 4.35Å; V200-I204 WeakPolarHBondContact O-CB 3.08Å; V200-I204 WeakPolarHBondContact O-CD1 3.24Å; V200-I204 WeakPolarHBondContact O-CG1 3.06Å; V200-I204 PolarHBondContact O-N 3.27Å; R201-I204 PolarHBondContact O-N 2.94Å; E202-I204 VanDerWaalsContact C-N 3.32Å; E202-I204 PolarHBondContact O-N 3.14Å; I204-V206 PolarHBondContact O-N 3.37Å; I204-E207 WeakPolarHBondContact O-CB 3.5Å; I204-E207 PolarHBondContact O-N 3.07Å
205K67.9Low66.6Low150 Ų15078.5 Ų78.565%0.65238%0.377SS*.Hα-helixtrans-62.4-24.2176.8-71.1177.5-166.5163.10113.6R201 E202 E207R201-K205 WeakPolarHBondContact O-CG 3.12Å; R201-K205 PolarHBondContact O-N 3.24Å; R201-K205 VanDerWaalsContact O-N 3.12Å; E202-K205 PolarHBondContact O-N 3.15Å; E202-K205 WeakPolarHBondContact OE2-CD 3.38Å; E202-K205 IonicContact OE2-NZ 3.45Å; E202-K205 PolarHBondContact OE2-NZ 3.45Å; K205-E207 PolarHBondContact O-N 3.3Å
206V65.8Low66.1Low26 Ų2685.5 Ų85.516%0.15840%0.401CS..THydrogen-bonded Turntrans-69.7-10.7175.6169.70000112I204 Q208 I384 L403 A404I204-V206 PolarHBondContact O-N 3.37Å; V206-Q208 PolarHBondContact O-N 2.75Å; V206-I384 HydrophobicContact CB-CD1 4.33Å; V206-I384 HydrophobicContact CG1-CD1 4.13Å; V206-I384 HydrophobicContact CG1-CG2 4.38Å; V206-I384 HydrophobicContact CG2-CD1 3.76Å; V206-L403 HydrophobicContact CG1-CB 4.09Å; V206-L403 HydrophobicContact CG1-CD2 3.6Å; V206-L403 HydrophobicContact CG1-CG 4.39Å; V206-L403 HydrophobicContact CG2-CB 4.21Å; V206-A404 HydrophobicContact CG2-CB 3.32Å
207E55.1Low65.7Low78 Ų7884.7 Ų84.736%0.36440%0.399SS..  trans-78.7100.8-177.9-154.3171.1-145.100112I204 K205 L211 V214I204-E207 WeakPolarHBondContact O-CB 3.5Å; I204-E207 PolarHBondContact O-N 3.07Å; K205-E207 PolarHBondContact O-N 3.3Å; E207-L211 WeakPolarHBondContact OE1-CA 3.31Å; E207-V214 HydrophobicContact CG-CG2 4.48Å
208Q50.3Low65.2Low188 Ų18887.4 Ų87.488%0.87941%0.409SS*.SBendtrans-121.9-3.9138.8-133.3169.6-0.200115.3V206V206-Q208 PolarHBondContact O-N 2.75Å
209E53.7Low64.7Low169 Ų16993.2 Ų93.279%0.7943%0.433SS*.SBendtrans-145-5.6-179.2-68.3-170.1163.600119.9
210E54.8Low64.3Low112 Ų11296.6 Ų96.652%0.52345%0.447SS..  trans-132.391.1-178.9-71.5-156.6174.100116.8N212 I213E210-N212 PolarHBondContact O-N 3.49Å; E210-I213 HydrophobicContact CB-CD1 4.39Å; E210-I213 PolarHBondContact O-N 3Å
211L56.5Low63.8Low139 Ų13998.1 Ų98.173%0.72845%0.453SS*.Hα-helixtrans-52.7-20173.4-79.3155.3000115.1E207 N215E207-L211 WeakPolarHBondContact OE1-CA 3.31Å; L211-N215 PolarHBondContact O-N 2.9Å
212N60.4Low63.5Low105 Ų105100 Ų10056%0.56147%0.467SS*.Hα-helixtrans-76-27-176.1-79.1-27000114.2E210 R216E210-N212 PolarHBondContact O-N 3.49Å; N212-R216 WeakPolarHBondContact O-CG 3.35Å; N212-R216 PolarHBondContact O-N 3.28Å; N212-R216 PolarHBondContact O-NE 2.91Å
213I62.2Low62.8Low55 Ų55105.7 Ų105.728%0.28249%0.491SS..Hα-helixtrans-78.9-44.7-178.1-62.8173.9000110.1E210 N215 R216 L217E210-I213 HydrophobicContact CB-CD1 4.39Å; E210-I213 PolarHBondContact O-N 3Å; I213-N215 VanDerWaalsContact C-N 3.32Å; I213-N215 PolarHBondContact O-N 3.38Å; I213-R216 PolarHBondContact O-N 3.08Å; I213-L217 HydrophobicContact CG2-CD1 3.84Å; I213-L217 HydrophobicContact CG2-CG 4.44Å; I213-L217 WeakPolarHBondContact O-CG 3.32Å; I213-L217 PolarHBondContact O-N 3.38Å
214V63.1Low62.5Low21 Ų21107.9 Ų107.913%0.12750%0.504CS..Hα-helixtrans-61.1-42.2176.7178.20000111.1E207 R216 L217 R218E207-V214 HydrophobicContact CG-CG2 4.48Å; V214-R216 VanDerWaalsContact C-N 3.34Å; V214-R216 PolarHBondContact O-N 3.17Å; V214-L217 PolarHBondContact O-N 3.38Å; V214-R218 WeakPolarHBondContact O-CB 3.38Å; V214-R218 PolarHBondContact O-N 2.85Å
215N65.8Low62.4Low103 Ų103110.4 Ų110.455%0.55151%0.514SS*.Hα-helixtrans-65.9-37.2178-126.25000112L211 I213 K219L211-N215 PolarHBondContact O-N 2.9Å; I213-N215 VanDerWaalsContact C-N 3.32Å; I213-N215 PolarHBondContact O-N 3.38Å; N215-K219 VanDerWaalsContact O-CB 3.24Å; N215-K219 WeakPolarHBondContact O-CB 3.3Å; N215-K219 PolarHBondContact O-N 3.34Å
216R66.4Low62.2Low161 Ų161109.3 Ų109.361%0.60851%0.514SS*.Hα-helixtrans-67-39.7173.8-83-173.5-81.5-114.84.3112.4N212 I213 V214 K219 F220N212-R216 WeakPolarHBondContact O-CG 3.35Å; N212-R216 PolarHBondContact O-N 3.28Å; N212-R216 PolarHBondContact O-NE 2.91Å; I213-R216 PolarHBondContact O-N 3.08Å; V214-R216 VanDerWaalsContact C-N 3.34Å; V214-R216 PolarHBondContact O-N 3.17Å; R216-K219 PolarHBondContact O-N 3.17Å; R216-F220 WeakPolarHBondContact O-CB 3.31Å; R216-F220 PolarHBondContact O-N 3.26Å
217L65.8Low62.4Low32 Ų32111.7 Ų111.717%0.16853%0.526CS..Hα-helixtrans-72.4-38.5178.4-71.7169.9000112.6A203 I213 V214 K219 F220 D221A203-L217 HydrophobicContact CB-CD1 3.26Å; I213-L217 HydrophobicContact CG2-CD1 3.84Å; I213-L217 HydrophobicContact CG2-CG 4.44Å; I213-L217 WeakPolarHBondContact O-CG 3.32Å; I213-L217 PolarHBondContact O-N 3.38Å; V214-L217 PolarHBondContact O-N 3.38Å; L217-K219 VanDerWaalsContact C-N 3.3Å; L217-K219 PolarHBondContact O-N 3.43Å; L217-F220 WeakPolarHBondContact O-CB 3.36Å; L217-F220 PolarHBondContact O-N 2.87Å; L217-D221 WeakPolarHBondContact O-CB 3.43Å; L217-D221 PolarHBondContact O-N 3.23Å
218R65.1Low63.1Low169 Ų169109.8 Ų109.864%0.63852%0.52SS*.Hα-helixtrans-65.2-36.5172.1-168.5-176.9-76.8169.5-3.7111.2V214 D221 H222V214-R218 WeakPolarHBondContact O-CB 3.38Å; V214-R218 PolarHBondContact O-N 2.85Å; R218-D221 WeakPolarHBondContact O-CB 3.41Å; R218-D221 PolarHBondContact O-N 3.45Å; R218-H222 PolarHBondContact O-N 2.9Å
219K68.1Low64.2Low140 Ų140103.9 Ų103.961%0.60950%0.499SS*.Hα-helixtrans-66.9-41.2172.5-157.1174.1-171178.60111.3N215 R216 L217 H222 F223N215-K219 VanDerWaalsContact O-CB 3.24Å; N215-K219 WeakPolarHBondContact O-CB 3.3Å; N215-K219 PolarHBondContact O-N 3.34Å; R216-K219 PolarHBondContact O-N 3.17Å; L217-K219 VanDerWaalsContact C-N 3.3Å; L217-K219 PolarHBondContact O-N 3.43Å; K219-H222 PolarHBondContact O-N 3.31Å; K219-F223 HydrophobicContact CD-CE2 4.41Å; K219-F223 HydrophobicContact CG-CD2 4.05Å; K219-F223 HydrophobicContact CG-CE2 3.83Å; K219-F223 WeakPolarHBondContact O-CD2 3.49Å; K219-F223 PolarHBondContact O-N 2.97Å; K219-F223 VanDerWaalsContact O-N 3.08Å
220F66.4Low65.3Low111 Ų111102.6 Ų102.649%0.48749%0.491SS..Hα-helixtrans-62.7-39.7173.8-178.8-98.7000112.6R216 L217 H222 F223 T224R216-F220 WeakPolarHBondContact O-CB 3.31Å; R216-F220 PolarHBondContact O-N 3.26Å; L217-F220 WeakPolarHBondContact O-CB 3.36Å; L217-F220 PolarHBondContact O-N 2.87Å; F220-H222 VanDerWaalsContact C-N 3.32Å; F220-H222 PolarHBondContact O-N 3.45Å; F220-F223 PolarHBondContact O-N 2.97Å; F220-T224 HydrophobicContact CD1-CG2 4.28Å; F220-T224 HydrophobicContact CD2-CG2 4.08Å; F220-T224 HydrophobicContact CE1-CG2 3.93Å; F220-T224 HydrophobicContact CE2-CG2 3.71Å; F220-T224 HydrophobicContact CG-CG2 4.35Å; F220-T224 HydrophobicContact CZ-CG2 3.64Å; F220-T224 WeakPolarHBondContact O-CB 3.26Å; F220-T224 WeakPolarHBondContact O-CG2 3.36Å; F220-T224 PolarHBondContact O-N 3.29Å; F220-T224 PolarHBondContact O-OG1 2.95Å
221D66.1Low66.2Low64 Ų64100.6 Ų100.634%0.34249%0.486SS..Hα-helixtrans-59-41.9175.1-177.562000112.2K196 L217 R218K196-D221 WeakPolarHBondContact CD-OD1 3.42Å; K196-D221 WeakPolarHBondContact CE-OD1 3.23Å; K196-D221 IonicContact NZ-OD1 2.82Å; K196-D221 PolarHBondContact NZ-OD1 2.81Å; L217-D221 WeakPolarHBondContact O-CB 3.43Å; L217-D221 PolarHBondContact O-N 3.23Å; R218-D221 WeakPolarHBondContact O-CB 3.41Å; R218-D221 PolarHBondContact O-N 3.45Å
222H67.1Low67Low153 Ų15399.1 Ų99.171%0.70847%0.474SS*.Hα-helixtrans-69.1-40.9176.2-168.565.8000112.7R218 K219 F220 T224R218-H222 PolarHBondContact O-N 2.9Å; K219-H222 PolarHBondContact O-N 3.31Å; F220-H222 VanDerWaalsContact C-N 3.32Å; F220-H222 PolarHBondContact O-N 3.45Å; H222-T224 VanDerWaalsContact C-N 3.35Å; H222-T224 PolarHBondContact O-N 2.89Å
223F59.6Low67.9Low159 Ų15998.9 Ų98.970%0.69747%0.472SS*.Hα-helixtrans-71.7-24.8179.9-85.7-68.4000114.2K219 F220K219-F223 HydrophobicContact CD-CE2 4.41Å; K219-F223 HydrophobicContact CG-CD2 4.05Å; K219-F223 HydrophobicContact CG-CE2 3.83Å; K219-F223 WeakPolarHBondContact O-CD2 3.49Å; K219-F223 PolarHBondContact O-N 2.97Å; K219-F223 VanDerWaalsContact O-N 3.08Å; F220-F223 PolarHBondContact O-N 2.97Å
224T64.1Low68.8Low49 Ų49100.1 Ų100.130%0.30148%0.483SS..THydrogen-bonded Turntrans-98.714-176.455.90000113.7F220 H222 I226F220-T224 HydrophobicContact CD1-CG2 4.28Å; F220-T224 HydrophobicContact CD2-CG2 4.08Å; F220-T224 HydrophobicContact CE1-CG2 3.93Å; F220-T224 HydrophobicContact CE2-CG2 3.71Å; F220-T224 HydrophobicContact CG-CG2 4.35Å; F220-T224 HydrophobicContact CZ-CG2 3.64Å; F220-T224 WeakPolarHBondContact O-CB 3.26Å; F220-T224 WeakPolarHBondContact O-CG2 3.36Å; F220-T224 PolarHBondContact O-N 3.29Å; F220-T224 PolarHBondContact O-OG1 2.95Å; H222-T224 VanDerWaalsContact C-N 3.35Å; H222-T224 PolarHBondContact O-N 2.89Å; T224-I226 PolarHBondContact O-N 3.46Å
225H65.7Low69.4Low134 Ų134102.4 Ų102.462%0.6249%0.491SS*.  trans-69.496.8174-169.978.5000110.5D227H225-D227 PolarHBondContact O-N 3.44Å
226I65Low69.8Low127 Ų12799.4 Ų99.465%0.65148%0.476SS*.  trans-84.1111.6175-60.6170.7000107.9T224 V228T224-I226 PolarHBondContact O-N 3.46Å; I226-V228 PolarHBondContact O-N 3.21Å
227D68.7Low70.5Confident76 Ų7695.9 Ų95.941%0.40647%0.473SS..  trans-73.492.5173.9-172.7-12.4000110.3H225 S229 K230 V231H225-D227 PolarHBondContact O-N 3.44Å; D227-S229 PolarHBondContact O-N 3.31Å; D227-S229 WeakPolarHBondContact OD1-CB 3.32Å; D227-S229 PolarHBondContact OD1-N 3.36Å; D227-S229 PolarHBondContact OD1-OG 2.87Å; D227-K230 HydrophobicContact CB-CB 4.12Å; D227-K230 PolarHBondContact O-N 3.35Å; D227-K230 PolarHBondContact OD1-N 3.44Å; D227-V231 PolarHBondContact O-N 3.33Å
228V70.3Confident71.3Confident39 Ų3997.8 Ų97.824%0.23649%0.485CS..Hα-helixtrans-52.3-35.9175.8161.30000112.3L186 I226 K232L186-V228 HydrophobicContact CB-CG1 3.92Å; L186-V228 HydrophobicContact CD1-CG1 3.85Å; L186-V228 HydrophobicContact CD2-CB 3.86Å; L186-V228 HydrophobicContact CD2-CG1 3.33Å; L186-V228 HydrophobicContact CD2-CG2 3.89Å; L186-V228 HydrophobicContact CG-CG1 3.83Å; I226-V228 PolarHBondContact O-N 3.21Å; V228-K232 PolarHBondContact O-N 3.26Å; V228-K232 VanDerWaalsContact O-N 3.13Å
229S73Confident71.7Confident64 Ų6490.4 Ų90.445%0.44846%0.46SS..Hα-helixtrans-71.5-37.2-177.477.80000112D227 K232 N233D227-S229 PolarHBondContact O-N 3.31Å; D227-S229 WeakPolarHBondContact OD1-CB 3.32Å; D227-S229 PolarHBondContact OD1-N 3.36Å; D227-S229 PolarHBondContact OD1-OG 2.87Å; S229-K232 PolarHBondContact O-N 3.01Å; S229-N233 WeakPolarHBondContact O-CB 3.47Å; S229-N233 VanDerWaalsContact O-CG 3.25Å; S229-N233 PolarHBondContact O-N 2.99Å; S229-N233 PolarHBondContact O-ND2 2.87Å
230K77.1Confident72.1Confident142 Ų14289.8 Ų89.862%0.61746%0.457SS*.Hα-helixtrans-66.2-45.2176.8-170.6174-177.8177.70111.5D227 K232 N233 T234D227-K230 HydrophobicContact CB-CB 4.12Å; D227-K230 PolarHBondContact O-N 3.35Å; D227-K230 PolarHBondContact OD1-N 3.44Å; K230-K232 PolarHBondContact O-N 3.11Å; K230-N233 PolarHBondContact O-N 2.69Å; K230-T234 PolarHBondContact O-N 3.47Å; K230-T234 PolarHBondContact O-OG1 3.47Å; K230-T234 VanDerWaalsContact O-OG1 3.09Å
231V74.6Confident72.9Confident70 Ų7090 Ų9042%0.42446%0.46SS..Hα-helixtrans-60.8-45.5177.4177.80000110.9D227 N233 T234 F235D227-V231 PolarHBondContact O-N 3.33Å; V231-N233 PolarHBondContact O-N 3.17Å; V231-T234 PolarHBondContact O-N 3.47Å; V231-F235 WeakPolarHBondContact O-CB 3.43Å; V231-F235 PolarHBondContact O-N 3.48Å; V231-F235 VanDerWaalsContact O-N 3.14Å
232K73.4Confident73.4Confident108 Ų10890.3 Ų90.347%0.4746%0.461SS..Hα-helixtrans-56.4-50174.9-171178.9177.31790111.9L186 V228 S229 K230 F235 V236L186-K232 HydrophobicContact CD1-CB 3.72Å; L186-K232 HydrophobicContact CD1-CD 4.22Å; L186-K232 HydrophobicContact CD1-CG 4.1Å; V228-K232 PolarHBondContact O-N 3.26Å; V228-K232 VanDerWaalsContact O-N 3.13Å; S229-K232 PolarHBondContact O-N 3.01Å; K230-K232 PolarHBondContact O-N 3.11Å; K232-F235 PolarHBondContact O-N 2.89Å; K232-V236 WeakPolarHBondContact O-CG2 3.34Å; K232-V236 PolarHBondContact O-N 2.8Å; K232-V236 VanDerWaalsContact O-N 3.11Å
233N78.4Confident73.7Confident99 Ų9987.4 Ų87.453%0.52945%0.448SS..Hα-helixtrans-67.9-38.4-176.2-73.8-15.1000112.7S229 K230 V231 F235 T237S229-N233 WeakPolarHBondContact O-CB 3.47Å; S229-N233 VanDerWaalsContact O-CG 3.25Å; S229-N233 PolarHBondContact O-N 2.99Å; S229-N233 PolarHBondContact O-ND2 2.87Å; K230-N233 PolarHBondContact O-N 2.69Å; V231-N233 PolarHBondContact O-N 3.17Å; N233-F235 VanDerWaalsContact C-N 3.35Å; N233-T237 VanDerWaalsContact O-CB 3.31Å; N233-T237 WeakPolarHBondContact O-CB 3.37Å; N233-T237 PolarHBondContact O-N 2.94Å; N233-T237 PolarHBondContact O-OG1 3.18Å
234T81.3Confident74.7Confident81 Ų8182.6 Ų82.650%0.49743%0.433SS..Hα-helixtrans-62-44.7174.9-61.50000110.9K230 V231 T237 V238K230-T234 PolarHBondContact O-N 3.47Å; K230-T234 PolarHBondContact O-OG1 3.47Å; K230-T234 VanDerWaalsContact O-OG1 3.09Å; V231-T234 PolarHBondContact O-N 3.47Å; T234-T237 PolarHBondContact O-N 3.32Å; T234-V238 WeakPolarHBondContact O-CG2 3.17Å; T234-V238 PolarHBondContact O-N 3.49Å
235F75Confident75.6Confident70 Ų7083.6 Ų83.631%0.30744%0.437SS..Hα-helixtrans-66.6-44.4-176.9-160.8-84.8000113.1S178 V182 V231 K232 N233 T237 S239S178-F235 VanDerWaalsContact CB-CE1 3.42Å; S178-F235 WeakPolarHBondContact OG-CE1 3.3Å; S178-F235 WeakPolarHBondContact OG-CZ 3.37Å; V182-F235 HydrophobicContact CG2-CB 4.39Å; V182-F235 HydrophobicContact CG2-CD1 4.12Å; V182-F235 HydrophobicContact CG2-CD2 4.13Å; V182-F235 HydrophobicContact CG2-CG 3.9Å; V231-F235 WeakPolarHBondContact O-CB 3.43Å; V231-F235 PolarHBondContact O-N 3.48Å; V231-F235 VanDerWaalsContact O-N 3.14Å; K232-F235 PolarHBondContact O-N 2.89Å; N233-F235 VanDerWaalsContact C-N 3.35Å; F235-T237 VanDerWaalsContact C-N 3.32Å; F235-T237 PolarHBondContact O-N 3.13Å; F235-S239 WeakPolarHBondContact O-CB 3.28Å; F235-S239 PolarHBondContact O-N 2.86Å; F235-S239 VanDerWaalsContact O-N 3.11Å; F235-S239 PolarHBondContact O-OG 3.06Å
236V74.4Confident76.1Confident39 Ų3980.1 Ų80.124%0.23642%0.42CS..Hα-helixtrans-62.5-40.1175.3171.50000111.2K232 K240K232-V236 WeakPolarHBondContact O-CG2 3.34Å; K232-V236 PolarHBondContact O-N 2.8Å; K232-V236 VanDerWaalsContact O-N 3.11Å; V236-K240 HydrophobicContact CG1-CD 4.08Å; V236-K240 WeakPolarHBondContact O-CB 3.45Å; V236-K240 WeakPolarHBondContact O-CG 3.4Å; V236-K240 PolarHBondContact O-N 2.91Å
237T82.3Confident76.7Confident87 Ų8776.7 Ų76.753%0.53441%0.408SS..Hα-helixtrans-64.2-49.8179.3-59.60000111.8N233 T234 F235 S239 K240 Q241N233-T237 VanDerWaalsContact O-CB 3.31Å; N233-T237 WeakPolarHBondContact O-CB 3.37Å; N233-T237 PolarHBondContact O-N 2.94Å; N233-T237 PolarHBondContact O-OG1 3.18Å; T234-T237 PolarHBondContact O-N 3.32Å; F235-T237 VanDerWaalsContact C-N 3.32Å; F235-T237 PolarHBondContact O-N 3.13Å; T237-S239 VanDerWaalsContact C-N 3.34Å; T237-S239 PolarHBondContact O-N 3.28Å; T237-K240 PolarHBondContact O-N 3.35Å; T237-Q241 WeakPolarHBondContact O-CB 3.33Å; T237-Q241 PolarHBondContact O-N 3.45Å
238V81.5Confident77.3Confident72 Ų7279.5 Ų79.544%0.43641%0.412SS..Hα-helixtrans-61.3-43.8179.81720000111T234 K240 Q241 I242T234-V238 WeakPolarHBondContact O-CG2 3.17Å; T234-V238 PolarHBondContact O-N 3.49Å; V238-K240 PolarHBondContact O-N 3.42Å; V238-Q241 PolarHBondContact O-N 3.07Å; V238-I242 HydrophobicContact CG1-CD1 4.02Å; V238-I242 WeakPolarHBondContact O-CG1 3.45Å; V238-I242 PolarHBondContact O-N 3.45Å
239S72.6Confident77.6Confident15 Ų1579.8 Ų79.811%0.10542%0.419CS..Hα-helixtrans-63.8-42.8180-58.50000112.6F235 T237 Q241 E243F235-S239 WeakPolarHBondContact O-CB 3.28Å; F235-S239 PolarHBondContact O-N 2.86Å; F235-S239 VanDerWaalsContact O-N 3.11Å; F235-S239 PolarHBondContact O-OG 3.06Å; T237-S239 VanDerWaalsContact C-N 3.34Å; T237-S239 PolarHBondContact O-N 3.28Å; S239-Q241 VanDerWaalsContact C-N 3.33Å; S239-Q241 PolarHBondContact O-N 2.89Å; S239-E243 PolarHBondContact O-N 2.99Å
240K76.8Confident77.7Confident126 Ų12677.9 Ų77.955%0.54840%0.403SS..Hα-helixtrans-65-36.1175.5-77.6-179.8178.2178.80112.6V236 T237 V238 S244V236-K240 HydrophobicContact CG1-CD 4.08Å; V236-K240 WeakPolarHBondContact O-CB 3.45Å; V236-K240 WeakPolarHBondContact O-CG 3.4Å; V236-K240 PolarHBondContact O-N 2.91Å; T237-K240 PolarHBondContact O-N 3.35Å; V238-K240 PolarHBondContact O-N 3.42Å; K240-S244 WeakPolarHBondContact O-CB 3.24Å; K240-S244 PolarHBondContact O-N 3.41Å
241Q83Confident77.8Confident117 Ų11777.3 Ų77.355%0.54740%0.401SS..Hα-helixtrans-64.9-45.5179.7-174.4172.8-7.100111.5T237 V238 S239 E243 S244 D245T237-Q241 WeakPolarHBondContact O-CB 3.33Å; T237-Q241 PolarHBondContact O-N 3.45Å; V238-Q241 PolarHBondContact O-N 3.07Å; S239-Q241 VanDerWaalsContact C-N 3.33Å; S239-Q241 PolarHBondContact O-N 2.89Å; Q241-E243 PolarHBondContact O-N 3.45Å; Q241-S244 PolarHBondContact O-N 2.94Å; Q241-D245 PolarHBondContact O-N 3.35Å
242I76.7Confident78Confident70 Ų7078 Ų7836%0.35940%0.402SS..Hα-helixtrans-62.6-43.5179.6-63.5166.7000111.3M171 V238 S244 D245 F246M171-I242 HydrophobicContact CE-CG2 3.66Å; M171-I242 HydrophobicContact CG-CG2 3.73Å; M171-I242 HydrophobicContact SD-CD1 4.49Å; M171-I242 HydrophobicContact SD-CG2 3.68Å; V238-I242 HydrophobicContact CG1-CD1 4.02Å; V238-I242 WeakPolarHBondContact O-CG1 3.45Å; V238-I242 PolarHBondContact O-N 3.45Å; I242-S244 VanDerWaalsContact C-N 3.35Å; I242-S244 PolarHBondContact O-N 3.44Å; I242-D245 PolarHBondContact O-N 3.22Å; I242-F246 WeakPolarHBondContact O-CB 3.48Å; I242-F246 PolarHBondContact O-N 3.09Å; I242-F246 VanDerWaalsContact O-N 3.12Å
243E74.7Confident78Confident92 Ų9275.3 Ų75.343%0.4339%0.392SS..Hα-helixtrans-61-43.1176.2-173-176.3163.600111.9K175 S239 Q241 F246 S247K175-E243 IonicContact NZ-OE2 2.72Å; K175-E243 PolarHBondContact NZ-OE2 3.45Å; S239-E243 PolarHBondContact O-N 2.99Å; Q241-E243 PolarHBondContact O-N 3.45Å; E243-F246 PolarHBondContact O-N 3.42Å; E243-S247 WeakPolarHBondContact O-CB 3.32Å; E243-S247 PolarHBondContact O-N 3.44Å
244S80.9Confident77.7Confident57 Ų5776.6 Ų76.640%0.39940%0.395SS..Hα-helixtrans-64.5-45178.5-172.60000112.3K240 Q241 I242 F246 S247 R248K240-S244 WeakPolarHBondContact O-CB 3.24Å; K240-S244 PolarHBondContact O-N 3.41Å; Q241-S244 PolarHBondContact O-N 2.94Å; I242-S244 VanDerWaalsContact C-N 3.35Å; I242-S244 PolarHBondContact O-N 3.44Å; S244-F246 VanDerWaalsContact C-N 3.29Å; S244-F246 PolarHBondContact O-N 2.94Å; S244-S247 PolarHBondContact O-N 3.05Å; S244-R248 VanDerWaalsContact O-CB 3.31Å; S244-R248 WeakPolarHBondContact O-CB 3.46Å; S244-R248 PolarHBondContact O-N 3Å
245D81.7Confident77.3Confident70 Ų7078.7 Ų78.737%0.37440%0.403SS..Hα-helixtrans-64.5-37.3-179.7-73.6-23.9000111.4Q241 I242 R248 A249Q241-D245 PolarHBondContact O-N 3.35Å; I242-D245 PolarHBondContact O-N 3.22Å; D245-R248 IonicContact OD1-CZ 2.73Å; D245-R248 IonicContact OD1-NH1 3.64Å; D245-R248 PolarHBondContact OD1-NH1 3.48Å; D245-R248 IonicContact OD1-NH2 3.91Å; D245-A249 PolarHBondContact O-N 3.17Å
246F75.6Confident77.2Confident62 Ų6282.4 Ų82.427%0.27242%0.416SS..Hα-helixtrans-69.7-45.6176.8-158.7-105000113.7T164 M167 I242 E243 S244 R248 A249 N250T164-F246 VanDerWaalsContact CA-CZ 3.46Å; T164-F246 HydrophobicContact CG2-CD1 4.13Å; T164-F246 HydrophobicContact CG2-CD2 4.07Å; T164-F246 HydrophobicContact CG2-CE1 3.42Å; T164-F246 VanDerWaalsContact CG2-CE1 3.42Å; T164-F246 HydrophobicContact CG2-CE2 3.35Å; T164-F246 HydrophobicContact CG2-CG 4.43Å; T164-F246 HydrophobicContact CG2-CZ 3.01Å; T164-F246 WeakPolarHBondContact O-CE1 3.39Å; T164-F246 WeakPolarHBondContact O-CZ 3.44Å; M167-F246 HydrophobicContact CB-CE2 4.45Å; M167-F246 HydrophobicContact CB-CZ 3.89Å; I242-F246 WeakPolarHBondContact O-CB 3.48Å; I242-F246 PolarHBondContact O-N 3.09Å; I242-F246 VanDerWaalsContact O-N 3.12Å; E243-F246 PolarHBondContact O-N 3.42Å; S244-F246 VanDerWaalsContact C-N 3.29Å; S244-F246 PolarHBondContact O-N 2.94Å; F246-R248 VanDerWaalsContact C-N 3.28Å; F246-R248 PolarHBondContact O-N 3.32Å; F246-A249 PolarHBondContact O-N 2.99Å; F246-N250 PolarHBondContact O-N 2.9Å
247S78.9Confident77Confident55 Ų5584.4 Ų84.439%0.38542%0.422SS..Hα-helixtrans-61.3-39.3174.9-174.40000111.3E243 S244 N250 K251E243-S247 WeakPolarHBondContact O-CB 3.32Å; E243-S247 PolarHBondContact O-N 3.44Å; S244-S247 PolarHBondContact O-N 3.05Å; S247-N250 PolarHBondContact O-N 3.32Å; S247-K251 WeakPolarHBondContact O-CG 3.34Å; S247-K251 PolarHBondContact O-N 2.86Å
248R80.9Confident76.2Confident135 Ų13584.7 Ų84.751%0.50942%0.42SS..Hα-helixtrans-62.7-46.4175.4-168-174.2-59.6130.48.2111.4S244 D245 F246 N250 K251 L252S244-R248 VanDerWaalsContact O-CB 3.31Å; S244-R248 WeakPolarHBondContact O-CB 3.46Å; S244-R248 PolarHBondContact O-N 3Å; D245-R248 IonicContact OD1-CZ 2.73Å; D245-R248 IonicContact OD1-NH1 3.64Å; D245-R248 PolarHBondContact OD1-NH1 3.48Å; D245-R248 IonicContact OD1-NH2 3.91Å; F246-R248 VanDerWaalsContact C-N 3.28Å; F246-R248 PolarHBondContact O-N 3.32Å; R248-N250 VanDerWaalsContact C-N 3.34Å; R248-N250 PolarHBondContact O-N 3.45Å; R248-K251 PolarHBondContact O-N 2.88Å; R248-L252 HydrophobicContact CG-CD1 4.27Å; R248-L252 VanDerWaalsContact O-CG 3.27Å; R248-L252 WeakPolarHBondContact O-CG 3.48Å; R248-L252 PolarHBondContact O-N 2.84Å
249A75.8Confident75.6Confident44 Ų4485.7 Ų85.736%0.36442%0.422SS..Hα-helixtrans-60.1-43177.400000112.2D245 F246 L253D245-A249 PolarHBondContact O-N 3.17Å; F246-A249 PolarHBondContact O-N 2.99Å; A249-L253 WeakPolarHBondContact O-CG 3.46Å; A249-L253 PolarHBondContact O-N 2.68Å
250N75.6Confident75.5Confident24 Ų2487.4 Ų87.413%0.12843%0.434CS..Hα-helixtrans-63.5-47.3176.7-85.8-19.9000113T164 F246 S247 R248 L252 L253 E254T164-N250 WeakPolarHBondContact CB-OD1 3.37Å; T164-N250 WeakPolarHBondContact CG2-OD1 3.46Å; F246-N250 PolarHBondContact O-N 2.9Å; S247-N250 PolarHBondContact O-N 3.32Å; R248-N250 VanDerWaalsContact C-N 3.34Å; R248-N250 PolarHBondContact O-N 3.45Å; N250-L252 VanDerWaalsContact C-N 3.33Å; N250-L252 PolarHBondContact O-N 3.45Å; N250-L253 PolarHBondContact O-N 2.91Å; N250-L253 VanDerWaalsContact O-N 3.15Å; N250-E254 PolarHBondContact O-N 3.37Å
251K80.3Confident75.2Confident130 Ų13085.1 Ų85.157%0.56543%0.428SS*.Hα-helixtrans-60.2-43.6178.2-75.8-176.5178.8-177.20112.1S247 R248 L253 E254 D255S247-K251 WeakPolarHBondContact O-CG 3.34Å; S247-K251 PolarHBondContact O-N 2.86Å; R248-K251 PolarHBondContact O-N 2.88Å; K251-L253 VanDerWaalsContact C-N 3.33Å; K251-L253 PolarHBondContact O-N 3.48Å; K251-E254 PolarHBondContact O-N 3.25Å; K251-D255 PolarHBondContact O-N 2.88Å
252L78.6Confident74.8Confident84 Ų8481.1 Ų81.144%0.4441%0.408SS..Hα-helixtrans-58.7-46.3175.2-68.8171.2000110.7R248 N250 E254 D255 Y256R248-L252 HydrophobicContact CG-CD1 4.27Å; R248-L252 VanDerWaalsContact O-CG 3.27Å; R248-L252 WeakPolarHBondContact O-CG 3.48Å; R248-L252 PolarHBondContact O-N 2.84Å; N250-L252 VanDerWaalsContact C-N 3.33Å; N250-L252 PolarHBondContact O-N 3.45Å; L252-E254 VanDerWaalsContact C-N 3.34Å; L252-E254 PolarHBondContact O-N 3.5Å; L252-D255 PolarHBondContact O-N 3.08Å; L252-Y256 HydrophobicContact CB-CD2 4.32Å; L252-Y256 HydrophobicContact CB-CE2 4.28Å; L252-Y256 HydrophobicContact CD2-CE2 4.04Å; L252-Y256 WeakPolarHBondContact O-CB 3.32Å; L252-Y256 WeakPolarHBondContact O-CD2 3.37Å; L252-Y256 PolarHBondContact O-N 3.33Å
253L72.7Confident74.9Confident52 Ų5281.7 Ų81.727%0.27241%0.411SS..Hα-helixtrans-61.8-38.6178.6-74.4168.3000113.1V156 V161 A249 N250 K251 K257V156-L253 HydrophobicContact CG1-CD2 4.27Å; V161-L253 HydrophobicContact CG2-CB 4.06Å; V161-L253 HydrophobicContact CG2-CD1 4.07Å; A249-L253 WeakPolarHBondContact O-CG 3.46Å; A249-L253 PolarHBondContact O-N 2.68Å; N250-L253 PolarHBondContact O-N 2.91Å; N250-L253 VanDerWaalsContact O-N 3.15Å; K251-L253 VanDerWaalsContact C-N 3.33Å; K251-L253 PolarHBondContact O-N 3.48Å; L253-K257 WeakPolarHBondContact O-CB 3.27Å; L253-K257 PolarHBondContact O-N 2.91Å; L253-K257 VanDerWaalsContact O-N 3.13Å
254E72.9Confident75.1Confident127 Ų12780.2 Ų80.259%0.59341%0.406SS*.Hα-helixtrans-68.1-45.2176.4-75.1-172.1156.300112.6N250 K251 L252 Y256 K257N250-E254 PolarHBondContact O-N 3.37Å; K251-E254 PolarHBondContact O-N 3.25Å; L252-E254 VanDerWaalsContact C-N 3.34Å; L252-E254 PolarHBondContact O-N 3.5Å; E254-Y256 VanDerWaalsContact C-N 3.33Å; E254-Y256 PolarHBondContact O-N 3.32Å; E254-K257 WeakPolarHBondContact O-CB 3.37Å; E254-K257 PolarHBondContact O-N 3.16Å
255D72.6Confident75.1Confident124 Ų12479.6 Ų79.666%0.66340%0.403SS*.Hα-helixtrans-65-37.6179.7-71.9-24.2000111.7K251 L252K251-D255 PolarHBondContact O-N 2.88Å; L252-D255 PolarHBondContact O-N 3.08Å
256Y72.1Confident75.2Confident148 Ų14877.2 Ų77.258%0.5839%0.394SS*.Hα-helixtrans-78.9-17.8178.1-72-62.6000114L252 E254 L258 S260L252-Y256 HydrophobicContact CB-CD2 4.32Å; L252-Y256 HydrophobicContact CB-CE2 4.28Å; L252-Y256 HydrophobicContact CD2-CE2 4.04Å; L252-Y256 WeakPolarHBondContact O-CB 3.32Å; L252-Y256 WeakPolarHBondContact O-CD2 3.37Å; L252-Y256 PolarHBondContact O-N 3.33Å; E254-Y256 VanDerWaalsContact C-N 3.33Å; E254-Y256 PolarHBondContact O-N 3.32Å; Y256-L258 PolarHBondContact O-N 3.31Å; Y256-S260 WeakPolarHBondContact O-CB 3.4Å; Y256-S260 PolarHBondContact O-N 2.84Å
257K70.6Confident75.7Confident81 Ų8178.9 Ų78.935%0.35241%0.405SS..Hα-helixtrans-56.4-48.7-175.3174.2163.7-161.8168.80112.5L157 S158 L253 E254L157-K257 HydrophobicContact CB-CB 4.42Å; L157-K257 HydrophobicContact CB-CD 3.76Å; L157-K257 HydrophobicContact CB-CG 3.92Å; L157-K257 HydrophobicContact CD1-CB 4Å; L157-K257 HydrophobicContact CD1-CG 3.75Å; L157-K257 HydrophobicContact CD2-CB 3.89Å; L157-K257 HydrophobicContact CD2-CG 4.3Å; L157-K257 HydrophobicContact CG-CB 4.31Å; L157-K257 HydrophobicContact CG-CG 4.19Å; L157-K257 PolarHBondContact O-NZ 2.95Å; S158-K257 PolarHBondContact OG-NZ 2.94Å; L253-K257 WeakPolarHBondContact O-CB 3.27Å; L253-K257 PolarHBondContact O-N 2.91Å; L253-K257 VanDerWaalsContact O-N 3.13Å; E254-K257 WeakPolarHBondContact O-CB 3.37Å; E254-K257 PolarHBondContact O-N 3.16Å
258L65.8Low76.2Confident94 Ų9477.5 Ų77.549%0.49239%0.392SS..Hα-helixtrans-76-46.6-173.8-150.383000110.7Y256 R262Y256-L258 PolarHBondContact O-N 3.31Å; L258-R262 VanDerWaalsContact CD2-NH2 3.26Å; L258-R262 WeakPolarHBondContact O-CD 3.31Å; L258-R262 WeakPolarHBondContact O-CG 3.37Å; L258-R262 PolarHBondContact O-N 3.34Å; L258-R262 PolarHBondContact O-NE 3.4Å
259L69.1Low76.5Confident93 Ų9375 Ų7549%0.48739%0.388SS..Hα-helixtrans-68.9-41.4-174.9-17064.8000112.6R262 I263L259-R262 WeakPolarHBondContact O-CB 3.19Å; L259-R262 PolarHBondContact O-N 2.92Å; L259-I263 HydrophobicContact CD1-CD1 4.25Å; L259-I263 HydrophobicContact CG-CD1 3.94Å; L259-I263 WeakPolarHBondContact O-CG1 3.48Å; L259-I263 PolarHBondContact O-N 3.33Å; L259-I263 VanDerWaalsContact O-N 3.13Å
260S70.6Confident77.2Confident51 Ų5177.9 Ų77.936%0.35740%0.396SS..Hα-helixtrans-64.3-46-179.4-178.50000112.1Y256 R262 I263 L264Y256-S260 WeakPolarHBondContact O-CB 3.4Å; Y256-S260 PolarHBondContact O-N 2.84Å; S260-R262 VanDerWaalsContact C-N 3.25Å; S260-R262 PolarHBondContact O-N 2.95Å; S260-I263 PolarHBondContact O-N 3.02Å; S260-L264 WeakPolarHBondContact O-CB 3.46Å; S260-L264 WeakPolarHBondContact O-CD1 3.48Å; S260-L264 WeakPolarHBondContact O-CG 3.36Å; S260-L264 PolarHBondContact O-N 3.47Å
261N70.1Confident78Confident78 Ų7880 Ų8042%0.41740%0.403SS..Hα-helixtrans-60.9-36.4179-169.237.1000112.1A265N261-A265 PolarHBondContact O-N 3.26Å; N261-A265 VanDerWaalsContact O-N 3.13Å
262R74.4Confident78.6Confident32 Ų3274 Ų7412%0.12138%0.377CS..Hα-helixtrans-66.7-48.9179.2-65.6163177.3-136.9-20.5111.9I98 L99 L258 L259 S260 L264 A265 A266I98-R262 HydrophobicContact CG2-CB 4.37Å; I98-R262 HydrophobicContact CG2-CG 3.67Å; I98-R262 WeakPolarHBondContact O-CD 3.43Å; I98-R262 WeakPolarHBondContact O-CG 3.33Å; I98-R262 PolarHBondContact O-NE 3.24Å; I98-R262 PolarHBondContact O-NH1 2.88Å; I98-R262 PolarHBondContact O-NH2 2.93Å; I98-R262 VanDerWaalsContact O-NH2 3.14Å; L99-R262 HydrophobicContact CD2-CB 3.89Å; L99-R262 HydrophobicContact CD2-CG 4.49Å; L99-R262 PolarHBondContact O-NH1 3.44Å; L258-R262 VanDerWaalsContact CD2-NH2 3.26Å; L258-R262 WeakPolarHBondContact O-CD 3.31Å; L258-R262 WeakPolarHBondContact O-CG 3.37Å; L258-R262 PolarHBondContact O-N 3.34Å; L258-R262 PolarHBondContact O-NE 3.4Å; L259-R262 WeakPolarHBondContact O-CB 3.19Å; L259-R262 PolarHBondContact O-N 2.92Å; S260-R262 VanDerWaalsContact C-N 3.25Å; S260-R262 PolarHBondContact O-N 2.95Å; R262-L264 VanDerWaalsContact C-N 3.33Å; R262-A265 PolarHBondContact O-N 3.43Å; R262-A266 PolarHBondContact O-N 2.88Å
263I78.8Confident79.3Confident83 Ų8373.3 Ų73.343%0.42637%0.373SS..Hα-helixtrans-65.8-39.3179.3-66.4169.7000110.5L259 S260 A265 A266 I267L259-I263 HydrophobicContact CD1-CD1 4.25Å; L259-I263 HydrophobicContact CG-CD1 3.94Å; L259-I263 WeakPolarHBondContact O-CG1 3.48Å; L259-I263 PolarHBondContact O-N 3.33Å; L259-I263 VanDerWaalsContact O-N 3.13Å; S260-I263 PolarHBondContact O-N 3.02Å; I263-A265 PolarHBondContact O-N 3.35Å; I263-A266 VanDerWaalsContact O-CB 3.26Å; I263-A266 WeakPolarHBondContact O-CB 3.49Å; I263-A266 PolarHBondContact O-N 2.92Å; I263-I267 HydrophobicContact CG2-CD1 3.67Å; I263-I267 HydrophobicContact CG2-CG1 4.3Å; I263-I267 WeakPolarHBondContact O-CG1 3.38Å; I263-I267 PolarHBondContact O-N 3.48Å
264L78.9Confident80.4Confident61 Ų6174.8 Ų74.832%0.31938%0.384SS..Hα-helixtrans-65.9-37179.1-71.2169.2000112.5I153 S260 R262 A266 I267 F268I153-L264 HydrophobicContact CD1-CD1 3.39Å; I153-L264 HydrophobicContact CG1-CD1 4.23Å; S260-L264 WeakPolarHBondContact O-CB 3.46Å; S260-L264 WeakPolarHBondContact O-CD1 3.48Å; S260-L264 WeakPolarHBondContact O-CG 3.36Å; S260-L264 PolarHBondContact O-N 3.47Å; R262-L264 VanDerWaalsContact C-N 3.33Å; L264-A266 VanDerWaalsContact C-N 3.35Å; L264-I267 PolarHBondContact O-N 2.99Å; L264-F268 VanDerWaalsContact O-CB 3.28Å; L264-F268 WeakPolarHBondContact O-CB 3.34Å; L264-F268 PolarHBondContact O-N 2.95Å
265A81.3Confident81.5Confident43 Ų4370.9 Ų70.936%0.35537%0.366SS..Hα-helixtrans-62.3-40.9172.400000112.1N261 R262 I263 F268 L269N261-A265 PolarHBondContact O-N 3.26Å; N261-A265 VanDerWaalsContact O-N 3.13Å; R262-A265 PolarHBondContact O-N 3.43Å; I263-A265 PolarHBondContact O-N 3.35Å; A265-F268 PolarHBondContact O-N 3.38Å; A265-L269 PolarHBondContact O-N 3.45Å
266A83.9Confident82.6Confident21 Ų2165 Ų6517%0.17433%0.334CS..Hα-helixtrans-58.3-55.1174.900000111.9W94 R262 I263 L264 F268 L269 I270W94-A266 VanDerWaalsContact CH2-CA 3.41Å; W94-A266 HydrophobicContact CH2-CB 3.26Å; W94-A266 HydrophobicContact CZ2-CB 3.44Å; W94-A266 VanDerWaalsContact CZ2-CB 3.44Å; R262-A266 PolarHBondContact O-N 2.88Å; I263-A266 VanDerWaalsContact O-CB 3.26Å; I263-A266 WeakPolarHBondContact O-CB 3.49Å; I263-A266 PolarHBondContact O-N 2.92Å; L264-A266 VanDerWaalsContact C-N 3.35Å; A266-F268 PolarHBondContact O-N 2.88Å; A266-L269 PolarHBondContact O-N 3.27Å; A266-I270 WeakPolarHBondContact O-CG1 3.21Å; A266-I270 PolarHBondContact O-N 2.77Å
267I86.6Confident83.7Confident97 Ų9759.9 Ų59.950%0.49732%0.323SS..Hα-helixtrans-59.5-41-177.8-68.6169.7000109.4I263 L264 I270 Y271I263-I267 HydrophobicContact CG2-CD1 3.67Å; I263-I267 HydrophobicContact CG2-CG1 4.3Å; I263-I267 WeakPolarHBondContact O-CG1 3.38Å; I263-I267 PolarHBondContact O-N 3.48Å; L264-I267 PolarHBondContact O-N 2.99Å; I267-I270 PolarHBondContact O-N 3.12Å; I267-Y271 VanDerWaalsContact O-CB 3.23Å; I267-Y271 WeakPolarHBondContact O-CB 3.26Å; I267-Y271 PolarHBondContact O-N 2.95Å
268F87.9Confident84.9Confident26 Ų2661.5 Ų61.511%0.11433%0.331CS..Hα-helixtrans-66.5-41.2178.8-172.3-104.2000112.9L138 Q142 L146 L264 A265 A266 Y271 L272L138-F268 HydrophobicContact CD2-CE1 3.78Å; L138-F268 HydrophobicContact CD2-CZ 4.37Å; Q142-F268 WeakPolarHBondContact O-CE2 3.38Å; Q142-F268 VanDerWaalsContact O-CZ 3.26Å; Q142-F268 WeakPolarHBondContact O-CZ 3.48Å; L146-F268 HydrophobicContact CB-CD1 3.91Å; L146-F268 HydrophobicContact CB-CD2 3.94Å; L146-F268 HydrophobicContact CB-CE1 3.52Å; L146-F268 HydrophobicContact CB-CE2 3.62Å; L146-F268 HydrophobicContact CB-CG 4.09Å; L146-F268 HydrophobicContact CB-CZ 3.41Å; L146-F268 VanDerWaalsContact CB-CZ 3.41Å; L146-F268 HydrophobicContact CD1-CB 4.15Å; L146-F268 HydrophobicContact CD1-CD1 3.75Å; L146-F268 HydrophobicContact CD1-CD2 4.27Å; L146-F268 HydrophobicContact CD1-CE1 4.22Å; L146-F268 HydrophobicContact CD1-CG 3.76Å; L146-F268 HydrophobicContact CD2-CD1 3.56Å; L146-F268 HydrophobicContact CD2-CE1 3.39Å; L146-F268 HydrophobicContact CD2-CG 4.4Å; L146-F268 HydrophobicContact CD2-CZ 4.18Å; L146-F268 HydrophobicContact CG-CD1 3.92Å; L146-F268 HydrophobicContact CG-CE1 3.87Å; L146-F268 HydrophobicContact CG-CG 4.29Å; L146-F268 HydrophobicContact CG-CZ 4.28Å; L264-F268 VanDerWaalsContact O-CB 3.28Å; L264-F268 WeakPolarHBondContact O-CB 3.34Å; L264-F268 PolarHBondContact O-N 2.95Å; A265-F268 PolarHBondContact O-N 3.38Å; A266-F268 PolarHBondContact O-N 2.88Å; F268-Y271 HydrophobicContact CD2-CD1 4.28Å; F268-Y271 HydrophobicContact CE2-CD1 4.19Å; F268-Y271 WeakPolarHBondContact O-CB 3.34Å; F268-Y271 PolarHBondContact O-N 3.48Å; F268-L272 HydrophobicContact CD1-CD1 3.9Å; F268-L272 HydrophobicContact CD1-CG 4.13Å; F268-L272 HydrophobicContact CE1-CD1 3.47Å; F268-L272 VanDerWaalsContact CE1-CD1 3.47Å; F268-L272 HydrophobicContact CE1-CD2 3.91Å; F268-L272 HydrophobicContact CE1-CG 3.67Å; F268-L272 HydrophobicContact CE2-CD2 4.39Å; F268-L272 HydrophobicContact CE2-CG 4.47Å; F268-L272 HydrophobicContact CZ-CD1 4.11Å; F268-L272 HydrophobicContact CZ-CD2 3.63Å; F268-L272 HydrophobicContact CZ-CG 3.82Å; F268-L272 WeakPolarHBondContact O-CG 3.48Å; F268-L272 PolarHBondContact O-N 3.4Å
269L88.4Confident86.4Confident81 Ų8157.8 Ų57.842%0.42431%0.311SS..Hα-helixtrans-60.1-47.4175.4-176.767.8000111.2A265 A266 Y271 L272 I273A265-L269 PolarHBondContact O-N 3.45Å; A266-L269 PolarHBondContact O-N 3.27Å; L269-Y271 VanDerWaalsContact C-N 3.3Å; L269-Y271 PolarHBondContact O-N 3Å; L269-L272 PolarHBondContact O-N 3.13Å; L269-I273 HydrophobicContact CG-CD1 4.48Å; L269-I273 WeakPolarHBondContact O-CG1 3.3Å; L269-I273 PolarHBondContact O-N 2.81Å; L269-I273 VanDerWaalsContact O-N 3.17Å
270I90.7Very high87.7Confident105 Ų10553.8 Ų53.854%0.53829%0.29SS..Hα-helixtrans-59.5-44.9175.5-65.3168.3000110A266 I267 L272 I273 V274A266-I270 WeakPolarHBondContact O-CG1 3.21Å; A266-I270 PolarHBondContact O-N 2.77Å; I267-I270 PolarHBondContact O-N 3.12Å; I270-L272 VanDerWaalsContact C-N 3.34Å; I270-L272 PolarHBondContact O-N 3.46Å; I270-I273 WeakPolarHBondContact O-CB 3.32Å; I270-I273 PolarHBondContact O-N 3.29Å; I270-I273 VanDerWaalsContact O-N 3.17Å; I270-V274 HydrophobicContact CG2-CG2 4.36Å; I270-V274 WeakPolarHBondContact O-CG2 3.44Å; I270-V274 PolarHBondContact O-N 3.02Å
271Y92.6Very high88.9Confident69 Ų6957.8 Ų57.827%0.27130%0.301SS..Hα-helixtrans-59.6-40.5178.5-179.7-112.2000112.7Q142 I267 F268 L269 V274 E275Q142-Y271 HydrophobicContact CB-CE1 4.16Å; Q142-Y271 VanDerWaalsContact CD-CE1 3.5Å; Q142-Y271 HydrophobicContact CG-CE1 4.08Å; Q142-Y271 PolarHBondContact NE2-OH 3.19Å; Q142-Y271 VanDerWaalsContact OE1-CE1 3.23Å; Q142-Y271 PolarHBondContact OE1-OH 3.07Å; I267-Y271 VanDerWaalsContact O-CB 3.23Å; I267-Y271 WeakPolarHBondContact O-CB 3.26Å; I267-Y271 PolarHBondContact O-N 2.95Å; F268-Y271 HydrophobicContact CD2-CD1 4.28Å; F268-Y271 HydrophobicContact CE2-CD1 4.19Å; F268-Y271 WeakPolarHBondContact O-CB 3.34Å; F268-Y271 PolarHBondContact O-N 3.48Å; L269-Y271 VanDerWaalsContact C-N 3.3Å; L269-Y271 PolarHBondContact O-N 3Å; Y271-V274 PolarHBondContact O-N 3.26Å; Y271-E275 HydrophobicContact CD1-CG 4.34Å; Y271-E275 HydrophobicContact CD2-CG 4.23Å; Y271-E275 HydrophobicContact CE1-CG 3.9Å; Y271-E275 HydrophobicContact CE2-CG 3.74Å; Y271-E275 HydrophobicContact CG-CG 4.49Å; Y271-E275 WeakPolarHBondContact O-CB 3.49Å; Y271-E275 WeakPolarHBondContact O-CG 3.4Å; Y271-E275 PolarHBondContact O-N 3.36Å; Y271-E275 PolarHBondContact OH-OE1 2.97Å
272L92.9Very high90.1Very high5 Ų555.3 Ų55.33%0.02629%0.29CS..Hα-helixtrans-64.2-39.6175.1-71172.1000113I134 T137 L138 Q142 F268 L269 I270 S276I134-L272 HydrophobicContact CG2-CB 4.41Å; I134-L272 HydrophobicContact CG2-CD1 4.35Å; T137-L272 HydrophobicContact CG2-CD2 3.9Å; L138-L272 HydrophobicContact CD1-CD1 4.48Å; L138-L272 HydrophobicContact CD2-CD1 3.38Å; L138-L272 HydrophobicContact CD2-CD2 4.1Å; L138-L272 HydrophobicContact CD2-CG 4.35Å; L138-L272 HydrophobicContact CG-CD1 3.75Å; L138-L272 HydrophobicContact CG-CD2 4.31Å; Q142-L272 HydrophobicContact CB-CD2 4.1Å; F268-L272 HydrophobicContact CD1-CD1 3.9Å; F268-L272 HydrophobicContact CD1-CG 4.13Å; F268-L272 HydrophobicContact CE1-CD1 3.47Å; F268-L272 VanDerWaalsContact CE1-CD1 3.47Å; F268-L272 HydrophobicContact CE1-CD2 3.91Å; F268-L272 HydrophobicContact CE1-CG 3.67Å; F268-L272 HydrophobicContact CE2-CD2 4.39Å; F268-L272 HydrophobicContact CE2-CG 4.47Å; F268-L272 HydrophobicContact CZ-CD1 4.11Å; F268-L272 HydrophobicContact CZ-CD2 3.63Å; F268-L272 HydrophobicContact CZ-CG 3.82Å; F268-L272 WeakPolarHBondContact O-CG 3.48Å; F268-L272 PolarHBondContact O-N 3.4Å; L269-L272 PolarHBondContact O-N 3.13Å; I270-L272 VanDerWaalsContact C-N 3.34Å; I270-L272 PolarHBondContact O-N 3.46Å; L272-S276 VanDerWaalsContact O-CB 3.27Å; L272-S276 WeakPolarHBondContact O-CB 3.27Å; L272-S276 PolarHBondContact O-N 2.96Å; L272-S276 PolarHBondContact O-OG 2.72Å
273I93.3Very high91.1Very high68 Ų6853.8 Ų53.835%0.34928%0.284SS..Hα-helixtrans-63.5-47.9176.7-65.5166.2000109.1V130 I134 L269 I270 S276 A277V130-I273 HydrophobicContact CG1-CG2 4.4Å; I134-I273 HydrophobicContact CD1-CG1 3.79Å; I134-I273 HydrophobicContact CG1-CG1 4.36Å; L269-I273 HydrophobicContact CG-CD1 4.48Å; L269-I273 WeakPolarHBondContact O-CG1 3.3Å; L269-I273 PolarHBondContact O-N 2.81Å; L269-I273 VanDerWaalsContact O-N 3.17Å; I270-I273 WeakPolarHBondContact O-CB 3.32Å; I270-I273 PolarHBondContact O-N 3.29Å; I270-I273 VanDerWaalsContact O-N 3.17Å; I273-S276 PolarHBondContact O-N 3.21Å; I273-A277 WeakPolarHBondContact O-CB 3.2Å; I273-A277 PolarHBondContact O-N 3.16Å
274V94.8Very high91.8Very high84 Ų8452.3 Ų52.351%0.50928%0.279SS..Hα-helixtrans-60.9-46.7177.9172.70000111.5I270 Y271 S276 A277 H278I270-V274 HydrophobicContact CG2-CG2 4.36Å; I270-V274 WeakPolarHBondContact O-CG2 3.44Å; I270-V274 PolarHBondContact O-N 3.02Å; Y271-V274 PolarHBondContact O-N 3.26Å; V274-S276 VanDerWaalsContact C-N 3.33Å; V274-S276 PolarHBondContact O-N 2.87Å; V274-A277 PolarHBondContact O-N 3.36Å; V274-H278 VanDerWaalsContact O-CB 3.3Å; V274-H278 WeakPolarHBondContact O-CB 3.3Å; V274-H278 PolarHBondContact O-N 3.46Å
275E95.1Very high92.6Very high45 Ų4555.2 Ų55.221%0.2129%0.293CS..Hα-helixtrans-63.5-38177.6-78.9-77.616000112.5T137 Q142 Y271 Y279T137-E275 HydrophobicContact CG2-CB 4.18Å; Q142-E275 HydrophobicContact CG-CB 4.46Å; Q142-E275 HydrophobicContact CG-CG 4.09Å; Q142-E275 PolarHBondContact NE2-OE1 3.23Å; Q142-E275 VanDerWaalsContact NE2-OE1 3.17Å; Q142-E275 PolarHBondContact NE2-OE2 3.49Å; Y271-E275 HydrophobicContact CD1-CG 4.34Å; Y271-E275 HydrophobicContact CD2-CG 4.23Å; Y271-E275 HydrophobicContact CE1-CG 3.9Å; Y271-E275 HydrophobicContact CE2-CG 3.74Å; Y271-E275 HydrophobicContact CG-CG 4.49Å; Y271-E275 WeakPolarHBondContact O-CB 3.49Å; Y271-E275 WeakPolarHBondContact O-CG 3.4Å; Y271-E275 PolarHBondContact O-N 3.36Å; Y271-E275 PolarHBondContact OH-OE1 2.97Å; E275-Y279 WeakPolarHBondContact O-CB 3.33Å; E275-Y279 PolarHBondContact O-N 2.86Å
276S96.1Very high93.1Very high0 Ų055.2 Ų55.20%029%0.29CS..Hα-helixtrans-67.2-43.5176.1-59.50000111.2T137 L272 I273 V274 Y279 L280T137-S276 WeakPolarHBondContact CB-OG 3.45Å; T137-S276 PolarHBondContact OG1-OG 2.92Å; L272-S276 VanDerWaalsContact O-CB 3.27Å; L272-S276 WeakPolarHBondContact O-CB 3.27Å; L272-S276 PolarHBondContact O-N 2.96Å; L272-S276 PolarHBondContact O-OG 2.72Å; I273-S276 PolarHBondContact O-N 3.21Å; V274-S276 VanDerWaalsContact C-N 3.33Å; V274-S276 PolarHBondContact O-N 2.87Å; S276-Y279 PolarHBondContact O-N 3.37Å; S276-L280 PolarHBondContact O-N 2.93Å
277A96Very high93.5Very high41 Ų4156.3 Ų56.334%0.33930%0.295SS..Hα-helixtrans-65-41.9175.200000112.2V130 I273 V274 L280 K281V130-A277 HydrophobicContact CG1-CB 4.31Å; V130-A277 HydrophobicContact CG2-CB 4.19Å; I273-A277 WeakPolarHBondContact O-CB 3.2Å; I273-A277 PolarHBondContact O-N 3.16Å; V274-A277 PolarHBondContact O-N 3.36Å; A277-L280 PolarHBondContact O-N 3.47Å; A277-K281 WeakPolarHBondContact O-CB 3.4Å; A277-K281 PolarHBondContact O-N 3.42Å
278H95.9Very high93.6Very high115 Ų11559.1 Ų59.153%0.53230%0.304SS..Hα-helixtrans-63.4-42.5177.3-177.3-88.9000111.8V274 S282V274-H278 VanDerWaalsContact O-CB 3.3Å; V274-H278 WeakPolarHBondContact O-CB 3.3Å; V274-H278 PolarHBondContact O-N 3.46Å; H278-S282 WeakPolarHBondContact O-CB 3.47Å; H278-S282 PolarHBondContact O-N 3.22Å; H278-S282 PolarHBondContact O-OG 3.49Å
279Y96.1Very high93.8Very high15 Ų1561.2 Ų61.26%0.05931%0.313CS..Hα-helixtrans-60.5-48.3173-178.5-79.2000111M133 E275 S276 K281 S282 Y283 F289 D290 R457M133-Y279 HydrophobicContact CE-CD1 3.06Å; M133-Y279 HydrophobicContact CE-CE1 3.5Å; M133-Y279 HydrophobicContact CE-CG 3.79Å; M133-Y279 HydrophobicContact SD-CD1 4.23Å; E275-Y279 WeakPolarHBondContact O-CB 3.33Å; E275-Y279 PolarHBondContact O-N 2.86Å; S276-Y279 PolarHBondContact O-N 3.37Å; Y279-K281 VanDerWaalsContact C-N 3.35Å; Y279-K281 PolarHBondContact O-N 3.43Å; Y279-S282 PolarHBondContact O-N 3.3Å; Y279-Y283 HydrophobicContact CE1-CD2 4.26Å; Y279-Y283 WeakPolarHBondContact O-CB 3.36Å; Y279-Y283 PolarHBondContact O-N 3.22Å; Y279-F289 AromaticContact CD2-CE1 3.96Å; Y279-F289 HydrophobicContact CD2-CE1 3.96Å; Y279-F289 AromaticContact CD2-CZ 3.84Å; Y279-F289 HydrophobicContact CD2-CZ 3.84Å; Y279-F289 HydrophobicContact CE1-CE1 4.46Å; Y279-F289 AromaticContact CE2-CE1 3.75Å; Y279-F289 HydrophobicContact CE2-CE1 3.75Å; Y279-F289 AromaticContact CE2-CZ 3.87Å; Y279-F289 HydrophobicContact CE2-CZ 3.87Å; Y279-F289 HydrophobicContact CG-CE1 4.42Å; Y279-D290 PolarHBondContact OH-OD2 3.37Å; Y279-D290 VanDerWaalsContact OH-OD2 3.07Å; Y279-R457 HydrophobicContact CE1-CB 4.17Å
280L96.4Very high93.7Very high9 Ų959.4 Ų59.45%0.04730%0.304CS..Hα-helixtrans-61.7-44.3-179.4-176.760.9000111.6P126 C129 V130 M133 S276 A277 S282 Y283 V284 F465P126-L280 HydrophobicContact CB-CD2 4.29Å; P126-L280 WeakPolarHBondContact O-CD2 3.38Å; C129-L280 HydrophobicContact CB-CD1 4.44Å; C129-L280 HydrophobicContact CB-CD2 3.83Å; V130-L280 HydrophobicContact CG2-CB 4.4Å; V130-L280 HydrophobicContact CG2-CD2 3.6Å; M133-L280 HydrophobicContact SD-CB 4.4Å; M133-L280 HydrophobicContact SD-CD1 4.46Å; S276-L280 PolarHBondContact O-N 2.93Å; A277-L280 PolarHBondContact O-N 3.47Å; L280-S282 VanDerWaalsContact C-N 3.33Å; L280-S282 PolarHBondContact O-N 2.9Å; L280-Y283 WeakPolarHBondContact O-CB 3.44Å; L280-Y283 PolarHBondContact O-N 3.36Å; L280-Y283 VanDerWaalsContact O-N 3.16Å; L280-V284 HydrophobicContact CD1-CG2 4.13Å; L280-V284 HydrophobicContact CG-CG2 4.41Å; L280-V284 WeakPolarHBondContact O-CG2 3.28Å; L280-V284 PolarHBondContact O-N 3.41Å; L280-F465 HydrophobicContact CD1-CD2 4.04Å; L280-F465 HydrophobicContact CD1-CE2 3.67Å; L280-F465 HydrophobicContact CD2-CE2 4.2Å; L280-F465 HydrophobicContact CG-CE2 4.33Å
281K96.3Very high93.5Very high135 Ų13555 Ų5559%0.58728%0.281SS*.Hα-helixtrans-55.3-49.4174.1179.8179.6178.3-178.10111A277 Y279 Y283 V284 I285A277-K281 WeakPolarHBondContact O-CB 3.4Å; A277-K281 PolarHBondContact O-N 3.42Å; Y279-K281 VanDerWaalsContact C-N 3.35Å; Y279-K281 PolarHBondContact O-N 3.43Å; K281-Y283 VanDerWaalsContact C-N 3.3Å; K281-Y283 PolarHBondContact O-N 3.43Å; K281-V284 PolarHBondContact O-N 2.84Å; K281-I285 HydrophobicContact CD-CD1 4.32Å; K281-I285 HydrophobicContact CG-CD1 3.56Å; K281-I285 HydrophobicContact CG-CG1 4.44Å; K281-I285 WeakPolarHBondContact O-CB 3.34Å; K281-I285 VanDerWaalsContact O-CG1 3.28Å; K281-I285 WeakPolarHBondContact O-CG1 3.39Å; K281-I285 PolarHBondContact O-N 3.41Å
282S95.8Very high93.2Very high27 Ų2754.6 Ų54.619%0.18929%0.286CS..Hα-helixtrans-61.4-39.3178.1-58.50000112.2H278 Y279 L280 S286H278-S282 WeakPolarHBondContact O-CB 3.47Å; H278-S282 PolarHBondContact O-N 3.22Å; H278-S282 PolarHBondContact O-OG 3.49Å; Y279-S282 PolarHBondContact O-N 3.3Å; L280-S282 VanDerWaalsContact C-N 3.33Å; L280-S282 PolarHBondContact O-N 2.9Å; S282-S286 WeakPolarHBondContact O-CB 3.39Å; S282-S286 PolarHBondContact O-N 2.97Å; S282-S286 VanDerWaalsContact O-N 3.07Å
283Y95.4Very high92.8Very high0 Ų055.1 Ų55.10%029%0.287CS..Hα-helixtrans-64.4-43.6177.9-175.9-81.3000112.8Y279 L280 K281 R458 A462 Q468 E469 R472Y279-Y283 HydrophobicContact CE1-CD2 4.26Å; Y279-Y283 WeakPolarHBondContact O-CB 3.36Å; Y279-Y283 PolarHBondContact O-N 3.22Å; L280-Y283 WeakPolarHBondContact O-CB 3.44Å; L280-Y283 PolarHBondContact O-N 3.36Å; L280-Y283 VanDerWaalsContact O-N 3.16Å; K281-Y283 VanDerWaalsContact C-N 3.3Å; K281-Y283 PolarHBondContact O-N 3.43Å; Y283-R458 HydrophobicContact CE2-CG 4.44Å; Y283-A462 VanDerWaalsContact OH-CA 3.32Å; Y283-A462 WeakPolarHBondContact OH-CA 3.45Å; Y283-A462 WeakPolarHBondContact OH-CB 3.38Å; Y283-A462 PolarHBondContact OH-N 3.49Å; Y283-Q468 HydrophobicContact CE1-CG 4.49Å; Y283-E469 PolarHBondContact OH-OE2 3.46Å; Y283-R472 VanDerWaalsContact CE2-CZ 3.44Å; Y283-R472 PolarHBondContact O-NH1 3.01Å
284V94.3Very high92.2Very high51 Ų5153 Ų5331%0.30928%0.277SS..Hα-helixtrans-76.1-36.3-177.5175.10000111.5L280 K281 F465 Q468L280-V284 HydrophobicContact CD1-CG2 4.13Å; L280-V284 HydrophobicContact CG-CG2 4.41Å; L280-V284 WeakPolarHBondContact O-CG2 3.28Å; L280-V284 PolarHBondContact O-N 3.41Å; K281-V284 PolarHBondContact O-N 2.84Å; V284-F465 HydrophobicContact CG2-CD1 3.89Å; V284-F465 HydrophobicContact CG2-CD2 4.1Å; V284-F465 HydrophobicContact CG2-CE1 3.93Å; V284-F465 HydrophobicContact CG2-CE2 4.18Å; V284-F465 HydrophobicContact CG2-CG 3.98Å; V284-F465 HydrophobicContact CG2-CZ 4.08Å; V284-Q468 PolarHBondContact O-NE2 3.05Å
285I94.1Very high91.7Very high123 Ų12349.8 Ų49.863%0.63126%0.257SS*.Hα-helixtrans-78.1-42.3-177.7-66.8174.4000112K281K281-I285 HydrophobicContact CD-CD1 4.32Å; K281-I285 HydrophobicContact CG-CD1 3.56Å; K281-I285 HydrophobicContact CG-CG1 4.44Å; K281-I285 WeakPolarHBondContact O-CB 3.34Å; K281-I285 VanDerWaalsContact O-CG1 3.28Å; K281-I285 WeakPolarHBondContact O-CG1 3.39Å; K281-I285 PolarHBondContact O-N 3.41Å
286S92.8Very high91.1Very high42 Ų4257.4 Ų57.429%0.29428%0.284SS..  trans-110.1122.8-169.2-179.60000113S282 K288 F289S282-S286 WeakPolarHBondContact O-CB 3.39Å; S282-S286 PolarHBondContact O-N 2.97Å; S282-S286 VanDerWaalsContact O-N 3.07Å; S286-K288 PolarHBondContact O-N 3.19Å; S286-K288 PolarHBondContact OG-N 3.19Å; S286-F289 PolarHBondContact OG-N 2.91Å
287V91.9Very high90.5Very high45 Ų4562.7 Ų62.727%0.27331%0.309SS..SBendtrans-73.3-16.3171.9-61.20000113.5N291 R472 F475V287-N291 WeakPolarHBondContact O-CB 3.15Å; V287-N291 PolarHBondContact O-ND2 2.89Å; V287-R472 HydrophobicContact CB-CG 4.21Å; V287-R472 HydrophobicContact CG1-CG 4.28Å; V287-F475 HydrophobicContact CB-CB 4.43Å; V287-F475 HydrophobicContact CB-CG 4.37Å; V287-F475 HydrophobicContact CG2-CB 4.4Å; V287-F475 HydrophobicContact CG2-CD1 4.22Å; V287-F475 HydrophobicContact CG2-CD2 4.05Å; V287-F475 HydrophobicContact CG2-CE2 4.43Å; V287-F475 HydrophobicContact CG2-CG 3.94Å
288K89.7Confident90Very high156 Ų15660.9 Ų60.968%0.67829%0.293SS*.SBendtrans-88.4-26179.4-64.3179.4-177.61760112.1S286 D290 F475S286-K288 PolarHBondContact O-N 3.19Å; S286-K288 PolarHBondContact OG-N 3.19Å; K288-D290 PolarHBondContact O-N 3.44Å; K288-F475 HydrophobicContact CD-CZ 4.41Å; K288-F475 HydrophobicContact CG-CE1 3.9Å; K288-F475 HydrophobicContact CG-CZ 3.76Å
289F91.2Very high89.4Confident69 Ų6959.8 Ų59.830%0.30329%0.291SS..THydrogen-bonded Turntrans-66.8123.9-175.2176.7-98.5000112.2Y279 S286 N291 R472Y279-F289 AromaticContact CD2-CE1 3.96Å; Y279-F289 HydrophobicContact CD2-CE1 3.96Å; Y279-F289 AromaticContact CD2-CZ 3.84Å; Y279-F289 HydrophobicContact CD2-CZ 3.84Å; Y279-F289 HydrophobicContact CE1-CE1 4.46Å; Y279-F289 AromaticContact CE2-CE1 3.75Å; Y279-F289 HydrophobicContact CE2-CE1 3.75Å; Y279-F289 AromaticContact CE2-CZ 3.87Å; Y279-F289 HydrophobicContact CE2-CZ 3.87Å; Y279-F289 HydrophobicContact CG-CE1 4.42Å; S286-F289 PolarHBondContact OG-N 2.91Å; F289-N291 PolarHBondContact O-N 2.96Å; F289-N291 VanDerWaalsContact O-N 3.09Å; F289-R472 VanDerWaalsContact O-CZ 3.31Å; F289-R472 PolarHBondContact O-NH1 3.46Å; F289-R472 PolarHBondContact O-NH2 3.29Å
290D85.7Confident89Confident44 Ų4464.7 Ų64.724%0.23531%0.314CS..THydrogen-bonded Turntrans4934.7179-159.233.4000113.9Y279 K288 Y293 R472Y279-D290 PolarHBondContact OH-OD2 3.37Å; Y279-D290 VanDerWaalsContact OH-OD2 3.07Å; K288-D290 PolarHBondContact O-N 3.44Å; D290-Y293 WeakPolarHBondContact O-CE2 3.25Å; D290-Y293 WeakPolarHBondContact OD1-CE2 3.24Å; D290-Y293 PolarHBondContact OD1-OH 3.44Å; D290-R472 PolarHBondContact O-NH2 2.96Å; D290-R472 VanDerWaalsContact O-NH2 3.09Å
291N88.4Confident88.5Confident13 Ų1367.1 Ų67.17%0.0732%0.324CS..  trans-10364.3-177-16418.7000111.6V287 F289 R472V287-N291 WeakPolarHBondContact O-CB 3.15Å; V287-N291 PolarHBondContact O-ND2 2.89Å; F289-N291 PolarHBondContact O-N 2.96Å; F289-N291 VanDerWaalsContact O-N 3.09Å; N291-R472 PolarHBondContact ND2-O 3.12Å
292V85.4Confident88Confident60 Ų6060.8 Ų60.836%0.36430%0.297SS..  trans-125.58.4-174.9-145.50000112.5N316 M317 V318V292-N316 WeakPolarHBondContact CG1-O 3.43Å; V292-M317 WeakPolarHBondContact O-CA 3.32Å; V292-V318 PolarHBondContact O-N 3.37Å
293Y83.6Confident87.5Confident15 Ų1564 Ų646%0.05932%0.32CS..EExtended strand (participates in β ladder)trans-100.9136.2-171.2-58.6-82.9000112.6D290 V318 R455 R458D290-Y293 WeakPolarHBondContact O-CE2 3.25Å; D290-Y293 WeakPolarHBondContact OD1-CE2 3.24Å; D290-Y293 PolarHBondContact OD1-OH 3.44Å; Y293-V318 CarbonylContact C-O 3.48Å; Y293-V318 WeakPolarHBondContact CA-O 3.43Å; Y293-V318 HydrophobicContact CD1-CB 3.96Å; Y293-V318 HydrophobicContact CD1-CG1 4.11Å; Y293-V318 HydrophobicContact CE1-CB 4.25Å; Y293-V318 HydrophobicContact CE1-CG1 4.19Å; Y293-R455 HydrophobicContact CE1-CG 3.89Å; Y293-R458 HydrophobicContact CD2-CG 4Å; Y293-R458 HydrophobicContact CE2-CB 4.42Å; Y293-R458 HydrophobicContact CE2-CG 3.93Å
294I81.4Confident87.1Confident25 Ų2570 Ų7013%0.12835%0.348CS..EExtended strand (participates in β ladder)trans-80.5119.7167.3-61.6154.1000107.9L299 L314 M317 V318 S320I294-L299 HydrophobicContact CG2-CD1 3.26Å; I294-L314 HydrophobicContact CD1-CB 4.17Å; I294-L314 HydrophobicContact CD1-CD2 3.51Å; I294-L314 HydrophobicContact CD1-CG 3.76Å; I294-L314 HydrophobicContact CG1-CD2 4.25Å; I294-L314 HydrophobicContact CG1-CG 4.34Å; I294-M317 HydrophobicContact CD1-CB 3.69Å; I294-M317 HydrophobicContact CG1-CB 3.67Å; I294-M317 HydrophobicContact CG1-SD 4.17Å; I294-V318 PolarHBondContact N-O 2.91Å; I294-S320 PolarHBondContact O-N 3Å; I294-S320 VanDerWaalsContact O-N 3.16Å
295T84.2Confident86.6Confident16 Ų1672.1 Ų72.110%0.09836%0.358CS..  trans-113.4158.8176.762.90000111.2Q297 L298 L299T295-Q297 VanDerWaalsContact C-N 3.27Å; T295-Q297 PolarHBondContact O-N 2.98Å; T295-L298 PolarHBondContact O-N 3Å; T295-L298 WeakPolarHBondContact OG1-CB 3.41Å; T295-L298 PolarHBondContact OG1-N 2.65Å; T295-L298 VanDerWaalsContact OG1-N 3.11Å; T295-L299 WeakPolarHBondContact O-CD1 3.49Å; T295-L299 PolarHBondContact O-N 3.45Å
296R82.3Confident85.9Confident205 Ų20569.3 Ų69.377%0.77436%0.359SS*.Hα-helixtrans-61-38.3173-70.4-177.1178.7172.9-2.5112.1L298 L299 Q300R296-L298 VanDerWaalsContact C-N 3.34Å; R296-L298 PolarHBondContact O-N 2.91Å; R296-L299 PolarHBondContact O-N 3.34Å; R296-Q300 WeakPolarHBondContact O-CB 3.47Å; R296-Q300 PolarHBondContact O-N 3.39Å
297Q83.1Confident85.3Confident111 Ų11168.4 Ų68.452%0.51935%0.351SS..Hα-helixtrans-63.2-38.6177.3-69.7173.7-18.700112.2T295 K301 I473T295-Q297 VanDerWaalsContact C-N 3.27Å; T295-Q297 PolarHBondContact O-N 2.98Å; Q297-K301 WeakPolarHBondContact O-CB 3.15Å; Q297-K301 PolarHBondContact O-N 2.93Å; Q297-I473 HydrophobicContact CB-CD1 3.68Å
298L85.3Confident84.5Confident3 Ų374.7 Ų74.72%0.01638%0.377CS..Hα-helixtrans-62.8-45.7174.2178.372000111.6T295 R296 K301 A302 I473 L476 L477T295-L298 PolarHBondContact O-N 3Å; T295-L298 WeakPolarHBondContact OG1-CB 3.41Å; T295-L298 PolarHBondContact OG1-N 2.65Å; T295-L298 VanDerWaalsContact OG1-N 3.11Å; R296-L298 VanDerWaalsContact C-N 3.34Å; R296-L298 PolarHBondContact O-N 2.91Å; L298-K301 PolarHBondContact O-N 3.33Å; L298-A302 WeakPolarHBondContact O-CB 3.5Å; L298-A302 PolarHBondContact O-N 3.46Å; L298-I473 HydrophobicContact CB-CG2 4.29Å; L298-I473 HydrophobicContact CD1-CG2 3.81Å; L298-L476 HydrophobicContact CD1-CD2 4.43Å; L298-L476 HydrophobicContact CD2-CD2 3.86Å; L298-L477 HydrophobicContact CD1-CB 4.4Å
299L84.6Confident83.8Confident91 Ų9169.5 Ų69.548%0.47636%0.356SS..Hα-helixtrans-64-43.2178.6-9373.6000111.9I294 T295 R296 A302 S303I294-L299 HydrophobicContact CG2-CD1 3.26Å; T295-L299 WeakPolarHBondContact O-CD1 3.49Å; T295-L299 PolarHBondContact O-N 3.45Å; R296-L299 PolarHBondContact O-N 3.34Å; L299-A302 PolarHBondContact O-N 3.49Å; L299-S303 PolarHBondContact O-N 3.39Å
300Q86.6Confident82.9Confident118 Ų11871 Ų7155%0.55136%0.364SS*.Hα-helixtrans-61-49.8177.5-179179.6-11.800110.6R296 A302 S303 E304R296-Q300 WeakPolarHBondContact O-CB 3.47Å; R296-Q300 PolarHBondContact O-N 3.39Å; Q300-A302 PolarHBondContact O-N 2.97Å; Q300-S303 WeakPolarHBondContact O-CB 3.29Å; Q300-S303 PolarHBondContact O-N 2.91Å; Q300-S303 VanDerWaalsContact O-N 3.1Å; Q300-E304 VanDerWaalsContact CG-OE1 3.32Å; Q300-E304 WeakPolarHBondContact CG-OE1 3.34Å; Q300-E304 PolarHBondContact NE2-OE1 3Å; Q300-E304 WeakPolarHBondContact O-CG 3.23Å; Q300-E304 PolarHBondContact O-N 3.36Å
301K85.9Confident81.9Confident60 Ų6074.1 Ų74.126%0.26139%0.387SS..Hα-helixtrans-64.2-38.8-179.5-170.1159.5-166.2163.50113.1Q297 L298 S303 E304 D305 I473 N474 L477Q297-K301 WeakPolarHBondContact O-CB 3.15Å; Q297-K301 PolarHBondContact O-N 2.93Å; L298-K301 PolarHBondContact O-N 3.33Å; K301-S303 VanDerWaalsContact C-N 3.29Å; K301-S303 PolarHBondContact O-N 3.49Å; K301-E304 PolarHBondContact O-N 3.24Å; K301-D305 WeakPolarHBondContact O-CB 3.13Å; K301-D305 PolarHBondContact O-N 3.27Å; K301-I473 HydrophobicContact CD-CG2 4.27Å; K301-N474 WeakPolarHBondContact CD-OD1 3.05Å; K301-N474 WeakPolarHBondContact CE-OD1 3.43Å; K301-N474 PolarHBondContact NZ-OD1 3.46Å; K301-L477 HydrophobicContact CG-CD2 4.36Å
302A85.6Confident80.8Confident2 Ų277.1 Ų77.12%0.01741%0.406CS..Hα-helixtrans-62.8-37.4173.800000112.2L298 L299 Q300 G306 I307 I309 L477L298-A302 WeakPolarHBondContact O-CB 3.5Å; L298-A302 PolarHBondContact O-N 3.46Å; L299-A302 PolarHBondContact O-N 3.49Å; Q300-A302 PolarHBondContact O-N 2.97Å; A302-G306 PolarHBondContact O-N 3.34Å; A302-I307 HydrophobicContact CB-CB 4.49Å; A302-I307 PolarHBondContact O-N 3.13Å; A302-I309 HydrophobicContact CB-CD1 3.63Å; A302-I309 HydrophobicContact CB-CG1 3.97Å; A302-L477 HydrophobicContact CB-CD1 3.82Å
303S85.3Confident79.9Confident96 Ų9675.1 Ų75.167%0.67139%0.393SS*.Hα-helixtrans-68.4-38.1174.8-171.10000112.5L299 Q300 K301 G306L299-S303 PolarHBondContact O-N 3.39Å; Q300-S303 WeakPolarHBondContact O-CB 3.29Å; Q300-S303 PolarHBondContact O-N 2.91Å; Q300-S303 VanDerWaalsContact O-N 3.1Å; K301-S303 VanDerWaalsContact C-N 3.29Å; K301-S303 PolarHBondContact O-N 3.49Å; S303-G306 PolarHBondContact O-N 3.41Å
304E87.2Confident79.2Confident126 Ų12676.9 Ų76.959%0.58940%0.403SS*.Hα-helixtrans-65.7-40.7175.8-72.3167.6-174.500111.3Q300 K301 G306Q300-E304 VanDerWaalsContact CG-OE1 3.32Å; Q300-E304 WeakPolarHBondContact CG-OE1 3.34Å; Q300-E304 PolarHBondContact NE2-OE1 3Å; Q300-E304 WeakPolarHBondContact O-CG 3.23Å; Q300-E304 PolarHBondContact O-N 3.36Å; K301-E304 PolarHBondContact O-N 3.24Å; E304-G306 PolarHBondContact O-N 3.34Å
305D84.4Confident78.5Confident94 Ų9484.2 Ų84.250%0.50343%0.434SS..THydrogen-bonded Turntrans-80.32.6178.2-68.3-14.1000113K301 I307 L477K301-D305 WeakPolarHBondContact O-CB 3.13Å; K301-D305 PolarHBondContact O-N 3.27Å; D305-I307 VanDerWaalsContact C-N 3.28Å; D305-I307 HydrophobicContact CB-CD1 3.61Å; D305-I307 HydrophobicContact CB-CG1 4.03Å; D305-I307 PolarHBondContact O-N 2.87Å; D305-L477 VanDerWaalsContact OD2-CD2 3.29Å; D305-L477 WeakPolarHBondContact OD2-CD2 3.5Å
306G79.2Confident77.7Confident64 Ų6488.5 Ų88.566%0.6646%0.456SS*.THydrogen-bonded Turntrans70.416.5178.900000115.3A302 S303 E304A302-G306 PolarHBondContact O-N 3.34Å; S303-G306 PolarHBondContact O-N 3.41Å; E304-G306 PolarHBondContact O-N 3.34Å
307I80.6Confident77.3Confident23 Ų2380.5 Ų80.512%0.11843%0.428CS..  trans-88.9112.1-174.3-58158000109.7A302 D305 I309 L477 Q481A302-I307 HydrophobicContact CB-CB 4.49Å; A302-I307 PolarHBondContact O-N 3.13Å; D305-I307 VanDerWaalsContact C-N 3.28Å; D305-I307 HydrophobicContact CB-CD1 3.61Å; D305-I307 HydrophobicContact CB-CG1 4.03Å; D305-I307 PolarHBondContact O-N 2.87Å; I307-I309 PolarHBondContact O-N 2.85Å; I307-L477 HydrophobicContact CD1-CD1 3.66Å; I307-L477 HydrophobicContact CD1-CD2 3.67Å; I307-L477 HydrophobicContact CD1-CG 3.64Å; I307-Q481 HydrophobicContact CD1-CG 4.04Å; I307-Q481 HydrophobicContact CG1-CG 4.4Å; I307-Q481 HydrophobicContact CG2-CG 4.15Å
308Q75.6Confident77.1Confident177 Ų17775.7 Ų75.783%0.82741%0.406SS*.  trans-76.7113.2171.4-66-167.824.600110.3E310 Q484Q308-E310 PolarHBondContact O-N 3.19Å; Q308-Q484 PolarHBondContact O-NE2 3.16Å
309I75Confident76.6Confident48 Ų4879 Ų7925%0.24642%0.424CS..  trans-87.4110.2179.6-43.2176.8000110.4A302 I307 L314 I480A302-I309 HydrophobicContact CB-CD1 3.63Å; A302-I309 HydrophobicContact CB-CG1 3.97Å; I307-I309 PolarHBondContact O-N 2.85Å; I309-L314 HydrophobicContact CB-CD1 4.19Å; I309-L314 HydrophobicContact CG2-CD1 3.19Å; I309-I480 HydrophobicContact CG2-CG2 4.05Å
310E71.1Confident76Confident101 Ų10175 Ų7547%0.47240%0.404SS..  trans-65.1142.1175.1-80.7-152.213800113.3Q308 T312 N313 L314Q308-E310 PolarHBondContact O-N 3.19Å; E310-T312 PolarHBondContact O-N 3.4Å; E310-T312 VanDerWaalsContact O-N 3.14Å; E310-N313 PolarHBondContact O-N 2.66Å; E310-N313 VanDerWaalsContact O-N 3.07Å; E310-L314 WeakPolarHBondContact O-CD1 3.33Å
311P65.6Low75.4Confident108 Ų10873.5 Ų73.570%0.70140%0.403SS*.G310 helixtrans-56.6-33177.6-20.229.4000113.4N313 L314 K315P311-N313 PolarHBondContact O-N 3.5Å; P311-L314 WeakPolarHBondContact O-CB 3.44Å; P311-L314 PolarHBondContact O-N 2.95Å; P311-L314 VanDerWaalsContact O-N 3.1Å; P311-K315 PolarHBondContact O-N 3.31Å
312T63.8Low74.9Confident77 Ų7772.4 Ų72.447%0.47240%0.403SS..G310 helixtrans-63.9-30.6-178.7-40.60000112.2E310 L314 K315E310-T312 PolarHBondContact O-N 3.4Å; E310-T312 VanDerWaalsContact O-N 3.14Å; T312-L314 VanDerWaalsContact C-N 3.34Å; T312-K315 WeakPolarHBondContact O-CB 3.32Å
313N67.3Low74.3Confident17 Ų1777.3 Ų77.39%0.09144%0.436CS..G310 helixtrans-78.7-19.4177.7-67.9-37.7000112.9E310 P311 I480 Q484 R487E310-N313 PolarHBondContact O-N 2.66Å; E310-N313 VanDerWaalsContact O-N 3.07Å; P311-N313 PolarHBondContact O-N 3.5Å; N313-I480 HydrophobicContact CB-CG2 4.45Å; N313-Q484 WeakPolarHBondContact ND2-CG 3.4Å; N313-R487 PolarHBondContact OD1-NH1 3.21Å
314L69.3Low74.1Confident52 Ų5280.8 Ų80.827%0.27244%0.439SS..G310 helixtrans-84.9-9174.7-82.974.5000113.5I294 I309 E310 P311 T312 N316 M317I294-L314 HydrophobicContact CD1-CB 4.17Å; I294-L314 HydrophobicContact CD1-CD2 3.51Å; I294-L314 HydrophobicContact CD1-CG 3.76Å; I294-L314 HydrophobicContact CG1-CD2 4.25Å; I294-L314 HydrophobicContact CG1-CG 4.34Å; I309-L314 HydrophobicContact CB-CD1 4.19Å; I309-L314 HydrophobicContact CG2-CD1 3.19Å; E310-L314 WeakPolarHBondContact O-CD1 3.33Å; P311-L314 WeakPolarHBondContact O-CB 3.44Å; P311-L314 PolarHBondContact O-N 2.95Å; P311-L314 VanDerWaalsContact O-N 3.1Å; T312-L314 VanDerWaalsContact C-N 3.34Å; L314-N316 PolarHBondContact O-N 2.96Å; L314-M317 PolarHBondContact O-N 3.03Å
315K66.5Low73.7Confident179 Ų17977.7 Ų77.778%0.77843%0.426SS*.THydrogen-bonded Turntrans-54.6-31.4-172.5-171.6175.8179.4-1800114.1P311 T312P311-K315 PolarHBondContact O-N 3.31Å; T312-K315 WeakPolarHBondContact O-CB 3.32Å
316N68.2Low73.6Confident107 Ų10775.3 Ų75.357%0.57241%0.414SS*.THydrogen-bonded Turntrans-102.57.7179.4-64.3-10.8000113.4V292 L314 Q328V292-N316 WeakPolarHBondContact CG1-O 3.43Å; L314-N316 PolarHBondContact O-N 2.96Å; N316-Q328 PolarHBondContact O-OE1 3.43Å
317M73.9Confident73.6Confident36 Ų3681.5 Ų81.518%0.17742%0.423CS..  trans-105.6150.1-178.5-59.6-164.8-179.600111.6V292 I294 L314 L476 I480V292-M317 WeakPolarHBondContact O-CA 3.32Å; I294-M317 HydrophobicContact CD1-CB 3.69Å; I294-M317 HydrophobicContact CG1-CB 3.67Å; I294-M317 HydrophobicContact CG1-SD 4.17Å; L314-M317 PolarHBondContact O-N 3.03Å; M317-L476 HydrophobicContact CE-CD1 3.8Å; M317-L476 HydrophobicContact CE-CG 4.3Å; M317-I480 HydrophobicContact CE-CD1 3.74Å; M317-I480 HydrophobicContact CE-CG1 3.66Å; M317-I480 HydrophobicContact SD-CD1 4.35Å
318V77.8Confident73.5Confident10 Ų1084.4 Ų84.46%0.06144%0.436CS..EExtended strand (participates in β ladder)trans-111.3130.4-173.3-179.90000110.6V292 Y293 I294 S320 T326 E329V292-V318 PolarHBondContact O-N 3.37Å; Y293-V318 CarbonylContact C-O 3.48Å; Y293-V318 WeakPolarHBondContact CA-O 3.43Å; Y293-V318 HydrophobicContact CD1-CB 3.96Å; Y293-V318 HydrophobicContact CD1-CG1 4.11Å; Y293-V318 HydrophobicContact CE1-CB 4.25Å; Y293-V318 HydrophobicContact CE1-CG1 4.19Å; I294-V318 PolarHBondContact N-O 2.91Å; V318-S320 PolarHBondContact O-N 2.98Å; V318-T326 HydrophobicContact CG1-CG2 4.18Å; V318-T326 HydrophobicContact CG2-CG2 4.28Å; V318-E329 WeakPolarHBondContact CG1-OE1 3.24Å; V318-E329 HydrophobicContact CG2-CG 4.43Å
319N75.6Confident73.8Confident74 Ų7476.7 Ų76.740%0.39640%0.4SS..EExtended strand (participates in β ladder)trans-70.3119.9174.3-175.5-29.7000111T321 S322N319-T321 PolarHBondContact O-N 3.48Å; N319-T321 PolarHBondContact OD1-N 3.03Å; N319-T321 PolarHBondContact OD1-OG1 3.26Å; N319-T321 VanDerWaalsContact OD1-OG1 3.05Å; N319-S322 PolarHBondContact O-N 3.42Å; N319-S322 PolarHBondContact OD1-N 2.78Å
320S72.6Confident74.2Confident7 Ų779.2 Ų79.25%0.04941%0.41CS..THydrogen-bonded Turntrans-64.9-20.2-175.8-179.50000114.7I294 V318 K459I294-S320 PolarHBondContact O-N 3Å; I294-S320 VanDerWaalsContact O-N 3.16Å; V318-S320 PolarHBondContact O-N 2.98Å; S320-K459 WeakPolarHBondContact O-CE 3.34Å; S320-K459 PolarHBondContact O-NZ 3.44Å; S320-K459 VanDerWaalsContact OG-CE 3.27Å; S320-K459 WeakPolarHBondContact OG-CE 3.45Å
321T72.2Confident74.8Confident85 Ų8578.4 Ų78.452%0.52141%0.412SS..THydrogen-bonded Turntrans-113.8-5.8-174.847.50000113.8N319N319-T321 PolarHBondContact O-N 3.48Å; N319-T321 PolarHBondContact OD1-N 3.03Å; N319-T321 PolarHBondContact OD1-OG1 3.26Å; N319-T321 VanDerWaalsContact OD1-OG1 3.05Å
322S75.8Confident75.7Confident38 Ų3878.9 Ų78.927%0.26640%0.403SS..  trans-72.6136.9179.6179.10000111.1N319 K324 R455N319-S322 PolarHBondContact O-N 3.42Å; N319-S322 PolarHBondContact OD1-N 2.78Å; S322-K324 PolarHBondContact O-N 2.9Å; S322-K324 WeakPolarHBondContact OG-CB 3.41Å; S322-K324 PolarHBondContact OG-N 2.98Å; S322-R455 PolarHBondContact O-NH1 3.04Å
323C73Confident76.8Confident105 Ų10575.3 Ų75.371%0.70938%0.381SS*.  trans-79.4-0168.2-65.60000113Y452C323-Y452 PolarHBondContact O-OH 3.31Å
324K80.7Confident77.8Confident168 Ų16878.4 Ų78.473%0.7340%0.397SS*.SBendtrans-82.7131.2177.2-62.2-175.9177.2-178.90110.2S322 R455S322-K324 PolarHBondContact O-N 2.9Å; S322-K324 WeakPolarHBondContact OG-CB 3.41Å; S322-K324 PolarHBondContact OG-N 2.98Å; K324-R455 PolarHBondContact O-NH2 3.44Å
325I79.5Confident78.8Confident62 Ų6279.1 Ų79.132%0.31841%0.41SS..PPolyproline II helixtrans-78.5126170.6-62.1175.8000107.7E329 F330I325-E329 HydrophobicContact CG2-CB 4.04Å; I325-F330 HydrophobicContact CG2-CB 4.14Å
326T81.6Confident79.9Confident43 Ų4371.6 Ų71.626%0.26438%0.38SS..PPolyproline II helixtrans-78.1154.9177.460.70000111.1V318 Q328 E329 F330V318-T326 HydrophobicContact CG1-CG2 4.18Å; V318-T326 HydrophobicContact CG2-CG2 4.28Å; T326-Q328 PolarHBondContact O-N 3.35Å; T326-E329 WeakPolarHBondContact CB-OE2 3.37Å; T326-E329 PolarHBondContact N-OE2 3.4Å; T326-E329 PolarHBondContact O-N 3.4Å; T326-E329 WeakPolarHBondContact OG1-CB 3.15Å; T326-E329 VanDerWaalsContact OG1-CD 3.27Å; T326-E329 VanDerWaalsContact OG1-CG 3.23Å; T326-E329 WeakPolarHBondContact OG1-CG 3.49Å; T326-E329 PolarHBondContact OG1-N 2.78Å; T326-E329 PolarHBondContact OG1-OE2 2.97Å; T326-F330 PolarHBondContact O-N 3.41Å
327K80Confident81.1Confident195 Ų19569 Ų6985%0.84837%0.365SS*.Hα-helixtrans-54.1-38.2176.6-67.2-174.3178.6-176.40111.9F330 T331K327-F330 PolarHBondContact O-N 2.86Å; K327-T331 WeakPolarHBondContact O-CG2 3.28Å; K327-T331 PolarHBondContact O-N 2.87Å; K327-T331 VanDerWaalsContact O-N 3.09Å
328Q77.7Confident82Confident84 Ų8471.3 Ų71.339%0.39338%0.381SS..Hα-helixtrans-69.8-32.4177.7-169.1-175900113.5N316 T326 T331N316-Q328 PolarHBondContact O-OE1 3.43Å; T326-Q328 PolarHBondContact O-N 3.35Å; Q328-T331 PolarHBondContact O-OG1 3.27Å
329E83.4Confident82.7Confident15 Ų1574 Ų747%0.0740%0.398CS..Hα-helixtrans-74.9-35.5173.6-74.1166.3130.100111.3V318 I325 T326 K332 C333 V451 R455V318-E329 WeakPolarHBondContact CG1-OE1 3.24Å; V318-E329 HydrophobicContact CG2-CG 4.43Å; I325-E329 HydrophobicContact CG2-CB 4.04Å; T326-E329 WeakPolarHBondContact CB-OE2 3.37Å; T326-E329 PolarHBondContact N-OE2 3.4Å; T326-E329 PolarHBondContact O-N 3.4Å; T326-E329 WeakPolarHBondContact OG1-CB 3.15Å; T326-E329 VanDerWaalsContact OG1-CD 3.27Å; T326-E329 VanDerWaalsContact OG1-CG 3.23Å; T326-E329 WeakPolarHBondContact OG1-CG 3.49Å; T326-E329 PolarHBondContact OG1-N 2.78Å; T326-E329 PolarHBondContact OG1-OE2 2.97Å; E329-K332 WeakPolarHBondContact O-CB 3.45Å; E329-K332 PolarHBondContact O-N 3.32Å; E329-C333 PolarHBondContact O-N 3.46Å; E329-V451 HydrophobicContact CB-CG1 4.22Å; E329-V451 HydrophobicContact CB-CG2 4.36Å; E329-V451 HydrophobicContact CG-CG1 4.23Å; E329-V451 VanDerWaalsContact OE1-CG1 3.3Å; E329-V451 WeakPolarHBondContact OE1-CG1 3.23Å; E329-R455 IonicContact OE1-CZ 3.62Å; E329-R455 VanDerWaalsContact OE1-CZ 3.28Å; E329-R455 IonicContact OE1-NE 3.28Å; E329-R455 PolarHBondContact OE1-NE 2.89Å; E329-R455 IonicContact OE1-NH2 3.82Å; E329-R455 PolarHBondContact OE1-NH2 3.07Å; E329-R455 IonicContact OE2-CZ 3.7Å; E329-R455 IonicContact OE2-NH2 3.7Å; E329-R455 PolarHBondContact OE2-NH2 2.89Å
330F83.4Confident83.5Confident101 Ų10170.8 Ų70.844%0.44338%0.381SS..Hα-helixtrans-64.6-41.4177-172.6-100.2000112.3I325 T326 K327 K332 C333 L334I325-F330 HydrophobicContact CG2-CB 4.14Å; T326-F330 PolarHBondContact O-N 3.41Å; K327-F330 PolarHBondContact O-N 2.86Å; F330-K332 PolarHBondContact O-N 2.8Å; F330-C333 WeakPolarHBondContact O-CA 3.28Å; F330-C333 WeakPolarHBondContact O-CB 3.45Å; F330-C333 PolarHBondContact O-N 3.45Å; F330-L334 HydrophobicContact CE1-CD2 3.88Å; F330-L334 HydrophobicContact CE1-CG 4.43Å; F330-L334 HydrophobicContact CZ-CD2 4.32Å; F330-L334 PolarHBondContact O-N 2.83Å
331T83.8Confident84.4Confident84 Ų8472.6 Ų72.652%0.51539%0.391SS..Hα-helixtrans-61.7-32.5176.354.30000112.4K327 Q328 C333 L334K327-T331 WeakPolarHBondContact O-CG2 3.28Å; K327-T331 PolarHBondContact O-N 2.87Å; K327-T331 VanDerWaalsContact O-N 3.09Å; Q328-T331 PolarHBondContact O-OG1 3.27Å; T331-C333 PolarHBondContact O-N 2.65Å; T331-L334 PolarHBondContact O-N 3.49Å
332K83.4Confident85.5Confident117 Ų11773.4 Ų73.451%0.50939%0.392SS..Hα-helixtrans-69.7-17.5173.1-66.3178.5-178.11770113.4E329 F330 P336E329-K332 WeakPolarHBondContact O-CB 3.45Å; E329-K332 PolarHBondContact O-N 3.32Å; F330-K332 PolarHBondContact O-N 2.8Å; K332-P336 VanDerWaalsContact O-CD 3.26Å; K332-P336 WeakPolarHBondContact O-CD 3.44Å
333C86.8Confident86.3Confident2 Ų277 Ų771%0.01440%0.4CS..Hα-helixtrans-86.8-22.9175.5-67.70000112.6E329 F330 T331 A335 P336 I337 V447E329-C333 PolarHBondContact O-N 3.46Å; F330-C333 WeakPolarHBondContact O-CA 3.28Å; F330-C333 WeakPolarHBondContact O-CB 3.45Å; F330-C333 PolarHBondContact O-N 3.45Å; T331-C333 PolarHBondContact O-N 2.65Å; C333-A335 PolarHBondContact O-N 3.32Å; C333-P336 VanDerWaalsContact O-CD 3.25Å; C333-P336 WeakPolarHBondContact O-CD 3.43Å; C333-I337 VanDerWaalsContact O-CG1 3.31Å; C333-I337 WeakPolarHBondContact O-CG1 3.47Å; C333-I337 PolarHBondContact O-N 2.86Å; C333-V447 HydrophobicContact CB-CG1 3.9Å
334L88.8Confident87.2Confident83 Ų8375 Ų7544%0.43538%0.38SS..Hα-helixtrans-58.5-50.4-177.5-69.3175.8000113F330 T331 I337 V338F330-L334 HydrophobicContact CE1-CD2 3.88Å; F330-L334 HydrophobicContact CE1-CG 4.43Å; F330-L334 HydrophobicContact CZ-CD2 4.32Å; F330-L334 PolarHBondContact O-N 2.83Å; T331-L334 PolarHBondContact O-N 3.49Å; L334-I337 WeakPolarHBondContact O-CB 3.34Å; L334-I337 PolarHBondContact O-N 2.92Å; L334-I337 VanDerWaalsContact O-N 3.12Å; L334-V338 WeakPolarHBondContact O-CG2 3Å; L334-V338 PolarHBondContact O-N 2.88Å
335A90Very high87.8Confident66 Ų6671.5 Ų71.555%0.54537%0.368SS..Hα-helixtrans-59.5-47.5179.100000112.5C333 I337 V338 V339C333-A335 PolarHBondContact O-N 3.32Å; A335-I337 PolarHBondContact O-N 2.83Å; A335-V338 PolarHBondContact O-N 3.45Å; A335-V339 WeakPolarHBondContact O-CG2 3.48Å; A335-V339 PolarHBondContact O-N 3.15Å
336P90.4Very high88.6Confident22 Ų2272.4 Ų72.414%0.14338%0.377CS..Hα-helixtrans-54.3-42169.3-30.734.8000115.4K332 C333 V339 V340 V447K332-P336 VanDerWaalsContact O-CD 3.26Å; K332-P336 WeakPolarHBondContact O-CD 3.44Å; C333-P336 VanDerWaalsContact O-CD 3.25Å; C333-P336 WeakPolarHBondContact O-CD 3.43Å; P336-V339 PolarHBondContact O-N 3.38Å; P336-V340 VanDerWaalsContact O-CG2 3.26Å; P336-V340 WeakPolarHBondContact O-CG2 3.26Å; P336-V340 PolarHBondContact O-N 3.29Å; P336-V447 HydrophobicContact CB-CG1 3.95Å; P336-V447 HydrophobicContact CB-CG2 4.21Å
337I92.3Very high89.1Confident51 Ų5170.8 Ų70.826%0.26237%0.366SS..Hα-helixtrans-60.1-52.1177.9-69170000109.7C333 L334 A335 V339 V340 T341 Y444 V447C333-I337 VanDerWaalsContact O-CG1 3.31Å; C333-I337 WeakPolarHBondContact O-CG1 3.47Å; C333-I337 PolarHBondContact O-N 2.86Å; L334-I337 WeakPolarHBondContact O-CB 3.34Å; L334-I337 PolarHBondContact O-N 2.92Å; L334-I337 VanDerWaalsContact O-N 3.12Å; A335-I337 PolarHBondContact O-N 2.83Å; I337-V339 VanDerWaalsContact C-N 3.31Å; I337-V339 PolarHBondContact O-N 3.37Å; I337-V340 PolarHBondContact O-N 2.98Å; I337-V340 VanDerWaalsContact O-N 3.17Å; I337-T341 PolarHBondContact O-N 2.95Å; I337-T341 PolarHBondContact O-OG1 3.07Å; I337-Y444 HydrophobicContact CG2-CE1 4.47Å; I337-V447 HydrophobicContact CD1-CG1 4.44Å; I337-V447 HydrophobicContact CG1-CG1 3.76Å
338V93.1Very high89.8Confident85 Ų8564.7 Ų64.752%0.51534%0.342SS..Hα-helixtrans-56.3-46.7-1801740000111L334 A335 V340 T341 L342L334-V338 WeakPolarHBondContact O-CG2 3Å; L334-V338 PolarHBondContact O-N 2.88Å; A335-V338 PolarHBondContact O-N 3.45Å; V338-V340 PolarHBondContact O-N 3.01Å; V338-T341 PolarHBondContact O-N 3.41Å; V338-L342 HydrophobicContact CG1-CD1 4.17Å; V338-L342 WeakPolarHBondContact O-CG 2.81Å; V338-L342 PolarHBondContact O-N 3.27Å
339V91.8Very high90.6Very high68 Ų6867 Ų6741%0.41235%0.351SS..Hα-helixtrans-60.4-47.6178.5172.50000111.4A335 P336 I337 T341 L342 Y343A335-V339 WeakPolarHBondContact O-CG2 3.48Å; A335-V339 PolarHBondContact O-N 3.15Å; P336-V339 PolarHBondContact O-N 3.38Å; I337-V339 VanDerWaalsContact C-N 3.31Å; I337-V339 PolarHBondContact O-N 3.37Å; V339-T341 VanDerWaalsContact C-N 3.32Å; V339-T341 PolarHBondContact O-N 3.46Å; V339-L342 PolarHBondContact O-N 3.27Å; V339-Y343 HydrophobicContact CG1-CD2 3.88Å; V339-Y343 HydrophobicContact CG1-CE2 3.65Å; V339-Y343 WeakPolarHBondContact O-CD2 2.9Å; V339-Y343 PolarHBondContact O-N 2.78Å; V339-Y343 VanDerWaalsContact O-N 3.16Å
340V92.6Very high91.2Very high5 Ų567.7 Ų67.73%0.0336%0.355CS..Hα-helixtrans-60.8-42.9177.7172.80000111.4R144 I148 P336 I337 V338 L342 Y343 F344 Y444 V447R144-V340 VanDerWaalsContact CD-CG2 3.46Å; R144-V340 HydrophobicContact CG-CG2 4.29Å; I148-V340 HydrophobicContact CD1-CG2 4.38Å; P336-V340 VanDerWaalsContact O-CG2 3.26Å; P336-V340 WeakPolarHBondContact O-CG2 3.26Å; P336-V340 PolarHBondContact O-N 3.29Å; I337-V340 PolarHBondContact O-N 2.98Å; I337-V340 VanDerWaalsContact O-N 3.17Å; V338-V340 PolarHBondContact O-N 3.01Å; V340-L342 PolarHBondContact O-N 3.02Å; V340-Y343 PolarHBondContact O-N 2.86Å; V340-F344 WeakPolarHBondContact O-CB 3.46Å; V340-F344 PolarHBondContact O-N 3.4Å; V340-Y444 HydrophobicContact CB-CE1 4.47Å; V340-Y444 HydrophobicContact CG1-CD1 4.2Å; V340-Y444 HydrophobicContact CG1-CD2 4.24Å; V340-Y444 HydrophobicContact CG1-CE1 3.96Å; V340-Y444 HydrophobicContact CG1-CE2 3.99Å; V340-Y444 HydrophobicContact CG1-CG 4.33Å; V340-V447 HydrophobicContact CG2-CG2 4.27Å
341T93.2Very high91.7Very high45 Ų4565 Ų6528%0.27634%0.344SS..Hα-helixtrans-62.6-41.7178.7-56.10000111.7I337 V338 V339 Y343 F344 I345 Y444I337-T341 PolarHBondContact O-N 2.95Å; I337-T341 PolarHBondContact O-OG1 3.07Å; V338-T341 PolarHBondContact O-N 3.41Å; V339-T341 VanDerWaalsContact C-N 3.32Å; V339-T341 PolarHBondContact O-N 3.46Å; T341-Y343 PolarHBondContact O-N 3.02Å; T341-F344 PolarHBondContact O-N 3.27Å; T341-I345 HydrophobicContact CG2-CD1 4.09Å; T341-I345 HydrophobicContact CG2-CG1 4.5Å; T341-I345 VanDerWaalsContact O-CG1 3.29Å; T341-I345 WeakPolarHBondContact O-CG1 3.47Å; T341-I345 PolarHBondContact O-N 3.13Å; T341-Y444 VanDerWaalsContact CA-OH 3.3Å; T341-Y444 WeakPolarHBondContact CA-OH 3.24Å; T341-Y444 WeakPolarHBondContact CB-OH 3.2Å; T341-Y444 PolarHBondContact OG1-OH 3.01Å
342L94.4Very high92.1Very high103 Ų10364.5 Ų64.554%0.53934%0.341SS..Hα-helixtrans-60.5-46.2175.4-70.9170.9000112.2V338 V339 V340 F344 I345 V346V338-L342 HydrophobicContact CG1-CD1 4.17Å; V338-L342 WeakPolarHBondContact O-CG 2.81Å; V338-L342 PolarHBondContact O-N 3.27Å; V339-L342 PolarHBondContact O-N 3.27Å; V340-L342 PolarHBondContact O-N 3.02Å; L342-F344 VanDerWaalsContact C-N 3.29Å; L342-F344 PolarHBondContact O-N 2.99Å; L342-I345 PolarHBondContact O-N 3.43Å; L342-V346 PolarHBondContact O-N 3.02Å; L342-V346 VanDerWaalsContact O-N 3.17Å
343Y92.4Very high92.7Very high112 Ų11262 Ų6244%0.43933%0.333SS..Hα-helixtrans-60.7-40.3175-80.7-72.1000112.2I148 V339 V340 T341 V346 I347I148-Y343 HydrophobicContact CD1-CD2 4.08Å; I148-Y343 HydrophobicContact CD1-CE2 4.4Å; I148-Y343 HydrophobicContact CG2-CD1 3.83Å; I148-Y343 HydrophobicContact CG2-CD2 4.02Å; I148-Y343 HydrophobicContact CG2-CE1 3.98Å; I148-Y343 HydrophobicContact CG2-CE2 4.17Å; I148-Y343 HydrophobicContact CG2-CG 3.86Å; V339-Y343 HydrophobicContact CG1-CD2 3.88Å; V339-Y343 HydrophobicContact CG1-CE2 3.65Å; V339-Y343 WeakPolarHBondContact O-CD2 2.9Å; V339-Y343 PolarHBondContact O-N 2.78Å; V339-Y343 VanDerWaalsContact O-N 3.16Å; V340-Y343 PolarHBondContact O-N 2.86Å; T341-Y343 PolarHBondContact O-N 3.02Å; Y343-V346 PolarHBondContact O-N 3.39Å; Y343-I347 WeakPolarHBondContact O-CG1 3.37Å; Y343-I347 PolarHBondContact O-N 3.06Å
344F91.2Very high93Very high63 Ų6362.2 Ų62.228%0.27633%0.334SS..Hα-helixtrans-66.3-38.6178.6-177.9-126.3000112.5V340 T341 L342 V346 I347 I348 C440V340-F344 WeakPolarHBondContact O-CB 3.46Å; V340-F344 PolarHBondContact O-N 3.4Å; T341-F344 PolarHBondContact O-N 3.27Å; L342-F344 VanDerWaalsContact C-N 3.29Å; L342-F344 PolarHBondContact O-N 2.99Å; F344-V346 VanDerWaalsContact C-N 3.33Å; F344-V346 PolarHBondContact O-N 3.42Å; F344-I347 PolarHBondContact O-N 3.24Å; F344-I348 HydrophobicContact CD1-CD1 3.56Å; F344-I348 HydrophobicContact CD1-CG1 4.47Å; F344-I348 HydrophobicContact CD2-CD1 4.09Å; F344-I348 HydrophobicContact CD2-CG1 4.14Å; F344-I348 HydrophobicContact CE1-CD1 3.18Å; F344-I348 HydrophobicContact CE1-CG1 4.15Å; F344-I348 HydrophobicContact CE2-CD1 3.77Å; F344-I348 HydrophobicContact CE2-CG1 3.79Å; F344-I348 HydrophobicContact CG-CD1 4.03Å; F344-I348 HydrophobicContact CG-CG1 4.49Å; F344-I348 HydrophobicContact CZ-CD1 3.31Å; F344-I348 HydrophobicContact CZ-CG1 3.81Å; F344-I348 WeakPolarHBondContact O-CG1 2.97Å; F344-I348 PolarHBondContact O-N 3.43Å; F344-C440 HydrophobicContact CD2-CB 3.82Å; F344-C440 WeakPolarHBondContact CD2-SG 3.34Å; F344-C440 HydrophobicContact CE2-CB 3.85Å
345I94.9Very high93.2Very high95 Ų9562.1 Ų62.149%0.48733%0.331SS..Hα-helixtrans-59.5-45.6174.2-70.3164.2000110.4T341 L342 I347 I348 F349T341-I345 HydrophobicContact CG2-CD1 4.09Å; T341-I345 HydrophobicContact CG2-CG1 4.5Å; T341-I345 VanDerWaalsContact O-CG1 3.29Å; T341-I345 WeakPolarHBondContact O-CG1 3.47Å; T341-I345 PolarHBondContact O-N 3.13Å; L342-I345 PolarHBondContact O-N 3.43Å; I345-I347 PolarHBondContact O-N 3.15Å; I345-I348 PolarHBondContact O-N 2.97Å; I345-F349 VanDerWaalsContact O-CB 3.32Å; I345-F349 WeakPolarHBondContact O-CB 3.47Å; I345-F349 PolarHBondContact O-N 3.46Å
346V94.8Very high93.3Very high82 Ų8263.7 Ų63.750%0.49733%0.329SS..Hα-helixtrans-61.3-44.7176.9175.30000111.1L342 Y343 F344 F349 I350L342-V346 PolarHBondContact O-N 3.02Å; L342-V346 VanDerWaalsContact O-N 3.17Å; Y343-V346 PolarHBondContact O-N 3.39Å; F344-V346 VanDerWaalsContact C-N 3.33Å; F344-V346 PolarHBondContact O-N 3.42Å; V346-F349 PolarHBondContact O-N 3.14Å; V346-I350 WeakPolarHBondContact O-CG1 3.2Å; V346-I350 PolarHBondContact O-N 2.72Å
347I93.3Very high93.4Very high8 Ų863.2 Ų63.24%0.04133%0.326CS..Hα-helixtrans-59.1-49.8176.9-75.8165.7000111.2L155 Y343 F344 I345 F349 I350 M351 L436L155-I347 HydrophobicContact CD2-CG1 4.1Å; Y343-I347 WeakPolarHBondContact O-CG1 3.37Å; Y343-I347 PolarHBondContact O-N 3.06Å; F344-I347 PolarHBondContact O-N 3.24Å; I345-I347 PolarHBondContact O-N 3.15Å; I347-F349 VanDerWaalsContact C-N 3.31Å; I347-F349 PolarHBondContact O-N 2.98Å; I347-I350 PolarHBondContact O-N 3.09Å; I347-M351 HydrophobicContact CG2-CG 4.49Å; I347-M351 HydrophobicContact CG2-SD 3.91Å; I347-M351 VanDerWaalsContact O-CG 3.32Å; I347-M351 WeakPolarHBondContact O-CG 3.31Å; I347-M351 PolarHBondContact O-N 2.91Å; I347-L436 HydrophobicContact CD1-CD1 4.37Å; I347-L436 HydrophobicContact CG2-CD2 3.27Å; I347-L436 HydrophobicContact CG2-CG 3.77Å
348I93.9Very high93.3Very high68 Ų6863.5 Ų63.535%0.34932%0.324SS..Hα-helixtrans-60-45178.1-69.7164.5000110.3F344 I345 I350 M351 V352F344-I348 HydrophobicContact CD1-CD1 3.56Å; F344-I348 HydrophobicContact CD1-CG1 4.47Å; F344-I348 HydrophobicContact CD2-CD1 4.09Å; F344-I348 HydrophobicContact CD2-CG1 4.14Å; F344-I348 HydrophobicContact CE1-CD1 3.18Å; F344-I348 HydrophobicContact CE1-CG1 4.15Å; F344-I348 HydrophobicContact CE2-CD1 3.77Å; F344-I348 HydrophobicContact CE2-CG1 3.79Å; F344-I348 HydrophobicContact CG-CD1 4.03Å; F344-I348 HydrophobicContact CG-CG1 4.49Å; F344-I348 HydrophobicContact CZ-CD1 3.31Å; F344-I348 HydrophobicContact CZ-CG1 3.81Å; F344-I348 WeakPolarHBondContact O-CG1 2.97Å; F344-I348 PolarHBondContact O-N 3.43Å; I345-I348 PolarHBondContact O-N 2.97Å; I348-I350 VanDerWaalsContact C-N 3.33Å; I348-I350 PolarHBondContact O-N 3.19Å; I348-M351 WeakPolarHBondContact O-CB 3.08Å; I348-M351 PolarHBondContact O-N 3.26Å; I348-M351 VanDerWaalsContact O-N 3.16Å; I348-V352 HydrophobicContact CG2-CG2 4.12Å; I348-V352 WeakPolarHBondContact O-CG2 2.84Å; I348-V352 PolarHBondContact O-N 3.14Å
349F95.8Very high93.2Very high131 Ų13163.5 Ų63.558%0.57532%0.318SS*.Hα-helixtrans-56.8-47.3179.7174.4-98.4000111.6I345 V346 I347 V352 L353I345-F349 VanDerWaalsContact O-CB 3.32Å; I345-F349 WeakPolarHBondContact O-CB 3.47Å; I345-F349 PolarHBondContact O-N 3.46Å; V346-F349 PolarHBondContact O-N 3.14Å; I347-F349 VanDerWaalsContact C-N 3.31Å; I347-F349 PolarHBondContact O-N 2.98Å; F349-V352 PolarHBondContact O-N 3.46Å; F349-L353 WeakPolarHBondContact O-CB 3.38Å; F349-L353 PolarHBondContact O-N 3.14Å
350I94.9Very high92.9Very high30 Ų3065.1 Ų65.115%0.15432%0.324CS..Hα-helixtrans-67.9-35.4178-62-64.9000111.7L155 I159 I160 I163 V346 I347 I348 L353 D354L155-I350 HydrophobicContact CD1-CB 3.96Å; L155-I350 HydrophobicContact CD1-CG2 3.71Å; L155-I350 HydrophobicContact CD2-CB 4.42Å; L155-I350 HydrophobicContact CD2-CG1 4.39Å; L155-I350 HydrophobicContact CD2-CG2 4.46Å; L155-I350 HydrophobicContact CG-CG2 4.16Å; I159-I350 HydrophobicContact CG2-CG2 3.87Å; I160-I350 HydrophobicContact CG1-CG2 4.25Å; I163-I350 HydrophobicContact CD1-CG2 4.12Å; V346-I350 WeakPolarHBondContact O-CG1 3.2Å; V346-I350 PolarHBondContact O-N 2.72Å; I347-I350 PolarHBondContact O-N 3.09Å; I348-I350 VanDerWaalsContact C-N 3.33Å; I348-I350 PolarHBondContact O-N 3.19Å; I350-L353 HydrophobicContact CD1-CD2 4.41Å; I350-L353 WeakPolarHBondContact O-CB 3.33Å; I350-L353 PolarHBondContact O-N 2.9Å; I350-D354 PolarHBondContact O-N 3.16Å
351M92.9Very high92.6Very high44 Ų4465.2 Ų65.222%0.21733%0.325CS..Hα-helixtrans-63.8-41.3172.9-74.2175.757.900112.6I159 I347 I348 L353 D354 H355 R433 L436I159-M351 HydrophobicContact CD1-CG 3.6Å; I159-M351 HydrophobicContact CD1-SD 4.49Å; I347-M351 HydrophobicContact CG2-CG 4.49Å; I347-M351 HydrophobicContact CG2-SD 3.91Å; I347-M351 VanDerWaalsContact O-CG 3.32Å; I347-M351 WeakPolarHBondContact O-CG 3.31Å; I347-M351 PolarHBondContact O-N 2.91Å; I348-M351 WeakPolarHBondContact O-CB 3.08Å; I348-M351 PolarHBondContact O-N 3.26Å; I348-M351 VanDerWaalsContact O-N 3.16Å; M351-L353 VanDerWaalsContact C-N 3.33Å; M351-D354 PolarHBondContact O-N 3.13Å; M351-H355 PolarHBondContact O-N 3.04Å; M351-R433 HydrophobicContact CE-CB 3.83Å; M351-R433 HydrophobicContact CE-CG 3.58Å; M351-L436 HydrophobicContact SD-CD2 3.92Å
352V94.1Very high92.2Very high75 Ų7565.1 Ų65.146%0.45532%0.324SS..Hα-helixtrans-65.2-41.7174.8170.60000109.7I348 F349 D354 H355 I356I348-V352 HydrophobicContact CG2-CG2 4.12Å; I348-V352 WeakPolarHBondContact O-CG2 2.84Å; I348-V352 PolarHBondContact O-N 3.14Å; F349-V352 PolarHBondContact O-N 3.46Å; V352-D354 PolarHBondContact O-N 3.37Å; V352-H355 WeakPolarHBondContact O-CB 3.42Å; V352-H355 PolarHBondContact O-N 3.47Å; V352-I356 HydrophobicContact CG1-CD1 3.74Å; V352-I356 HydrophobicContact CG1-CG1 4.28Å; V352-I356 VanDerWaalsContact O-CG1 3.3Å; V352-I356 WeakPolarHBondContact O-CG1 3.47Å; V352-I356 PolarHBondContact O-N 2.9Å
353L94.6Very high91.7Very high63 Ų6365.3 Ų65.333%0.3333%0.33SS..Hα-helixtrans-59.6-43.7175.7-176.464.3000112.2I163 F349 I350 M351 H355 I356 V357I163-L353 HydrophobicContact CD1-CD2 4.37Å; I163-L353 HydrophobicContact CD1-CG 4.39Å; F349-L353 WeakPolarHBondContact O-CB 3.38Å; F349-L353 PolarHBondContact O-N 3.14Å; I350-L353 HydrophobicContact CD1-CD2 4.41Å; I350-L353 WeakPolarHBondContact O-CB 3.33Å; I350-L353 PolarHBondContact O-N 2.9Å; M351-L353 VanDerWaalsContact C-N 3.33Å; L353-H355 VanDerWaalsContact C-N 3.3Å; L353-H355 PolarHBondContact O-N 3.04Å; L353-I356 PolarHBondContact O-N 3.3Å; L353-V357 HydrophobicContact CD1-CG2 4.36Å; L353-V357 HydrophobicContact CG-CG2 4.46Å; L353-V357 WeakPolarHBondContact O-CG2 3.22Å; L353-V357 PolarHBondContact O-N 2.78Å
354D94.3Very high90.7Very high7 Ų761.3 Ų61.34%0.03732%0.318CS..Hα-helixtrans-58.8-42.3174.8-176.240.9000112.2I159 N162 I163 I350 M351 V352 V357 Y358 P428I159-D354 HydrophobicContact CG2-CB 3.64Å; N162-D354 PolarHBondContact ND2-OD1 2.97Å; N162-D354 PolarHBondContact ND2-OD2 3.46Å; I163-D354 HydrophobicContact CD1-CB 3.93Å; I163-D354 HydrophobicContact CG1-CB 3.63Å; I163-D354 WeakPolarHBondContact CG1-OD1 3.37Å; I350-D354 PolarHBondContact O-N 3.16Å; M351-D354 PolarHBondContact O-N 3.13Å; V352-D354 PolarHBondContact O-N 3.37Å; D354-V357 PolarHBondContact O-N 2.86Å; D354-Y358 WeakPolarHBondContact O-CB 3.34Å; D354-Y358 PolarHBondContact O-N 3Å; D354-P428 WeakPolarHBondContact OD2-CB 3.27Å
355H92.7Very high89.8Confident82 Ų8258.7 Ų58.738%0.3831%0.309SS..Hα-helixtrans-66.9-40.9176-162.855.4000112.6M351 V352 L353 Y358 H359M351-H355 PolarHBondContact O-N 3.04Å; V352-H355 WeakPolarHBondContact O-CB 3.42Å; V352-H355 PolarHBondContact O-N 3.47Å; L353-H355 VanDerWaalsContact C-N 3.3Å; L353-H355 PolarHBondContact O-N 3.04Å; H355-Y358 PolarHBondContact O-N 3.35Å; H355-H359 AromaticContact CD2-CD2 3.66Å; H355-H359 AromaticContact CD2-NE2 3.97Å; H355-H359 AromaticContact CE1-CD2 3.37Å; H355-H359 PolarHBondContact CE1-CD2 3.46Å; H355-H359 AromaticContact CE1-NE2 3.03Å; H355-H359 PolarHBondContact CE1-NE2 3.49Å; H355-H359 AromaticContact CG-CD2 3.9Å; H355-H359 AromaticContact ND1-CD2 3.72Å; H355-H359 AromaticContact ND1-NE2 3.8Å; H355-H359 AromaticContact NE2-CD2 3.36Å; H355-H359 PolarHBondContact NE2-CD2 3.45Å; H355-H359 AromaticContact NE2-NE2 3.16Å; H355-H359 PolarHBondContact NE2-NE2 2.92Å; H355-H359 VanDerWaalsContact NE2-NE2 3.16Å; H355-H359 WeakPolarHBondContact O-CB 3.27Å; H355-H359 PolarHBondContact O-CD2 2.81Å; H355-H359 VanDerWaalsContact O-CD2 3.3Å; H355-H359 PolarHBondContact O-N 2.9Å
356I92.5Very high88.6Confident98 Ų9857.4 Ų57.450%0.50331%0.307SS..Hα-helixtrans-61.4-46.5174.8-69.4167.5000110.2V352 L353 H359 L360V352-I356 HydrophobicContact CG1-CD1 3.74Å; V352-I356 HydrophobicContact CG1-CG1 4.28Å; V352-I356 VanDerWaalsContact O-CG1 3.3Å; V352-I356 WeakPolarHBondContact O-CG1 3.47Å; V352-I356 PolarHBondContact O-N 2.9Å; L353-I356 PolarHBondContact O-N 3.3Å; I356-H359 PolarHBondContact O-N 3.18Å; I356-L360 VanDerWaalsContact O-CB 3.3Å; I356-L360 WeakPolarHBondContact O-CB 3.33Å; I356-L360 PolarHBondContact O-N 3.42Å
357V91.1Very high87.2Confident12 Ų1262.8 Ų62.87%0.07332%0.318CS..Hα-helixtrans-63.8-45.6179.4170.70000110.7I163 N166 M167 L353 D354 H359 L360 V361I163-V357 HydrophobicContact CG2-CG2 4.34Å; N166-V357 HydrophobicContact CB-CG1 3.69Å; M167-V357 HydrophobicContact CG-CG1 4.18Å; M167-V357 HydrophobicContact SD-CG1 4.11Å; L353-V357 HydrophobicContact CD1-CG2 4.36Å; L353-V357 HydrophobicContact CG-CG2 4.46Å; L353-V357 WeakPolarHBondContact O-CG2 3.22Å; L353-V357 PolarHBondContact O-N 2.78Å; D354-V357 PolarHBondContact O-N 2.86Å; V357-H359 VanDerWaalsContact C-N 3.34Å; V357-H359 PolarHBondContact O-N 3.18Å; V357-L360 WeakPolarHBondContact O-CB 3.34Å; V357-L360 PolarHBondContact O-N 3.06Å; V357-V361 VanDerWaalsContact O-CG2 3.28Å; V357-V361 WeakPolarHBondContact O-CG2 3.16Å; V357-V361 PolarHBondContact O-N 3.1Å
358Y91.3Very high85.8Confident57 Ų5764.5 Ų64.522%0.22433%0.327CS..Hα-helixtrans-57.3-45.8174.4171.2-103.4000112.1D354 H355 V361 T362 P425 S426 A427 P428D354-Y358 WeakPolarHBondContact O-CB 3.34Å; D354-Y358 PolarHBondContact O-N 3Å; H355-Y358 PolarHBondContact O-N 3.35Å; Y358-V361 PolarHBondContact O-N 3.35Å; Y358-T362 HydrophobicContact CD2-CG2 4.2Å; Y358-T362 HydrophobicContact CE1-CG2 4.16Å; Y358-T362 HydrophobicContact CE2-CG2 3.73Å; Y358-T362 WeakPolarHBondContact O-CG2 3.44Å; Y358-T362 PolarHBondContact O-N 3.47Å; Y358-T362 PolarHBondContact O-OG1 3.29Å; Y358-P425 HydrophobicContact CD2-CB 4.24Å; Y358-P425 HydrophobicContact CE2-CB 4.25Å; Y358-P425 HydrophobicContact CE2-CG 4.25Å; Y358-S426 WeakPolarHBondContact CD2-O 3.48Å; Y358-A427 HydrophobicContact CD2-CB 4.46Å; Y358-A427 HydrophobicContact CE2-CB 3.83Å; Y358-P428 HydrophobicContact CG-CG 4.41Å
359H89.9Confident84.4Confident85 Ų8562.6 Ų62.639%0.39432%0.318SS..Hα-helixtrans-67-38.9177.3-86.1-63.4000113.2H355 I356 V357 V361 T362 V363H355-H359 AromaticContact CD2-CD2 3.66Å; H355-H359 AromaticContact CD2-NE2 3.97Å; H355-H359 AromaticContact CE1-CD2 3.37Å; H355-H359 PolarHBondContact CE1-CD2 3.46Å; H355-H359 AromaticContact CE1-NE2 3.03Å; H355-H359 PolarHBondContact CE1-NE2 3.49Å; H355-H359 AromaticContact CG-CD2 3.9Å; H355-H359 AromaticContact ND1-CD2 3.72Å; H355-H359 AromaticContact ND1-NE2 3.8Å; H355-H359 AromaticContact NE2-CD2 3.36Å; H355-H359 PolarHBondContact NE2-CD2 3.45Å; H355-H359 AromaticContact NE2-NE2 3.16Å; H355-H359 PolarHBondContact NE2-NE2 2.92Å; H355-H359 VanDerWaalsContact NE2-NE2 3.16Å; H355-H359 WeakPolarHBondContact O-CB 3.27Å; H355-H359 PolarHBondContact O-CD2 2.81Å; H355-H359 VanDerWaalsContact O-CD2 3.3Å; H355-H359 PolarHBondContact O-N 2.9Å; I356-H359 PolarHBondContact O-N 3.18Å; V357-H359 VanDerWaalsContact C-N 3.34Å; V357-H359 PolarHBondContact O-N 3.18Å; H359-V361 VanDerWaalsContact C-N 3.34Å; H359-V361 PolarHBondContact O-N 3.33Å; H359-T362 VanDerWaalsContact CA-OG1 3.24Å; H359-T362 WeakPolarHBondContact CA-OG1 3.49Å; H359-T362 PolarHBondContact O-N 2.95Å; H359-T362 PolarHBondContact O-OG1 3.14Å; H359-V363 WeakPolarHBondContact O-CB 3.47Å; H359-V363 WeakPolarHBondContact O-CG2 3.42Å; H359-V363 PolarHBondContact O-N 3.15Å
360L86.8Confident82.8Confident102 Ų10262.9 Ų62.953%0.53433%0.325SS..Hα-helixtrans-57.7-49.8174.6-177.865.8000110.1I356 V357 V363 S364I356-L360 VanDerWaalsContact O-CB 3.3Å; I356-L360 WeakPolarHBondContact O-CB 3.33Å; I356-L360 PolarHBondContact O-N 3.42Å; V357-L360 WeakPolarHBondContact O-CB 3.34Å; V357-L360 PolarHBondContact O-N 3.06Å; L360-V363 PolarHBondContact O-N 3.29Å; L360-S364 WeakPolarHBondContact O-CB 3.5Å; L360-S364 PolarHBondContact O-N 2.9Å; L360-S364 PolarHBondContact O-OG 3.11Å
361V85.2Confident81.4Confident7 Ų764.1 Ų64.14%0.04233%0.334CS..Hα-helixtrans-64-44.6-179.6179.80000112N166 V169 V170 V357 Y358 H359 V363 G365 P425N166-V361 HydrophobicContact CB-CG2 4.22Å; N166-V361 WeakPolarHBondContact O-CG2 3.38Å; V169-V361 HydrophobicContact CB-CG1 3.98Å; V169-V361 HydrophobicContact CG1-CG1 3.52Å; V170-V361 HydrophobicContact CG2-CG2 3.48Å; V170-V361 VanDerWaalsContact CG2-CG2 3.48Å; V357-V361 VanDerWaalsContact O-CG2 3.28Å; V357-V361 WeakPolarHBondContact O-CG2 3.16Å; V357-V361 PolarHBondContact O-N 3.1Å; Y358-V361 PolarHBondContact O-N 3.35Å; H359-V361 VanDerWaalsContact C-N 3.34Å; H359-V361 PolarHBondContact O-N 3.33Å; V361-V363 VanDerWaalsContact C-N 3.34Å; V361-V363 PolarHBondContact O-N 2.77Å; V361-G365 PolarHBondContact O-N 2.95Å; V361-P425 HydrophobicContact CB-CB 4.3Å; V361-P425 HydrophobicContact CG1-CB 3.73Å; V361-P425 HydrophobicContact CG1-CG 4.28Å
362T85.5Confident79.8Confident44 Ų4466.5 Ų66.527%0.2735%0.353SS..Hα-helixtrans-65.6-35.6-178.946.90000112.8Y358 H359 P366 P425Y358-T362 HydrophobicContact CD2-CG2 4.2Å; Y358-T362 HydrophobicContact CE1-CG2 4.16Å; Y358-T362 HydrophobicContact CE2-CG2 3.73Å; Y358-T362 WeakPolarHBondContact O-CG2 3.44Å; Y358-T362 PolarHBondContact O-N 3.47Å; Y358-T362 PolarHBondContact O-OG1 3.29Å; H359-T362 VanDerWaalsContact CA-OG1 3.24Å; H359-T362 WeakPolarHBondContact CA-OG1 3.49Å; H359-T362 PolarHBondContact O-N 2.95Å; H359-T362 PolarHBondContact O-OG1 3.14Å; T362-P366 WeakPolarHBondContact O-CD 3.34Å; T362-P425 HydrophobicContact CG2-CB 4.38Å; T362-P425 HydrophobicContact CG2-CG 3.56Å
363V82.6Confident78.5Confident107 Ų10766.1 Ų66.165%0.64836%0.357SS*.Hα-helixtrans-81.5-42.6177.2175.40000111.5H359 L360 V361H359-V363 WeakPolarHBondContact O-CB 3.47Å; H359-V363 WeakPolarHBondContact O-CG2 3.42Å; H359-V363 PolarHBondContact O-N 3.15Å; L360-V363 PolarHBondContact O-N 3.29Å; V361-V363 VanDerWaalsContact C-N 3.34Å; V361-V363 PolarHBondContact O-N 2.77Å
364S72.8Confident77Confident28 Ų2866.3 Ų66.320%0.19636%0.361CS..Hα-helixtrans-73.5-28.9-176.470.10000113L360 W367 L368L360-S364 WeakPolarHBondContact O-CB 3.5Å; L360-S364 PolarHBondContact O-N 2.9Å; L360-S364 PolarHBondContact O-OG 3.11Å; S364-W367 PolarHBondContact O-N 3.3Å; S364-L368 WeakPolarHBondContact O-CB 3.4Å; S364-L368 WeakPolarHBondContact O-CD1 3.48Å; S364-L368 PolarHBondContact O-N 3.35Å
365G71.6Confident75.7Confident8 Ų870.7 Ų70.78%0.08239%0.392CS..Hα-helixtrans-54.4-59.5-177.600000112.6V361 W367 L368 L369V361-G365 PolarHBondContact O-N 2.95Å; G365-W367 PolarHBondContact O-N 3.4Å; G365-L368 PolarHBondContact O-N 2.76Å; G365-L369 VanDerWaalsContact O-CG 3.26Å; G365-L369 WeakPolarHBondContact O-CG 3.16Å; G365-L369 PolarHBondContact O-N 3.29Å
366P69.9Low74.5Confident68 Ų6869.8 Ų69.844%0.44239%0.393SS..Hα-helixtrans-61-41.7176.9-24.134.3000113.1T362 L368 L369 D370T362-P366 WeakPolarHBondContact O-CD 3.34Å; P366-L368 PolarHBondContact O-N 2.92Å; P366-L369 PolarHBondContact O-N 3.04Å; P366-D370 PolarHBondContact O-N 2.05Å
367W65.8Low73.6Confident195 Ų19568.3 Ų68.374%0.73939%0.391SS*.Hα-helixtrans-65.2-37-178.5-175.979.4000113.5S364 G365 L369S364-W367 PolarHBondContact O-N 3.3Å; G365-W367 PolarHBondContact O-N 3.4Å; W367-L369 VanDerWaalsContact C-N 3.34Å
368L64.3Low72.8Confident44 Ų4470.4 Ų70.423%0.2340%0.401CS..Hα-helixtrans-71.9-27.9175.1-10293.1000112.9V173 S364 G365 P366V173-L368 HydrophobicContact CG1-CB 3.86Å; V173-L368 HydrophobicContact CG1-CD2 3.71Å; V173-L368 HydrophobicContact CG1-CG 4.37Å; S364-L368 WeakPolarHBondContact O-CB 3.4Å; S364-L368 WeakPolarHBondContact O-CD1 3.48Å; S364-L368 PolarHBondContact O-N 3.35Å; G365-L368 PolarHBondContact O-N 2.76Å; P366-L368 PolarHBondContact O-N 2.92Å
369L63.8Low72.2Confident28 Ų2870.4 Ų70.415%0.14741%0.412CS..Hα-helixtrans-85.8-23.9-178-64.9172.1000112.5G365 P366 W367 A418 C421 Y422G365-L369 VanDerWaalsContact O-CG 3.26Å; G365-L369 WeakPolarHBondContact O-CG 3.16Å; G365-L369 PolarHBondContact O-N 3.29Å; P366-L369 PolarHBondContact O-N 3.04Å; W367-L369 VanDerWaalsContact C-N 3.34Å; L369-A418 HydrophobicContact CB-CB 4.46Å; L369-A418 HydrophobicContact CD2-CB 4.45Å; L369-A418 WeakPolarHBondContact O-CB 3.36Å; L369-C421 HydrophobicContact CD2-CB 3.71Å; L369-Y422 HydrophobicContact CD1-CD2 4.1Å
370D63.1Low71.5Confident136 Ų13668 Ų6873%0.72740%0.404SS*.  trans-94.524.9179-81.7-21.7000114P366 P372P366-D370 PolarHBondContact O-N 2.05Å; D370-P372 WeakPolarHBondContact O-CD 3.09Å; D370-P372 VanDerWaalsContact O-N 3.09Å
371V63.7Low71.1Confident56 Ų5670.7 Ų70.734%0.33941%0.411SS..  trans-64.1114.2175.1177.10000108.8P416V371-P416 HydrophobicContact CB-CG 4.08Å; V371-P416 HydrophobicContact CG1-CG 4.36Å
372P60.7Low70.6Confident95 Ų9573.4 Ų73.462%0.61742%0.421SS*.  trans-65.5150.1-175.627-33.9000110.3D370 T374D370-P372 WeakPolarHBondContact O-CD 3.09Å; D370-P372 VanDerWaalsContact O-N 3.09Å; P372-T374 PolarHBondContact O-N 3.31Å
373A66Low70Confident66 Ų6677 Ų7755%0.54543%0.433SS..  trans-63.5107176.800000110.1F414A373-F414 CarbonylContact C-O 3.4Å; A373-F414 WeakPolarHBondContact CA-O 3.09Å; A373-F414 VanDerWaalsContact CB-O 3.25Å; A373-F414 WeakPolarHBondContact CB-O 3.02Å
374T64.4Low69.3Low68 Ų6873.1 Ų73.142%0.41741%0.408SS..EExtended strand (participates in β ladder)trans-90.3120.5-179.252.60000109.9P372 F414P372-T374 PolarHBondContact O-N 3.31Å; T374-F414 PolarHBondContact N-O 3.44Å; T374-F414 VanDerWaalsContact O-CB 3.31Å; T374-F414 WeakPolarHBondContact O-CB 3.41Å; T374-F414 PolarHBondContact O-N 3.46Å
375S65.4Low69.2Low99 Ų9976.1 Ų76.169%0.69242%0.419SS*.EExtended strand (participates in β ladder)trans-76.4130.3168.8500000110.2W412S375-W412 CarbonylContact C-O 3.4Å; S375-W412 VanDerWaalsContact CA-O 3.31Å; S375-W412 WeakPolarHBondContact CA-O 3.4Å
376V68.8Low69Low63 Ų6378.3 Ų78.338%0.38243%0.428SS..EExtended strand (participates in β ladder)trans-121.1135.4174.6-175.80000107.7W412V376-W412 HydrophobicContact CB-CD2 4.11Å; V376-W412 HydrophobicContact CB-CE3 4.41Å; V376-W412 HydrophobicContact CB-CH2 3.8Å; V376-W412 HydrophobicContact CB-CZ2 3.46Å; V376-W412 VanDerWaalsContact CB-CZ2 3.46Å; V376-W412 HydrophobicContact CB-CZ3 4.26Å; V376-W412 HydrophobicContact CG1-CH2 3.32Å; V376-W412 HydrophobicContact CG1-CZ2 3.38Å; V376-W412 HydrophobicContact CG1-CZ3 3.99Å; V376-W412 HydrophobicContact CG2-CZ2 4.22Å; V376-W412 PolarHBondContact N-O 3.44Å; V376-W412 PolarHBondContact O-N 3.48Å
377S72.3Confident68.7Low66 Ų6682.1 Ų82.146%0.46243%0.434SS..EExtended strand (participates in β ladder)trans-119.5124.1-178.860.30000110.4Y410 D411S377-Y410 WeakPolarHBondContact CA-O 3.33Å; S377-D411 WeakPolarHBondContact CB-OD1 3.38Å
378I75.4Confident68.9Low57 Ų5777.1 Ų77.129%0.29242%0.418SS..EExtended strand (participates in β ladder)trans-100.8119.2169.2-73.5166.2000108.7F192 V380 Q409 Y410 W412F192-I378 HydrophobicContact CE1-CD1 3.63Å; F192-I378 HydrophobicContact CE2-CD1 4.41Å; F192-I378 HydrophobicContact CZ-CD1 3.44Å; F192-I378 VanDerWaalsContact CZ-CD1 3.44Å; I378-V380 HydrophobicContact CG2-CG2 3.93Å; I378-Q409 WeakPolarHBondContact O-CA 3.29Å; I378-Y410 PolarHBondContact N-O 3.35Å; I378-Y410 PolarHBondContact O-N 3.12Å; I378-W412 HydrophobicContact CB-CZ3 4.05Å; I378-W412 HydrophobicContact CD1-CH2 3.37Å; I378-W412 HydrophobicContact CD1-CZ3 3.38Å; I378-W412 HydrophobicContact CG1-CH2 3.62Å; I378-W412 HydrophobicContact CG1-CZ3 3.45Å; I378-W412 VanDerWaalsContact CG1-CZ3 3.45Å
379A77.3Confident69Low56 Ų5680.3 Ų80.346%0.46344%0.441SS..EExtended strand (participates in β ladder)trans-94.8110.4170.500000110
380V77.2Confident69.2Low35 Ų3581.7 Ų81.721%0.21246%0.462CS..EExtended strand (participates in β ladder)trans-89.4123.7172.6-1770000108.4A195 I378 H407 K408 Y410A195-V380 HydrophobicContact CB-CG2 4.45Å; I378-V380 HydrophobicContact CG2-CG2 3.93Å; V380-H407 WeakPolarHBondContact O-CA 3.4Å; V380-K408 PolarHBondContact N-O 2.8Å; V380-K408 PolarHBondContact O-N 3.29Å; V380-K408 VanDerWaalsContact O-N 3.07Å; V380-Y410 HydrophobicContact CB-CE2 4.23Å; V380-Y410 HydrophobicContact CG2-CD2 4.09Å; V380-Y410 HydrophobicContact CG2-CE2 3.9Å
381K77.9Confident69.3Low159 Ų15979.9 Ų79.969%0.69145%0.452SS*.EExtended strand (participates in β ladder)trans-121.4114.5175.2-74177.5-179.7179.80108.4L406 H407K381-L406 CarbonylContact C-O 3.56Å; K381-L406 WeakPolarHBondContact CA-O 3.39Å; K381-H407 WeakPolarHBondContact CE-CE1 3.23Å; K381-H407 WeakPolarHBondContact CG-ND1 3.46Å
382Y73.3Confident69.4Low64 Ų6479.1 Ų79.125%0.25145%0.449SS..EExtended strand (participates in β ladder)trans-130.3123.1177.8-177.4-110.7000109.9L199 A203 I384 N405 L406L199-Y382 HydrophobicContact CD1-CD1 3.59Å; L199-Y382 HydrophobicContact CD1-CD2 3.72Å; L199-Y382 HydrophobicContact CD1-CE1 4.06Å; L199-Y382 HydrophobicContact CD1-CE2 4.22Å; L199-Y382 HydrophobicContact CD1-CG 3.38Å; A203-Y382 HydrophobicContact CB-CE1 4.36Å; Y382-I384 HydrophobicContact CD1-CD1 4.33Å; Y382-I384 HydrophobicContact CD1-CG1 4.28Å; Y382-I384 HydrophobicContact CE1-CD1 3.27Å; Y382-I384 HydrophobicContact CE1-CG1 3.44Å; Y382-I384 VanDerWaalsContact CE1-CG1 3.44Å; Y382-I384 HydrophobicContact CE2-CG1 4.41Å; Y382-I384 VanDerWaalsContact OH-CD1 3.29Å; Y382-I384 WeakPolarHBondContact OH-CD1 3.45Å; Y382-I384 WeakPolarHBondContact OH-CG1 3.49Å; Y382-N405 CarbonylContact O-C 3.56Å; Y382-N405 WeakPolarHBondContact O-CA 3.22Å; Y382-L406 PolarHBondContact N-O 3.22Å; Y382-L406 PolarHBondContact O-N 2.86Å
383K73.8Confident69.8Low119 Ų11981.4 Ų81.452%0.51746%0.455SS..EExtended strand (participates in β ladder)trans-128.1129.8179.1-68.7-170.3172.9-158.70109.5A404K383-A404 WeakPolarHBondContact CA-O 3.4Å
384I68.9Low69.9Low26 Ų2682.8 Ų82.813%0.13345%0.452CS..EExtended strand (participates in β ladder)trans-112.7124.4171.5-61.6165000108.3V206 Y382 L403 A404V206-I384 HydrophobicContact CB-CD1 4.33Å; V206-I384 HydrophobicContact CG1-CD1 4.13Å; V206-I384 HydrophobicContact CG1-CG2 4.38Å; V206-I384 HydrophobicContact CG2-CD1 3.76Å; Y382-I384 HydrophobicContact CD1-CD1 4.33Å; Y382-I384 HydrophobicContact CD1-CG1 4.28Å; Y382-I384 HydrophobicContact CE1-CD1 3.27Å; Y382-I384 HydrophobicContact CE1-CG1 3.44Å; Y382-I384 VanDerWaalsContact CE1-CG1 3.44Å; Y382-I384 HydrophobicContact CE2-CG1 4.41Å; Y382-I384 VanDerWaalsContact OH-CD1 3.29Å; Y382-I384 WeakPolarHBondContact OH-CD1 3.45Å; Y382-I384 WeakPolarHBondContact OH-CG1 3.49Å; I384-L403 HydrophobicContact CG2-CB 4.36Å; I384-L403 PolarHBondContact O-N 3.06Å; I384-A404 HydrophobicContact CB-CB 4.44Å; I384-A404 HydrophobicContact CD1-CB 4.15Å; I384-A404 PolarHBondContact N-O 2.96Å
385H70.4Confident70Confident91 Ų9185 Ų8542%0.42147%0.467SS..EExtended strand (participates in β ladder)trans-109.7128.1170.6-64.7-81.8000108.9D400 E402H385-D400 HydrophobicContact CB-CB 4.27Å; H385-E402 WeakPolarHBondContact CE1-CG 3.44Å; H385-E402 IonicContact CE1-OE1 3.19Å; H385-E402 PolarHBondContact CE1-OE1 3.43Å; H385-E402 WeakPolarHBondContact ND1-CG 3.31Å
386L65.7Low70.2Confident53 Ų5385 Ų8528%0.27747%0.473SS..EExtended strand (participates in β ladder)trans-94.6119.9171.1-169.867.5000108.6F388 T401 L403L386-F388 HydrophobicContact CD2-CE1 3.93Å; L386-F388 HydrophobicContact CD2-CE2 3.64Å; L386-F388 HydrophobicContact CD2-CZ 3.23Å; L386-F388 HydrophobicContact CG-CE1 4.39Å; L386-F388 HydrophobicContact CG-CE2 4Å; L386-F388 HydrophobicContact CG-CZ 3.92Å; L386-T401 PolarHBondContact N-O 3.42Å; L386-T401 PolarHBondContact O-N 2.84Å; L386-T401 VanDerWaalsContact O-N 3.13Å; L386-L403 HydrophobicContact CB-CD1 3.61Å; L386-L403 HydrophobicContact CB-CD2 4.24Å; L386-L403 HydrophobicContact CB-CG 4.43Å; L386-L403 HydrophobicContact CD2-CD1 3.95Å; L386-L403 HydrophobicContact CD2-CD2 4Å; L386-L403 HydrophobicContact CG-CD1 4.45Å
387R64.3Low69.9Low149 Ų14986.6 Ų86.656%0.56248%0.479SS*.  trans-112.5118.7176.6-176.8176-70.3174.9-1.8108.8P389 D400R387-P389 VanDerWaalsContact O-CD 3.27Å; R387-P389 WeakPolarHBondContact O-CD 3.44Å; R387-D400 IonicContact CZ-OD1 2.64Å; R387-D400 IonicContact CZ-OD2 3.73Å; R387-D400 IonicContact NE-OD1 2.78Å; R387-D400 PolarHBondContact NE-OD1 3.17Å; R387-D400 IonicContact NE-OD2 3.34Å; R387-D400 IonicContact NH2-OD1 2.76Å; R387-D400 PolarHBondContact NH2-OD1 2.97Å; R387-D400 IonicContact NH2-OD2 2.84Å; R387-D400 PolarHBondContact NH2-OD2 3.24Å
388F69.6Low69.6Low90 Ų9085.7 Ų85.740%0.39547%0.472SS..  trans-87.9106.7175.2-65.8-79.5000109.8L386 G390 L391 C392L386-F388 HydrophobicContact CD2-CE1 3.93Å; L386-F388 HydrophobicContact CD2-CE2 3.64Å; L386-F388 HydrophobicContact CD2-CZ 3.23Å; L386-F388 HydrophobicContact CG-CE1 4.39Å; L386-F388 HydrophobicContact CG-CE2 4Å; L386-F388 HydrophobicContact CG-CZ 3.92Å; F388-G390 VanDerWaalsContact C-N 3.25Å; F388-G390 PolarHBondContact O-N 3.45Å; F388-L391 HydrophobicContact CB-CB 4.39Å; F388-L391 HydrophobicContact CB-CD1 4.01Å; F388-L391 HydrophobicContact CG-CD1 4.46Å; F388-L391 PolarHBondContact O-N 3.42Å; F388-L391 VanDerWaalsContact O-N 3.15Å; F388-C392 PolarHBondContact O-N 2.87Å
389P67.5Low69.1Low110 Ų11093.3 Ų93.371%0.71450%0.497SS*.G310 helixtrans-61.1-33.8-171.2-21.833.6000113.1R387 L391 C392R387-P389 VanDerWaalsContact O-CD 3.27Å; R387-P389 WeakPolarHBondContact O-CD 3.44Å; P389-L391 VanDerWaalsContact C-N 3.34Å; P389-L391 PolarHBondContact O-N 2.99Å; P389-C392 PolarHBondContact O-N 3.24Å
390G68.4Low68.6Low58 Ų5893.7 Ų93.760%0.59849%0.491SS*.G310 helixtrans-67.6-27.4179.800000114.7F388 I393F388-G390 VanDerWaalsContact C-N 3.25Å; F388-G390 PolarHBondContact O-N 3.45Å; G390-I393 WeakPolarHBondContact O-CD1 3.21Å
391L65.4Low68.1Low97 Ų9795.4 Ų95.451%0.50850%0.502SS..G310 helixtrans-84.2-16.6175.9-78160.3000112.6F388 P389 I393 I397F388-L391 HydrophobicContact CB-CB 4.39Å; F388-L391 HydrophobicContact CB-CD1 4.01Å; F388-L391 HydrophobicContact CG-CD1 4.46Å; F388-L391 PolarHBondContact O-N 3.42Å; F388-L391 VanDerWaalsContact O-N 3.15Å; P389-L391 VanDerWaalsContact C-N 3.34Å; P389-L391 PolarHBondContact O-N 2.99Å; L391-I393 VanDerWaalsContact C-N 3.27Å; L391-I393 PolarHBondContact O-N 3.41Å; L391-I397 HydrophobicContact CD2-CG2 4Å
392C65.8Low67.6Low41 Ų4193 Ų9328%0.27749%0.493SS..G310 helixtrans-86.89.6-179.5-690000114.5F388 P389 I394 C398F388-C392 PolarHBondContact O-N 2.87Å; P389-C392 PolarHBondContact O-N 3.24Å; C392-I394 VanDerWaalsContact C-N 3.26Å; C392-C398 HydrophobicContact CB-CB 3.83Å; C392-C398 WeakPolarHBondContact CB-SG 3.26Å; C392-C398 WeakPolarHBondContact SG-CB 3.09Å; C392-C398 CovalentContact SG-SG 2.05Å; C392-C398 PolarHBondContact SG-SG 3.49Å
393I68.6Low67.1Low143 Ų14393.2 Ų93.273%0.73350%0.498SS*.G310 helixtrans-70.5-28.7168.6-55.8172.6000110.2G390 L391G390-I393 WeakPolarHBondContact O-CD1 3.21Å; L391-I393 VanDerWaalsContact C-N 3.27Å; L391-I393 PolarHBondContact O-N 3.41Å
394I68.3Low66.8Low95 Ų9587.9 Ų87.949%0.48748%0.476SS..SBendtrans-109.9111.3174-58.6172.7000108.5C392 A396 I397 C398C392-I394 VanDerWaalsContact C-N 3.26Å; I394-A396 HydrophobicContact CG2-CB 4.26Å; I394-A396 PolarHBondContact O-N 3.15Å; I394-A396 VanDerWaalsContact O-N 3.1Å; I394-I397 HydrophobicContact CB-CD1 4.2Å; I394-I397 HydrophobicContact CB-CG1 4.39Å; I394-I397 HydrophobicContact CD1-CD1 4.09Å; I394-I397 HydrophobicContact CG2-CD1 4Å; I394-I397 HydrophobicContact CG2-CG1 4.03Å; I394-I397 PolarHBondContact O-N 3.19Å; I394-C398 PolarHBondContact O-N 3.49Å
395P66.4Low67.1Low115 Ų11590.5 Ų90.575%0.74749%0.49SS*.THydrogen-bonded Turntrans-57.8-30.6-175.1-25.633.1000114.2I397P395-I397 PolarHBondContact O-N 3.43Å
396A68.4Low67.3Low99 Ų9987.1 Ų87.182%0.81848%0.475SS*.THydrogen-bonded Turntrans-68.3-18.1179.900000114.2I394I394-A396 HydrophobicContact CG2-CB 4.26Å; I394-A396 PolarHBondContact O-N 3.15Å; I394-A396 VanDerWaalsContact O-N 3.1Å
397I63Low68Low96 Ų9690.1 Ų90.149%0.49249%0.487SS..THydrogen-bonded Turntrans-113.5-10.8-174.5-50.3174.3000110.9L391 I394 P395 R399L391-I397 HydrophobicContact CD2-CG2 4Å; I394-I397 HydrophobicContact CB-CD1 4.2Å; I394-I397 HydrophobicContact CB-CG1 4.39Å; I394-I397 HydrophobicContact CD1-CD1 4.09Å; I394-I397 HydrophobicContact CG2-CD1 4Å; I394-I397 HydrophobicContact CG2-CG1 4.03Å; I394-I397 PolarHBondContact O-N 3.19Å; P395-I397 PolarHBondContact O-N 3.43Å; I397-R399 PolarHBondContact O-N 3.26Å
398C65.5Low68.8Low47 Ų4787 Ų8732%0.31848%0.478SS..  trans-69.299.3173.3-167.20000109.6C392 I394C392-C398 HydrophobicContact CB-CB 3.83Å; C392-C398 WeakPolarHBondContact CB-SG 3.26Å; C392-C398 WeakPolarHBondContact SG-CB 3.09Å; C392-C398 CovalentContact SG-SG 2.05Å; C392-C398 PolarHBondContact SG-SG 3.49Å; I394-C398 PolarHBondContact O-N 3.49Å
399R65.1Low69.3Low217 Ų21788 Ų8882%0.81948%0.484SS*.  trans-119.9123.3172.2-134.4179.5-163.8-1754.2108.5I397 T401I397-R399 PolarHBondContact O-N 3.26Å; R399-T401 PolarHBondContact O-N 2.92Å
400D68.3Low69.8Low64 Ų6483.4 Ų83.434%0.34245%0.452SS..  trans-71.9115.3170.8-70.6-28.5000108H385 R387H385-D400 HydrophobicContact CB-CB 4.27Å; R387-D400 IonicContact CZ-OD1 2.64Å; R387-D400 IonicContact CZ-OD2 3.73Å; R387-D400 IonicContact NE-OD1 2.78Å; R387-D400 PolarHBondContact NE-OD1 3.17Å; R387-D400 IonicContact NE-OD2 3.34Å; R387-D400 IonicContact NH2-OD1 2.76Å; R387-D400 PolarHBondContact NH2-OD1 2.97Å; R387-D400 IonicContact NH2-OD2 2.84Å; R387-D400 PolarHBondContact NH2-OD2 3.24Å
401T65.3Low70.2Confident70 Ų7085.4 Ų85.443%0.42945%0.45SS..EExtended strand (participates in β ladder)trans-85.8118.4178.4-42.50000108.4L386 R399 L403L386-T401 PolarHBondContact N-O 3.42Å; L386-T401 PolarHBondContact O-N 2.84Å; L386-T401 VanDerWaalsContact O-N 3.13Å; R399-T401 PolarHBondContact O-N 2.92Å; T401-L403 HydrophobicContact CG2-CD1 4.29Å; T401-L403 PolarHBondContact O-N 2.81Å
402E67.4Low70.5Confident110 Ų11083.2 Ų83.251%0.51443%0.434SS..EExtended strand (participates in β ladder)trans-69.3112.3173.5-75.4-171.7172.800109.3H385H385-E402 WeakPolarHBondContact CE1-CG 3.44Å; H385-E402 IonicContact CE1-OE1 3.19Å; H385-E402 PolarHBondContact CE1-OE1 3.43Å; H385-E402 WeakPolarHBondContact ND1-CG 3.31Å
403L63.1Low70.6Confident68 Ų6886.4 Ų86.436%0.35645%0.453SS..EExtended strand (participates in β ladder)trans-92.5-30.3-180-109.168.7000112.8V206 I384 L386 T401V206-L403 HydrophobicContact CG1-CB 4.09Å; V206-L403 HydrophobicContact CG1-CD2 3.6Å; V206-L403 HydrophobicContact CG1-CG 4.39Å; V206-L403 HydrophobicContact CG2-CB 4.21Å; I384-L403 HydrophobicContact CG2-CB 4.36Å; I384-L403 PolarHBondContact O-N 3.06Å; L386-L403 HydrophobicContact CB-CD1 3.61Å; L386-L403 HydrophobicContact CB-CD2 4.24Å; L386-L403 HydrophobicContact CB-CG 4.43Å; L386-L403 HydrophobicContact CD2-CD1 3.95Å; L386-L403 HydrophobicContact CD2-CD2 4Å; L386-L403 HydrophobicContact CG-CD1 4.45Å; T401-L403 HydrophobicContact CG2-CD1 4.29Å; T401-L403 PolarHBondContact O-N 2.81Å
404A67.3Low70.5Confident6 Ų681 Ų815%0.0542%0.424CS..EExtended strand (participates in β ladder)trans-154.2142.5175.800000111.3E202 V206 K383 I384E202-A404 HydrophobicContact CG-CB 3.99Å; V206-A404 HydrophobicContact CG2-CB 3.32Å; K383-A404 WeakPolarHBondContact CA-O 3.4Å; I384-A404 HydrophobicContact CB-CB 4.44Å; I384-A404 HydrophobicContact CD1-CB 4.15Å; I384-A404 PolarHBondContact N-O 2.96Å
405N75.5Confident70.2Confident81 Ų8180 Ų8043%0.43343%0.425SS..EExtended strand (participates in β ladder)trans-141.296.3177.3-177.510.7000109.3Y382Y382-N405 CarbonylContact O-C 3.56Å; Y382-N405 WeakPolarHBondContact O-CA 3.22Å
406L74.4Confident69.9Low21 Ų2175.3 Ų75.311%0.1140%0.395CS..EExtended strand (participates in β ladder)trans-96.5111.9173.2-178.468000109D198 L199 E202 K381 Y382 K408D198-L406 HydrophobicContact CB-CD2 4.32Å; L199-L406 HydrophobicContact CB-CD2 4.45Å; L199-L406 HydrophobicContact CD1-CD2 4.43Å; E202-L406 HydrophobicContact CB-CB 4.49Å; E202-L406 HydrophobicContact CG-CB 4.19Å; K381-L406 CarbonylContact C-O 3.56Å; K381-L406 WeakPolarHBondContact CA-O 3.39Å; Y382-L406 PolarHBondContact N-O 3.22Å; Y382-L406 PolarHBondContact O-N 2.86Å; L406-K408 HydrophobicContact CD1-CB 4.34Å
407H81.5Confident69.3Low115 Ų11578.2 Ų78.253%0.53239%0.392SS..EExtended strand (participates in β ladder)trans-122.4105.1166.5-174.133.3000109.1V380 K381V380-H407 WeakPolarHBondContact O-CA 3.4Å; K381-H407 WeakPolarHBondContact CE-CE1 3.23Å; K381-H407 WeakPolarHBondContact CG-ND1 3.46Å
408K79.6Confident68.9Low85 Ų8575.1 Ų75.137%0.3738%0.38SS..EExtended strand (participates in β ladder)trans-138.5135.2-179.2-167.5163.4170-170.60110.5D198 V380 L406 Y410D198-K408 IonicContact OD2-NZ 2.71Å; D198-K408 PolarHBondContact OD2-NZ 3.01Å; V380-K408 PolarHBondContact N-O 2.8Å; V380-K408 PolarHBondContact O-N 3.29Å; V380-K408 VanDerWaalsContact O-N 3.07Å; L406-K408 HydrophobicContact CD1-CB 4.34Å; K408-Y410 HydrophobicContact CB-CE2 3.99Å; K408-Y410 HydrophobicContact CD-CE1 4.22Å; K408-Y410 HydrophobicContact CD-CE2 4.47Å; K408-Y410 WeakPolarHBondContact CD-OH 3.46Å; K408-Y410 HydrophobicContact CG-CE1 4.35Å; K408-Y410 HydrophobicContact CG-CE2 4Å
409Q80.8Confident68.3Low110 Ų11081.3 Ų81.351%0.51441%0.409SS..EExtended strand (participates in β ladder)trans-102.6132.9177-174.6172.9-27.900109I378 D411I378-Q409 WeakPolarHBondContact O-CA 3.29Å; Q409-D411 WeakPolarHBondContact CG-OD1 3.43Å; Q409-D411 PolarHBondContact NE2-OD1 3.46Å
410Y77.7Confident68Low13 Ų1382.1 Ų82.15%0.05141%0.413CS..EExtended strand (participates in β ladder)trans-116.4110.7179-60.1-91.7000107.8L191 A195 D198 S377 I378 V380 K408L191-Y410 HydrophobicContact CD2-CD1 4.28Å; A195-Y410 WeakPolarHBondContact CA-OH 3.43Å; A195-Y410 HydrophobicContact CB-CD1 4.41Å; A195-Y410 HydrophobicContact CB-CD2 4.07Å; A195-Y410 HydrophobicContact CB-CE1 4.04Å; A195-Y410 HydrophobicContact CB-CE2 3.68Å; A195-Y410 HydrophobicContact CB-CG 4.42Å; D198-Y410 WeakPolarHBondContact CB-OH 3.39Å; D198-Y410 PolarHBondContact OD2-OH 3.19Å; S377-Y410 WeakPolarHBondContact CA-O 3.33Å; I378-Y410 PolarHBondContact N-O 3.35Å; I378-Y410 PolarHBondContact O-N 3.12Å; V380-Y410 HydrophobicContact CB-CE2 4.23Å; V380-Y410 HydrophobicContact CG2-CD2 4.09Å; V380-Y410 HydrophobicContact CG2-CE2 3.9Å; K408-Y410 HydrophobicContact CB-CE2 3.99Å; K408-Y410 HydrophobicContact CD-CE1 4.22Å; K408-Y410 HydrophobicContact CD-CE2 4.47Å; K408-Y410 WeakPolarHBondContact CD-OH 3.46Å; K408-Y410 HydrophobicContact CG-CE1 4.35Å; K408-Y410 HydrophobicContact CG-CE2 4Å
411D76.9Confident68.2Low101 Ų10179.6 Ų79.654%0.5440%0.399SS..EExtended strand (participates in β ladder)trans-99.1137.3-179.7-57.1-44.5000109.9S377 Q409S377-D411 WeakPolarHBondContact CB-OD1 3.38Å; Q409-D411 WeakPolarHBondContact CG-OD1 3.43Å; Q409-D411 PolarHBondContact NE2-OD1 3.46Å
412W71.7Confident68.5Low50 Ų5083.3 Ų83.319%0.18941%0.407CS..EExtended strand (participates in β ladder)trans-139.2152.3168.876.992.3000111.8L191 S375 V376 I378L191-W412 HydrophobicContact CD1-CB 3.46Å; L191-W412 VanDerWaalsContact CD1-CB 3.46Å; L191-W412 HydrophobicContact CD1-CG 4.3Å; S375-W412 CarbonylContact C-O 3.4Å; S375-W412 VanDerWaalsContact CA-O 3.31Å; S375-W412 WeakPolarHBondContact CA-O 3.4Å; V376-W412 HydrophobicContact CB-CD2 4.11Å; V376-W412 HydrophobicContact CB-CE3 4.41Å; V376-W412 HydrophobicContact CB-CH2 3.8Å; V376-W412 HydrophobicContact CB-CZ2 3.46Å; V376-W412 VanDerWaalsContact CB-CZ2 3.46Å; V376-W412 HydrophobicContact CB-CZ3 4.26Å; V376-W412 HydrophobicContact CG1-CH2 3.32Å; V376-W412 HydrophobicContact CG1-CZ2 3.38Å; V376-W412 HydrophobicContact CG1-CZ3 3.99Å; V376-W412 HydrophobicContact CG2-CZ2 4.22Å; V376-W412 PolarHBondContact N-O 3.44Å; V376-W412 PolarHBondContact O-N 3.48Å; I378-W412 HydrophobicContact CB-CZ3 4.05Å; I378-W412 HydrophobicContact CD1-CH2 3.37Å; I378-W412 HydrophobicContact CD1-CZ3 3.38Å; I378-W412 HydrophobicContact CG1-CH2 3.62Å; I378-W412 HydrophobicContact CG1-CZ3 3.45Å; I378-W412 VanDerWaalsContact CG1-CZ3 3.45Å
413T67.6Low68.9Low108 Ų10881.3 Ų81.366%0.66340%0.399SS*.EExtended strand (participates in β ladder)trans-103.2121175.451.40000109.4
414F66Low69.8Low30 Ų3085.4 Ų85.413%0.13242%0.416CS..EExtended strand (participates in β ladder)trans-79.6122.3166.6-178.9-96.9000108.5F181 S184 A373 T374 P416F181-F414 HydrophobicContact CB-CE2 4.15Å; F181-F414 HydrophobicContact CB-CZ 4.11Å; F181-F414 HydrophobicContact CD2-CD2 4.42Å; F181-F414 AromaticContact CD2-CE2 3.35Å; F181-F414 HydrophobicContact CD2-CE2 3.35Å; F181-F414 AromaticContact CD2-CZ 3.58Å; F181-F414 HydrophobicContact CD2-CZ 3.58Å; F181-F414 HydrophobicContact CE2-CE2 4.03Å; F181-F414 HydrophobicContact CE2-CZ 4.48Å; F181-F414 HydrophobicContact CG-CE2 4.05Å; F181-F414 HydrophobicContact CG-CZ 4.29Å; S184-F414 VanDerWaalsContact CB-CD2 3.44Å; A373-F414 CarbonylContact C-O 3.4Å; A373-F414 WeakPolarHBondContact CA-O 3.09Å; A373-F414 VanDerWaalsContact CB-O 3.25Å; A373-F414 WeakPolarHBondContact CB-O 3.02Å; T374-F414 PolarHBondContact N-O 3.44Å; T374-F414 VanDerWaalsContact O-CB 3.31Å; T374-F414 WeakPolarHBondContact O-CB 3.41Å; T374-F414 PolarHBondContact O-N 3.46Å; F414-P416 HydrophobicContact CD1-CG 4.49Å; F414-P416 HydrophobicContact CE1-CB 4.19Å; F414-P416 HydrophobicContact CE1-CG 3.89Å
415S62.9Low70.6Confident73 Ų7386.2 Ų86.251%0.5142%0.421SS..  trans-132.4106.9172.7-172.10000109.2S184 E417S184-S415 PolarHBondContact OG-O 3.34Å; S415-E417 PolarHBondContact O-N 3.47Å
416P60Low71.3Confident17 Ų1784.6 Ų84.611%0.1142%0.416CS..  trans-68.7125.8171.624.4-23.5000108.8V371 F414 A418V371-P416 HydrophobicContact CB-CG 4.08Å; V371-P416 HydrophobicContact CG1-CG 4.36Å; F414-P416 HydrophobicContact CD1-CG 4.49Å; F414-P416 HydrophobicContact CE1-CB 4.19Å; F414-P416 HydrophobicContact CE1-CG 3.89Å; P416-A418 VanDerWaalsContact C-N 3.27Å; P416-A418 PolarHBondContact O-N 3.29Å
417E56.5Low72Confident160 Ų16086.3 Ų86.375%0.74843%0.433SS*.  trans-76.778.8-180-143167.6-160.400109.3S415S415-E417 PolarHBondContact O-N 3.47Å
418A54.4Low72.5Confident31 Ų3181.7 Ų81.726%0.25641%0.413SS..G310 helixtrans-78.8-22.6-160.500000116.1L369 P416 R420 C421L369-A418 HydrophobicContact CB-CB 4.46Å; L369-A418 HydrophobicContact CD2-CB 4.45Å; L369-A418 WeakPolarHBondContact O-CB 3.36Å; P416-A418 VanDerWaalsContact C-N 3.27Å; P416-A418 PolarHBondContact O-N 3.29Å; A418-R420 VanDerWaalsContact C-N 3.26Å; A418-R420 PolarHBondContact O-N 2.76Å; A418-C421 PolarHBondContact O-N 3.49Å
419L52.3Low73Confident177 Ų17780.6 Ų80.693%0.92741%0.411SS*.G310 helixtrans-71.5-9.2-161.3-136.990.1000115.8
420R59.6Low73.5Confident235 Ų23580.6 Ų80.689%0.88741%0.414SS*.G310 helixtrans-105.96-176.1-69.2-171.9-177.9-170.12.5115A418A418-R420 VanDerWaalsContact C-N 3.26Å; A418-R420 PolarHBondContact O-N 2.76Å
421C71.9Confident74.2Confident10 Ų1089 Ų897%0.06845%0.446CS..  trans-1122.2-162.5-68.50000115.3C176 L369 A418C176-C421 HydrophobicContact CB-CB 3.32Å; C176-C421 WeakPolarHBondContact CB-SG 3.27Å; C176-C421 VanDerWaalsContact SG-CA 3.53Å; C176-C421 WeakPolarHBondContact SG-CB 3.42Å; C176-C421 CovalentContact SG-SG 2.01Å; C176-C421 PolarHBondContact SG-SG 3.41Å; L369-C421 HydrophobicContact CD2-CB 3.71Å; A418-C421 PolarHBondContact O-N 3.49Å
422Y71.6Confident74.8Confident149 Ų14985.3 Ų85.358%0.58443%0.427SS*.  trans-77.7123177.8-177.9-101.2000111.4L369L369-Y422 HydrophobicContact CD1-CD2 4.1Å
423I75.8Confident75.8Confident68 Ų6887.2 Ų87.235%0.34943%0.434SS..  trans-121.3135.6168.2-60.5-176.2000107.9V169 H172V169-I423 HydrophobicContact CG1-CB 4.13Å; V169-I423 HydrophobicContact CG2-CB 4.26Å; V169-I423 HydrophobicContact CG2-CG2 3.78Å; H172-I423 HydrophobicContact CB-CD1 3.67Å; H172-I423 VanDerWaalsContact ND1-CD1 3.29Å; H172-I423 WeakPolarHBondContact ND1-CD1 3.3Å
424E80.8Confident77.1Confident154 Ų15486.7 Ų86.772%0.7243%0.431SS*.PPolyproline II helixtrans-70.9126.4179.7-167.9170.3-174.900111.3
425P85.9Confident78.4Confident23 Ų2389.7 Ų89.715%0.14944%0.444CS..PPolyproline II helixtrans-73.4151.2177.127.4-31.5000112.5Y358 V361 T362Y358-P425 HydrophobicContact CD2-CB 4.24Å; Y358-P425 HydrophobicContact CE2-CB 4.25Å; Y358-P425 HydrophobicContact CE2-CG 4.25Å; V361-P425 HydrophobicContact CB-CB 4.3Å; V361-P425 HydrophobicContact CG1-CB 3.73Å; V361-P425 HydrophobicContact CG1-CG 4.28Å; T362-P425 HydrophobicContact CG2-CB 4.38Å; T362-P425 HydrophobicContact CG2-CG 3.56Å
426S88.4Confident79.9Confident46 Ų4686.3 Ų86.332%0.32242%0.42SS..PPolyproline II helixtrans-88.7116.2178.1-175.60000111.4N162 N166 Y358N162-S426 PolarHBondContact ND2-O 2.85Å; N162-S426 VanDerWaalsContact OD1-CB 3.23Å; N162-S426 WeakPolarHBondContact OD1-CB 3.21Å; N162-S426 PolarHBondContact OD1-O 3.45Å; N162-S426 PolarHBondContact OD1-OG 3.5Å; N166-S426 PolarHBondContact ND2-O 2.87Å; N166-S426 PolarHBondContact OD1-N 3.1Å; N166-S426 PolarHBondContact OD1-O 3.39Å; Y358-S426 WeakPolarHBondContact CD2-O 3.48Å
427A90.1Very high81.5Confident57 Ų5787.2 Ų87.247%0.47143%0.433SS..PPolyproline II helixtrans-73.2142.5-179.500000112.6Y358 D429Y358-A427 HydrophobicContact CD2-CB 4.46Å; Y358-A427 HydrophobicContact CE2-CB 3.83Å; A427-D429 PolarHBondContact O-N 2.88Å
428P91.1Very high83.3Confident19 Ų1984.2 Ų84.212%0.12342%0.421CS..PPolyproline II helixtrans-59.9124.5176.7-25.334.1000113.5D354 Y358 L430D354-P428 WeakPolarHBondContact OD2-CB 3.27Å; Y358-P428 HydrophobicContact CG-CG 4.41Å; P428-L430 PolarHBondContact O-N 3.34Å
429D90.2Very high85.3Confident61 Ų6183.9 Ų83.933%0.32642%0.415SS..PPolyproline II helixtrans-70.2120.2-177.5-172.5-16.5000112.4A427 R431 V432 R433A427-D429 PolarHBondContact O-N 2.88Å; D429-R431 VanDerWaalsContact C-N 3.34Å; D429-R431 PolarHBondContact O-N 3.47Å; D429-R431 WeakPolarHBondContact OD1-CB 3.41Å; D429-R431 IonicContact OD1-CZ 3.78Å; D429-R431 PolarHBondContact OD1-N 3.4Å; D429-R431 IonicContact OD1-NE 3.46Å; D429-R431 IonicContact OD1-NH2 2.76Å; D429-R431 IonicContact OD2-CZ 3.29Å; D429-R431 IonicContact OD2-NE 3.43Å; D429-R431 IonicContact OD2-NH2 3.62Å; D429-R431 PolarHBondContact OD2-NH2 3.35Å; D429-V432 HydrophobicContact CB-CB 4.34Å; D429-V432 HydrophobicContact CB-CG2 3.96Å; D429-V432 PolarHBondContact O-N 3.41Å; D429-R433 PolarHBondContact O-N 2.92Å
430L91.4Very high87.2Confident110 Ų11076 Ų7658%0.57638%0.375SS*.Hα-helixtrans-59.7-39.4176.5-178.563.4000113.1P428 V432 R433 V434P428-L430 PolarHBondContact O-N 3.34Å; L430-V432 VanDerWaalsContact C-N 3.32Å; L430-V432 PolarHBondContact O-N 2.77Å; L430-R433 PolarHBondContact O-N 2.64Å; L430-V434 HydrophobicContact CD1-CG2 4.21Å; L430-V434 HydrophobicContact CG-CG2 4.32Å; L430-V434 WeakPolarHBondContact O-CG2 3.5Å; L430-V434 PolarHBondContact O-N 3.29Å
431R92.1Very high88.8Confident189 Ų18969.5 Ų69.571%0.71336%0.357SS*.Hα-helixtrans-63-41.4-177.9-65.1-177.3-60.4-106.4-11.6111.3D429 R433 V434 F435D429-R431 VanDerWaalsContact C-N 3.34Å; D429-R431 PolarHBondContact O-N 3.47Å; D429-R431 WeakPolarHBondContact OD1-CB 3.41Å; D429-R431 IonicContact OD1-CZ 3.78Å; D429-R431 PolarHBondContact OD1-N 3.4Å; D429-R431 IonicContact OD1-NE 3.46Å; D429-R431 IonicContact OD1-NH2 2.76Å; D429-R431 IonicContact OD2-CZ 3.29Å; D429-R431 IonicContact OD2-NE 3.43Å; D429-R431 IonicContact OD2-NH2 3.62Å; D429-R431 PolarHBondContact OD2-NH2 3.35Å; R431-R433 VanDerWaalsContact C-N 3.33Å; R431-R433 PolarHBondContact O-N 2.82Å; R431-V434 PolarHBondContact O-N 2.93Å; R431-F435 VanDerWaalsContact O-CB 3.27Å; R431-F435 WeakPolarHBondContact O-CB 3.41Å; R431-F435 PolarHBondContact O-N 2.87Å
432V91.2Very high89.9Confident25 Ų2571.7 Ų71.715%0.15237%0.37CS..Hα-helixtrans-62.6-42.7177.7176.90000110.3V154 I159 D429 L430 F435 L436V154-V432 HydrophobicContact CG1-CG1 3.77Å; I159-V432 HydrophobicContact CD1-CG1 4.37Å; I159-V432 HydrophobicContact CG1-CG1 4.23Å; D429-V432 HydrophobicContact CB-CB 4.34Å; D429-V432 HydrophobicContact CB-CG2 3.96Å; D429-V432 PolarHBondContact O-N 3.41Å; L430-V432 VanDerWaalsContact C-N 3.32Å; L430-V432 PolarHBondContact O-N 2.77Å; V432-F435 PolarHBondContact O-N 3.49Å; V432-L436 WeakPolarHBondContact O-CB 3.47Å; V432-L436 PolarHBondContact O-N 2.93Å
433R92.4Very high91Very high89 Ų8964.8 Ų64.834%0.33634%0.343SS..Hα-helixtrans-64-46.3177.7-62.7-169-67.4-144.7-6.3112.6M351 D429 L430 R431 F435 L436 G437M351-R433 HydrophobicContact CE-CB 3.83Å; M351-R433 HydrophobicContact CE-CG 3.58Å; D429-R433 PolarHBondContact O-N 2.92Å; L430-R433 PolarHBondContact O-N 2.64Å; R431-R433 VanDerWaalsContact C-N 3.33Å; R431-R433 PolarHBondContact O-N 2.82Å; R433-F435 VanDerWaalsContact C-N 3.34Å; R433-L436 PolarHBondContact O-N 3.27Å; R433-G437 PolarHBondContact O-N 2.98Å
434V94.3Very high91.8Very high97 Ų9764.9 Ų64.959%0.58834%0.34SS*.Hα-helixtrans-62.4-44.5177.4172.60000110.4L430 R431 L436 G437 L438L430-V434 HydrophobicContact CD1-CG2 4.21Å; L430-V434 HydrophobicContact CG-CG2 4.32Å; L430-V434 WeakPolarHBondContact O-CG2 3.5Å; L430-V434 PolarHBondContact O-N 3.29Å; R431-V434 PolarHBondContact O-N 2.93Å; V434-L436 PolarHBondContact O-N 3.38Å; V434-G437 PolarHBondContact O-N 3.31Å; V434-L438 PolarHBondContact O-N 3.5Å
435F93.4Very high92.3Very high94 Ų9461.2 Ų61.241%0.41233%0.325SS..Hα-helixtrans-60.4-45.5177.2-178.5-106.8000112.1V154 R431 V432 R433 L438 L439V154-F435 HydrophobicContact CG1-CD1 4.4Å; V154-F435 HydrophobicContact CG2-CD1 4.43Å; V154-F435 HydrophobicContact CG2-CE1 4.02Å; R431-F435 VanDerWaalsContact O-CB 3.27Å; R431-F435 WeakPolarHBondContact O-CB 3.41Å; R431-F435 PolarHBondContact O-N 2.87Å; V432-F435 PolarHBondContact O-N 3.49Å; R433-F435 VanDerWaalsContact C-N 3.34Å; F435-L438 WeakPolarHBondContact O-CB 3.3Å; F435-L438 PolarHBondContact O-N 2.93Å; F435-L439 HydrophobicContact CD1-CD1 3.98Å; F435-L439 HydrophobicContact CD1-CG 4.43Å; F435-L439 HydrophobicContact CE1-CD1 3.45Å; F435-L439 VanDerWaalsContact CE1-CD1 3.45Å; F435-L439 HydrophobicContact CE1-CG 4.05Å; F435-L439 HydrophobicContact CZ-CD1 3.89Å; F435-L439 HydrophobicContact CZ-CD2 4.18Å; F435-L439 HydrophobicContact CZ-CG 4.12Å; F435-L439 WeakPolarHBondContact O-CG 3.4Å; F435-L439 PolarHBondContact O-N 2.93Å
436L94.3Very high92.6Very high1 Ų161.4 Ų61.41%0.00532%0.324CS..Hα-helixtrans-66.6-39178.7-161.459.4000111.9L155 I159 I347 M351 V432 R433 V434 L438 L439 C440L155-L436 HydrophobicContact CD1-CD2 4.37Å; I159-L436 HydrophobicContact CD1-CD2 3.9Å; I347-L436 HydrophobicContact CD1-CD1 4.37Å; I347-L436 HydrophobicContact CG2-CD2 3.27Å; I347-L436 HydrophobicContact CG2-CG 3.77Å; M351-L436 HydrophobicContact SD-CD2 3.92Å; V432-L436 WeakPolarHBondContact O-CB 3.47Å; V432-L436 PolarHBondContact O-N 2.93Å; R433-L436 PolarHBondContact O-N 3.27Å; V434-L436 PolarHBondContact O-N 3.38Å; L436-L438 VanDerWaalsContact C-N 3.35Å; L436-L438 PolarHBondContact O-N 3.11Å; L436-L439 HydrophobicContact CD1-CD1 4.49Å; L436-L439 PolarHBondContact O-N 3.33Å; L436-C440 PolarHBondContact O-N 2.78Å; L436-C440 PolarHBondContact O-SG 3.49Å
437G93.6Very high92.8Very high37 Ų3759.2 Ų59.238%0.38131%0.309SS..Hα-helixtrans-60.6-41.9171.800000112.7R433 V434 C440 L441R433-G437 PolarHBondContact O-N 2.98Å; V434-G437 PolarHBondContact O-N 3.31Å; G437-C440 WeakPolarHBondContact O-CB 3.5Å; G437-C440 PolarHBondContact O-N 3.13Å; G437-L441 PolarHBondContact O-N 2.88Å
438L95.4Very high92.7Very high96 Ų9660.5 Ų60.550%0.50331%0.307SS..Hα-helixtrans-63.8-45.6174.9-17964.7000111.8V434 F435 L436 C440 L441 V442V434-L438 PolarHBondContact O-N 3.5Å; F435-L438 WeakPolarHBondContact O-CB 3.3Å; F435-L438 PolarHBondContact O-N 2.93Å; L436-L438 VanDerWaalsContact C-N 3.35Å; L436-L438 PolarHBondContact O-N 3.11Å; L438-C440 VanDerWaalsContact C-N 3.25Å; L438-C440 PolarHBondContact O-N 3.46Å; L438-L441 PolarHBondContact O-N 3.47Å; L438-V442 HydrophobicContact CD1-CG2 4.34Å; L438-V442 HydrophobicContact CG-CG2 4.46Å; L438-V442 VanDerWaalsContact O-CG2 3.31Å; L438-V442 WeakPolarHBondContact O-CG2 3.27Å; L438-V442 PolarHBondContact O-N 3.32Å
439L94.7Very high92.6Very high24 Ų2463.5 Ų63.513%0.12632%0.322CS..Hα-helixtrans-58.5-39.7175.5-71.8-179.7000111.7I147 T150 F435 L436 V442 S443I147-L439 HydrophobicContact CG2-CB 4.09Å; I147-L439 HydrophobicContact CG2-CD2 4.27Å; I147-L439 VanDerWaalsContact CG2-O 3.31Å; I147-L439 WeakPolarHBondContact CG2-O 3.29Å; T150-L439 HydrophobicContact CG2-CD1 4.23Å; F435-L439 HydrophobicContact CD1-CD1 3.98Å; F435-L439 HydrophobicContact CD1-CG 4.43Å; F435-L439 HydrophobicContact CE1-CD1 3.45Å; F435-L439 VanDerWaalsContact CE1-CD1 3.45Å; F435-L439 HydrophobicContact CE1-CG 4.05Å; F435-L439 HydrophobicContact CZ-CD1 3.89Å; F435-L439 HydrophobicContact CZ-CD2 4.18Å; F435-L439 HydrophobicContact CZ-CG 4.12Å; F435-L439 WeakPolarHBondContact O-CG 3.4Å; F435-L439 PolarHBondContact O-N 2.93Å; L436-L439 HydrophobicContact CD1-CD1 4.49Å; L436-L439 PolarHBondContact O-N 3.33Å; L439-V442 PolarHBondContact O-N 3.11Å; L439-S443 WeakPolarHBondContact O-CB 3.44Å; L439-S443 PolarHBondContact O-N 3.33Å
440C92.8Very high92.7Very high11 Ų1161.2 Ų61.27%0.07431%0.309CS..Hα-helixtrans-64.2-47.3176-66.10000111.5F344 L436 G437 L438 V442 S443 Y444F344-C440 HydrophobicContact CD2-CB 3.82Å; F344-C440 WeakPolarHBondContact CD2-SG 3.34Å; F344-C440 HydrophobicContact CE2-CB 3.85Å; L436-C440 PolarHBondContact O-N 2.78Å; L436-C440 PolarHBondContact O-SG 3.49Å; G437-C440 WeakPolarHBondContact O-CB 3.5Å; G437-C440 PolarHBondContact O-N 3.13Å; L438-C440 VanDerWaalsContact C-N 3.25Å; L438-C440 PolarHBondContact O-N 3.46Å; C440-V442 PolarHBondContact O-N 3.36Å; C440-S443 WeakPolarHBondContact O-CB 3.44Å; C440-S443 PolarHBondContact O-N 2.94Å; C440-S443 VanDerWaalsContact O-N 3.15Å; C440-Y444 WeakPolarHBondContact O-CD2 3.47Å; C440-Y444 PolarHBondContact O-N 3.06Å; C440-Y444 VanDerWaalsContact O-N 3.07Å
441L94.2Very high92.6Very high100 Ų10056 Ų5652%0.52428%0.282SS..Hα-helixtrans-57.5-47.8175.8178.463.6000111.5G437 L438 S443 Y444 I445G437-L441 PolarHBondContact O-N 2.88Å; L438-L441 PolarHBondContact O-N 3.47Å; L441-S443 VanDerWaalsContact C-N 3.3Å; L441-S443 PolarHBondContact O-N 3.14Å; L441-Y444 PolarHBondContact O-N 3.47Å; L441-I445 HydrophobicContact CD1-CD1 4.19Å; L441-I445 HydrophobicContact CG-CD1 3.96Å; L441-I445 WeakPolarHBondContact O-CG1 3.46Å; L441-I445 PolarHBondContact O-N 3.31Å
442V94.2Very high92.5Very high55 Ų5550.6 Ų50.633%0.33326%0.262SS..Hα-helixtrans-61-41.1177.2176.20000110.6I147 L438 L439 C440 Y444 I445 M446I147-V442 HydrophobicContact CD1-CG1 3.77Å; L438-V442 HydrophobicContact CD1-CG2 4.34Å; L438-V442 HydrophobicContact CG-CG2 4.46Å; L438-V442 VanDerWaalsContact O-CG2 3.31Å; L438-V442 WeakPolarHBondContact O-CG2 3.27Å; L438-V442 PolarHBondContact O-N 3.32Å; L439-V442 PolarHBondContact O-N 3.11Å; C440-V442 PolarHBondContact O-N 3.36Å; V442-Y444 PolarHBondContact O-N 3.36Å; V442-I445 PolarHBondContact O-N 3.28Å; V442-M446 HydrophobicContact CG1-CG 4.1Å; V442-M446 WeakPolarHBondContact O-CB 3.31Å; V442-M446 WeakPolarHBondContact O-CG 3.36Å; V442-M446 PolarHBondContact O-N 3.03Å
443S94.1Very high92.5Very high4 Ų449.7 Ų49.73%0.02826%0.257CS..Hα-helixtrans-58.6-43.3176.7-170.40000112.5L439 C440 L441 M446 V447L439-S443 WeakPolarHBondContact O-CB 3.44Å; L439-S443 PolarHBondContact O-N 3.33Å; C440-S443 WeakPolarHBondContact O-CB 3.44Å; C440-S443 PolarHBondContact O-N 2.94Å; C440-S443 VanDerWaalsContact O-N 3.15Å; L441-S443 VanDerWaalsContact C-N 3.3Å; L441-S443 PolarHBondContact O-N 3.14Å; S443-M446 WeakPolarHBondContact O-CB 3.38Å; S443-M446 PolarHBondContact O-N 2.71Å; S443-V447 WeakPolarHBondContact O-CG2 3.31Å; S443-V447 PolarHBondContact O-N 2.86Å
444Y92.6Very high92.4Very high70 Ų7048 Ų4828%0.27525%0.251SS..Hα-helixtrans-65.8-45.4175.1-79.6-72.4000112.4I337 V340 T341 C440 L441 V442 M446 V447I337-Y444 HydrophobicContact CG2-CE1 4.47Å; V340-Y444 HydrophobicContact CB-CE1 4.47Å; V340-Y444 HydrophobicContact CG1-CD1 4.2Å; V340-Y444 HydrophobicContact CG1-CD2 4.24Å; V340-Y444 HydrophobicContact CG1-CE1 3.96Å; V340-Y444 HydrophobicContact CG1-CE2 3.99Å; V340-Y444 HydrophobicContact CG1-CG 4.33Å; T341-Y444 VanDerWaalsContact CA-OH 3.3Å; T341-Y444 WeakPolarHBondContact CA-OH 3.24Å; T341-Y444 WeakPolarHBondContact CB-OH 3.2Å; T341-Y444 PolarHBondContact OG1-OH 3.01Å; C440-Y444 WeakPolarHBondContact O-CD2 3.47Å; C440-Y444 PolarHBondContact O-N 3.06Å; C440-Y444 VanDerWaalsContact O-N 3.07Å; L441-Y444 PolarHBondContact O-N 3.47Å; V442-Y444 PolarHBondContact O-N 3.36Å; Y444-M446 PolarHBondContact O-N 3.07Å; Y444-V447 WeakPolarHBondContact O-CB 3.43Å; Y444-V447 PolarHBondContact O-N 3.43Å; Y444-V447 VanDerWaalsContact O-N 3.11Å
445I92.4Very high92.3Very high78 Ų7843.8 Ų43.840%0.422%0.224SC..Hα-helixtrans-58.3-41.6176.2-68.1169.4000110.2L441 V442 V447 L448 L449L441-I445 HydrophobicContact CD1-CD1 4.19Å; L441-I445 HydrophobicContact CG-CD1 3.96Å; L441-I445 WeakPolarHBondContact O-CG1 3.46Å; L441-I445 PolarHBondContact O-N 3.31Å; V442-I445 PolarHBondContact O-N 3.28Å; I445-V447 PolarHBondContact O-N 3.29Å; I445-L448 WeakPolarHBondContact O-CB 3Å; I445-L448 PolarHBondContact O-N 2.91Å; I445-L449 HydrophobicContact CG2-CD1 3.68Å; I445-L449 HydrophobicContact CG2-CG 3.96Å; I445-L449 WeakPolarHBondContact O-CG 2.97Å; I445-L449 PolarHBondContact O-N 3.42Å
446M92.2Very high92.2Very high26 Ų2643.3 Ų43.313%0.12823%0.225CC..Hα-helixtrans-61.4-28.6178.9-74.1-73.9-76.600113.3L138 G139 I147 V442 S443 Y444 L448 L449 E450L138-M446 WeakPolarHBondContact O-CE 3.48Å; G139-M446 VanDerWaalsContact CA-CE 3.48Å; I147-M446 HydrophobicContact CD1-CG 3.99Å; V442-M446 HydrophobicContact CG1-CG 4.1Å; V442-M446 WeakPolarHBondContact O-CB 3.31Å; V442-M446 WeakPolarHBondContact O-CG 3.36Å; V442-M446 PolarHBondContact O-N 3.03Å; S443-M446 WeakPolarHBondContact O-CB 3.38Å; S443-M446 PolarHBondContact O-N 2.71Å; Y444-M446 PolarHBondContact O-N 3.07Å; M446-L448 VanDerWaalsContact C-N 3.32Å; M446-L448 PolarHBondContact O-N 3.43Å; M446-L449 PolarHBondContact O-N 3.28Å; M446-L449 HydrophobicContact SD-CD1 4.42Å; M446-E450 VanDerWaalsContact O-CB 3.29Å; M446-E450 WeakPolarHBondContact O-CB 3.09Å; M446-E450 PolarHBondContact O-N 3.24Å
447V92Very high92.2Very high1 Ų144.5 Ų44.51%0.00623%0.23CC..Hα-helixtrans-66.3-36.7175.1178.90000111.5C333 P336 I337 V340 S443 Y444 I445C333-V447 HydrophobicContact CB-CG1 3.9Å; P336-V447 HydrophobicContact CB-CG1 3.95Å; P336-V447 HydrophobicContact CB-CG2 4.21Å; I337-V447 HydrophobicContact CD1-CG1 4.44Å; I337-V447 HydrophobicContact CG1-CG1 3.76Å; V340-V447 HydrophobicContact CG2-CG2 4.27Å; S443-V447 WeakPolarHBondContact O-CG2 3.31Å; S443-V447 PolarHBondContact O-N 2.86Å; Y444-V447 WeakPolarHBondContact O-CB 3.43Å; Y444-V447 PolarHBondContact O-N 3.43Å; Y444-V447 VanDerWaalsContact O-N 3.11Å; I445-V447 PolarHBondContact O-N 3.29Å
448L87.4Confident92.1Very high84 Ų8443.3 Ų43.344%0.4421%0.213SC..Hα-helixtrans-75.1-43.9174.7-59.7178000110.9I445 M446 E450 V451I445-L448 WeakPolarHBondContact O-CB 3Å; I445-L448 PolarHBondContact O-N 2.91Å; M446-L448 VanDerWaalsContact C-N 3.32Å; M446-L448 PolarHBondContact O-N 3.43Å; L448-E450 PolarHBondContact O-N 2.76Å; L448-V451 PolarHBondContact O-N 3.02Å
449L89.5Confident92Very high82 Ų8242.9 Ų42.943%0.42921%0.208SC..Hα-helixtrans-63.7-25.8177.7-65.6-178.7000112.7I445 M446 V451 Y452 A453I445-L449 HydrophobicContact CG2-CD1 3.68Å; I445-L449 HydrophobicContact CG2-CG 3.96Å; I445-L449 WeakPolarHBondContact O-CG 2.97Å; I445-L449 PolarHBondContact O-N 3.42Å; M446-L449 PolarHBondContact O-N 3.28Å; M446-L449 HydrophobicContact SD-CD1 4.42Å; L449-V451 PolarHBondContact O-N 3.09Å; L449-V451 VanDerWaalsContact O-N 3.15Å; L449-Y452 HydrophobicContact CD2-CD2 4.45Å; L449-Y452 PolarHBondContact O-N 2.99Å; L449-A453 WeakPolarHBondContact O-CB 3.25Å; L449-A453 PolarHBondContact O-N 3.2Å
450E91.9Very high92Very high12 Ų1242.1 Ų42.16%0.05620%0.204CC..Hα-helixtrans-57.5-30.1178.5176167.7-166.600113.2G139 K141 R144 M446 L448 R454G139-E450 WeakPolarHBondContact O-CA 3.31Å; K141-E450 PolarHBondContact N-OE1 3.48Å; R144-E450 IonicContact CZ-OE2 2.98Å; R144-E450 IonicContact NH1-OE2 3.4Å; R144-E450 PolarHBondContact NH1-OE2 2.83Å; R144-E450 IonicContact NH2-OE2 2.67Å; R144-E450 PolarHBondContact NH2-OE2 2.97Å; M446-E450 VanDerWaalsContact O-CB 3.29Å; M446-E450 WeakPolarHBondContact O-CB 3.09Å; M446-E450 PolarHBondContact O-N 3.24Å; L448-E450 PolarHBondContact O-N 2.76Å; E450-R454 WeakPolarHBondContact O-CB 3.47Å; E450-R454 VanDerWaalsContact O-CG 3.3Å; E450-R454 WeakPolarHBondContact O-CG 3.48Å; E450-R454 PolarHBondContact O-N 3.48Å; E450-R454 VanDerWaalsContact O-N 3.11Å; E450-R454 PolarHBondContact O-NE 3.08Å; E450-R454 VanDerWaalsContact O-NE 3.13Å
451V90.1Very high92.1Very high2 Ų241.6 Ų41.61%0.01220%0.201CC..Hα-helixtrans-64.7-47.8173.7-1800000110.3E329 L448 L449 R454 R455E329-V451 HydrophobicContact CB-CG1 4.22Å; E329-V451 HydrophobicContact CB-CG2 4.36Å; E329-V451 HydrophobicContact CG-CG1 4.23Å; E329-V451 VanDerWaalsContact OE1-CG1 3.3Å; E329-V451 WeakPolarHBondContact OE1-CG1 3.23Å; L448-V451 PolarHBondContact O-N 3.02Å; L449-V451 PolarHBondContact O-N 3.09Å; L449-V451 VanDerWaalsContact O-N 3.15Å; V451-R454 PolarHBondContact O-N 3.3Å; V451-R455 WeakPolarHBondContact O-CG 3.35Å; V451-R455 PolarHBondContact O-N 3.45Å
452Y89.8Confident92Very high75 Ų7537.6 Ų37.629%0.29418%0.182SC..Hα-helixtrans-70.7-39.8-179.9-58.9-72.2000112.1C323 L449 R454 R455 I456C323-Y452 PolarHBondContact O-OH 3.31Å; L449-Y452 HydrophobicContact CD2-CD2 4.45Å; L449-Y452 PolarHBondContact O-N 2.99Å; Y452-R454 VanDerWaalsContact C-N 3.31Å; Y452-R454 PolarHBondContact O-N 2.88Å; Y452-R455 CarbonylContact O-C 3.59Å; Y452-R455 PolarHBondContact O-N 2.86Å; Y452-R455 VanDerWaalsContact O-N 3.12Å; Y452-I456 VanDerWaalsContact O-CG1 3.3Å; Y452-I456 WeakPolarHBondContact O-CG1 3.42Å; Y452-I456 PolarHBondContact O-N 2.84Å
453A92.5Very high92Very high6 Ų636 Ų365%0.0517%0.173CC..Hα-helixtrans-56.2-45.3174.800000111.7P136 G139 T140 L449 R455 I456 R457P136-A453 WeakPolarHBondContact O-CB 2.79Å; G139-A453 VanDerWaalsContact O-CB 3.3Å; G139-A453 WeakPolarHBondContact O-CB 3.45Å; T140-A453 HydrophobicContact CG2-CB 3.99Å; L449-A453 WeakPolarHBondContact O-CB 3.25Å; L449-A453 PolarHBondContact O-N 3.2Å; A453-R455 PolarHBondContact O-N 2.95Å; A453-I456 PolarHBondContact O-N 2.88Å; A453-R457 WeakPolarHBondContact O-CG 2.93Å; A453-R457 PolarHBondContact O-N 3.37Å
454R89.6Confident92.1Very high53 Ų5336 Ų3620%0.217%0.173CC..Hα-helixtrans-59.3-46.3173.8-77.5-178.4-80.1-168-1.7112.3E450 V451 Y452 I456 R457 R458E450-R454 WeakPolarHBondContact O-CB 3.47Å; E450-R454 VanDerWaalsContact O-CG 3.3Å; E450-R454 WeakPolarHBondContact O-CG 3.48Å; E450-R454 PolarHBondContact O-N 3.48Å; E450-R454 VanDerWaalsContact O-N 3.11Å; E450-R454 PolarHBondContact O-NE 3.08Å; E450-R454 VanDerWaalsContact O-NE 3.13Å; V451-R454 PolarHBondContact O-N 3.3Å; Y452-R454 VanDerWaalsContact C-N 3.31Å; Y452-R454 PolarHBondContact O-N 2.88Å; R454-I456 VanDerWaalsContact C-N 3.34Å; R454-I456 PolarHBondContact O-N 2.92Å; R454-R457 PolarHBondContact O-N 2.01Å; R454-R458 PolarHBondContact O-N 2.63Å; R454-R458 VanDerWaalsContact O-N 3.09Å
455R91.1Very high92.2Very high8 Ų834.7 Ų34.73%0.0317%0.168CC..Hα-helixtrans-64.6-37.1177.7-66.5171.9179.5-165.76.8112.5Y293 S322 K324 E329 V451 Y452 A453 K459Y293-R455 HydrophobicContact CE1-CG 3.89Å; S322-R455 PolarHBondContact O-NH1 3.04Å; K324-R455 PolarHBondContact O-NH2 3.44Å; E329-R455 IonicContact OE1-CZ 3.62Å; E329-R455 VanDerWaalsContact OE1-CZ 3.28Å; E329-R455 IonicContact OE1-NE 3.28Å; E329-R455 PolarHBondContact OE1-NE 2.89Å; E329-R455 IonicContact OE1-NH2 3.82Å; E329-R455 PolarHBondContact OE1-NH2 3.07Å; E329-R455 IonicContact OE2-CZ 3.7Å; E329-R455 IonicContact OE2-NH2 3.7Å; E329-R455 PolarHBondContact OE2-NH2 2.89Å; V451-R455 WeakPolarHBondContact O-CG 3.35Å; V451-R455 PolarHBondContact O-N 3.45Å; Y452-R455 CarbonylContact O-C 3.59Å; Y452-R455 PolarHBondContact O-N 2.86Å; Y452-R455 VanDerWaalsContact O-N 3.12Å; A453-R455 PolarHBondContact O-N 2.95Å; R455-K459 WeakPolarHBondContact O-CG 3.33Å; R455-K459 PolarHBondContact O-N 2.95Å
456I91.8Very high92.2Very high85 Ų8535.3 Ų35.344%0.43617%0.168SC..Hα-helixtrans-65.2-49.4175.2-68.2165.9000109.7P136 Y452 A453 R454 R458 K459 V460P136-I456 HydrophobicContact CB-CB 4.13Å; P136-I456 HydrophobicContact CB-CG2 3.74Å; P136-I456 HydrophobicContact CG-CG2 4.07Å; Y452-I456 VanDerWaalsContact O-CG1 3.3Å; Y452-I456 WeakPolarHBondContact O-CG1 3.42Å; Y452-I456 PolarHBondContact O-N 2.84Å; A453-I456 PolarHBondContact O-N 2.88Å; R454-I456 VanDerWaalsContact C-N 3.34Å; R454-I456 PolarHBondContact O-N 2.92Å; I456-R458 VanDerWaalsContact C-N 3.26Å; I456-R458 PolarHBondContact O-N 3.27Å; I456-K459 PolarHBondContact O-N 3.42Å; I456-V460 HydrophobicContact CG2-CG2 4.08Å; I456-V460 WeakPolarHBondContact O-CG2 3.42Å; I456-V460 PolarHBondContact O-N 3.09Å
457R93.8Very high92.2Very high26 Ų2638.7 Ų38.710%0.09819%0.19CC..Hα-helixtrans-52.2-46.9176.4-73.5-167.3-58.1172.83.8111.8M133 P136 T137 Y279 A453 R454 V460 S461M133-R457 HydrophobicContact CE-CB 3.7Å; M133-R457 HydrophobicContact CE-CG 3.86Å; P136-R457 HydrophobicContact CB-CG 3.77Å; P136-R457 HydrophobicContact CG-CG 3.83Å; T137-R457 WeakPolarHBondContact OG1-CD 3.49Å; Y279-R457 HydrophobicContact CE1-CB 4.17Å; A453-R457 WeakPolarHBondContact O-CG 2.93Å; A453-R457 PolarHBondContact O-N 3.37Å; R454-R457 PolarHBondContact O-N 2.01Å; R457-V460 PolarHBondContact O-N 2.97Å; R457-S461 PolarHBondContact O-N 2.83Å; R457-S461 PolarHBondContact O-OG 2.81Å; R457-S461 VanDerWaalsContact O-OG 3.07Å
458R92.4Very high92.3Very high11 Ų1139.9 Ų39.94%0.04220%0.196CC..Hα-helixtrans-60.8-43.8175.7-177.2-91.2-177.5-158.7-10112.8Y283 Y293 R454 I456 S461 A462 E469Y283-R458 HydrophobicContact CE2-CG 4.44Å; Y293-R458 HydrophobicContact CD2-CG 4Å; Y293-R458 HydrophobicContact CE2-CB 4.42Å; Y293-R458 HydrophobicContact CE2-CG 3.93Å; R454-R458 PolarHBondContact O-N 2.63Å; R454-R458 VanDerWaalsContact O-N 3.09Å; I456-R458 VanDerWaalsContact C-N 3.26Å; I456-R458 PolarHBondContact O-N 3.27Å; R458-S461 PolarHBondContact O-N 2.86Å; R458-A462 WeakPolarHBondContact O-CB 3.34Å; R458-A462 PolarHBondContact O-N 2.93Å; R458-E469 IonicContact CZ-OE1 3.7Å; R458-E469 IonicContact NH1-OE1 2.77Å; R458-E469 IonicContact NH2-OE1 2.8Å; R458-E469 PolarHBondContact NH2-OE1 2.97Å; R458-E469 IonicContact NH2-OE2 2.62Å
459K92.3Very high92.6Very high88 Ų8836.1 Ų36.138%0.38318%0.176SC..Hα-helixtrans-65.3-40.5176.7-76.5177.7-177.81730112.6S320 R455 I456 A462 S463S320-K459 WeakPolarHBondContact O-CE 3.34Å; S320-K459 PolarHBondContact O-NZ 3.44Å; S320-K459 VanDerWaalsContact OG-CE 3.27Å; S320-K459 WeakPolarHBondContact OG-CE 3.45Å; R455-K459 WeakPolarHBondContact O-CG 3.33Å; R455-K459 PolarHBondContact O-N 2.95Å; I456-K459 PolarHBondContact O-N 3.42Å; K459-A462 PolarHBondContact O-N 3.39Å; K459-S463 PolarHBondContact O-N 3.36Å
460V95Very high92.7Very high8 Ų837.4 Ų37.45%0.04818%0.18CC..Hα-helixtrans-59.4-54.3174.7175.10000108.9W60 T132 M133 I456 R457 A462 S463 F464W60-V460 HydrophobicContact CH2-CG1 4.37Å; W60-V460 HydrophobicContact CH2-CG2 4Å; W60-V460 HydrophobicContact CZ2-CG2 4.33Å; T132-V460 HydrophobicContact CG2-CG1 3.92Å; T132-V460 HydrophobicContact CG2-CG2 4.32Å; M133-V460 HydrophobicContact CG-CB 4.28Å; M133-V460 HydrophobicContact CG-CG1 3.78Å; I456-V460 HydrophobicContact CG2-CG2 4.08Å; I456-V460 WeakPolarHBondContact O-CG2 3.42Å; I456-V460 PolarHBondContact O-N 3.09Å; R457-V460 PolarHBondContact O-N 2.97Å; V460-A462 VanDerWaalsContact C-N 3.31Å; V460-A462 PolarHBondContact O-N 2.96Å; V460-S463 WeakPolarHBondContact O-CB 3.29Å; V460-S463 PolarHBondContact O-N 3.25Å; V460-S463 VanDerWaalsContact O-N 3.08Å; V460-F464 HydrophobicContact CG1-CD2 4.04Å; V460-F464 HydrophobicContact CG1-CE2 3.97Å; V460-F464 VanDerWaalsContact O-CD2 3.28Å; V460-F464 WeakPolarHBondContact O-CD2 3.32Å; V460-F464 PolarHBondContact O-N 3.43Å
461S94.8Very high92.8Very high0 Ų042.6 Ų42.60%020%0.202CC..Hα-helixtrans-58.4-40.4178.8-52.50000113.1M133 R457 R458 S463 F464 F465M133-S461 PolarHBondContact SD-OG 3.43Å; R457-S461 PolarHBondContact O-N 2.83Å; R457-S461 PolarHBondContact O-OG 2.81Å; R457-S461 VanDerWaalsContact O-OG 3.07Å; R458-S461 PolarHBondContact O-N 2.86Å; S461-S463 VanDerWaalsContact C-N 3.34Å; S461-S463 PolarHBondContact O-N 2.95Å; S461-F464 PolarHBondContact O-N 3.46Å; S461-F465 PolarHBondContact O-N 2.81Å
462A93.3Very high93Very high15 Ų1542.5 Ų42.512%0.12420%0.202CC..Hα-helixtrans-63.9-36.1176.600000113.2Y283 R458 K459 V460 E469Y283-A462 VanDerWaalsContact OH-CA 3.32Å; Y283-A462 WeakPolarHBondContact OH-CA 3.45Å; Y283-A462 WeakPolarHBondContact OH-CB 3.38Å; Y283-A462 PolarHBondContact OH-N 3.49Å; R458-A462 WeakPolarHBondContact O-CB 3.34Å; R458-A462 PolarHBondContact O-N 2.93Å; K459-A462 PolarHBondContact O-N 3.39Å; V460-A462 VanDerWaalsContact C-N 3.31Å; V460-A462 PolarHBondContact O-N 2.96Å; A462-E469 HydrophobicContact CB-CB 4.43Å; A462-E469 HydrophobicContact CB-CG 4.14Å
463S93.8Very high93Very high23 Ų2339.4 Ų39.416%0.16119%0.19CC..Hα-helixtrans-67.9-38.6177.3-162.40000112.3W60 S64 K459 V460 S461W60-S463 PolarHBondContact NE1-OG 3.4Å; S64-S463 PolarHBondContact OG-OG 3.43Å; S64-S463 VanDerWaalsContact OG-OG 3.06Å; K459-S463 PolarHBondContact O-N 3.36Å; V460-S463 WeakPolarHBondContact O-CB 3.29Å; V460-S463 PolarHBondContact O-N 3.25Å; V460-S463 VanDerWaalsContact O-N 3.08Å; S461-S463 VanDerWaalsContact C-N 3.34Å; S461-S463 PolarHBondContact O-N 2.95Å
464F95.1Very high93Very high4 Ų441.8 Ų41.82%0.01820%0.202CC..Hα-helixtrans-77-40.3-179.2-82.1-102000112.3W60 Y63 S64 H125 R128 C129 V460 S461W60-F464 HydrophobicContact CH2-CE2 4.35Å; W60-F464 HydrophobicContact CZ2-CE2 4.39Å; Y63-F464 AromaticContact CD1-CZ 3.73Å; Y63-F464 HydrophobicContact CD1-CZ 3.73Å; Y63-F464 HydrophobicContact CE1-CE1 4.4Å; Y63-F464 AromaticContact CE1-CZ 3.62Å; Y63-F464 HydrophobicContact CE1-CZ 3.62Å; S64-F464 WeakPolarHBondContact O-CA 3.33Å; H125-F464 AromaticContact CD2-CD1 3.94Å; H125-F464 AromaticContact CE1-CD1 3.9Å; H125-F464 PolarHBondContact CE1-O 2.93Å; H125-F464 AromaticContact NE2-CD1 3.46Å; H125-F464 WeakPolarHBondContact NE2-CD1 3.17Å; H125-F464 PolarHBondContact NE2-O 3Å; R128-F464 HydrophobicContact CB-CE1 3.58Å; R128-F464 HydrophobicContact CB-CZ 4.17Å; C129-F464 HydrophobicContact CB-CB 4.11Å; C129-F464 HydrophobicContact CB-CD1 3.58Å; C129-F464 HydrophobicContact CB-CD2 4.12Å; C129-F464 HydrophobicContact CB-CE1 3.99Å; C129-F464 HydrophobicContact CB-CE2 4.45Å; C129-F464 HydrophobicContact CB-CG 3.66Å; C129-F464 HydrophobicContact CB-CZ 4.38Å; V460-F464 HydrophobicContact CG1-CD2 4.04Å; V460-F464 HydrophobicContact CG1-CE2 3.97Å; V460-F464 VanDerWaalsContact O-CD2 3.28Å; V460-F464 WeakPolarHBondContact O-CD2 3.32Å; V460-F464 PolarHBondContact O-N 3.43Å; S461-F464 PolarHBondContact O-N 3.46Å
465F95.1Very high93.1Very high41 Ų4142.3 Ų42.318%0.1821%0.206CC..  trans-114.265.9-174-65.8-91.7000111.7H125 P126 C129 L280 V284 S461 T467 Q468 E469H125-F465 AromaticContact CE1-CZ 3.97Å; H125-F465 AromaticContact ND1-CZ 3.84Å; P126-F465 HydrophobicContact CB-CZ 4.19Å; P126-F465 HydrophobicContact CG-CZ 4.18Å; C129-F465 HydrophobicContact CB-CE2 4.3Å; L280-F465 HydrophobicContact CD1-CD2 4.04Å; L280-F465 HydrophobicContact CD1-CE2 3.67Å; L280-F465 HydrophobicContact CD2-CE2 4.2Å; L280-F465 HydrophobicContact CG-CE2 4.33Å; V284-F465 HydrophobicContact CG2-CD1 3.89Å; V284-F465 HydrophobicContact CG2-CD2 4.1Å; V284-F465 HydrophobicContact CG2-CE1 3.93Å; V284-F465 HydrophobicContact CG2-CE2 4.18Å; V284-F465 HydrophobicContact CG2-CG 3.98Å; V284-F465 HydrophobicContact CG2-CZ 4.08Å; S461-F465 PolarHBondContact O-N 2.81Å; F465-T467 PolarHBondContact O-N 3.11Å; F465-Q468 HydrophobicContact CB-CB 4.05Å; F465-Q468 PolarHBondContact O-N 3.28Å; F465-Q468 VanDerWaalsContact O-N 3.16Å; F465-E469 PolarHBondContact O-N 3.29Å
466K92.6Very high93Very high92 Ų9242.2 Ų42.240%0.421%0.206SC..Hα-helixtrans-56.1-46.8-176.8-64-176.4-177.9175.30112.8D61 Q468 E469 E470D61-K466 IonicContact OD1-NZ 2.71Å; D61-K466 PolarHBondContact OD1-NZ 3.05Å; K466-Q468 VanDerWaalsContact C-N 3.3Å; K466-Q468 PolarHBondContact O-N 3.14Å; K466-E469 WeakPolarHBondContact O-CB 3.17Å; K466-E469 PolarHBondContact O-N 2.82Å; K466-E469 VanDerWaalsContact O-N 3.11Å; K466-E470 PolarHBondContact O-N 2.96Å
467T92.4Very high92.9Very high96 Ų9638.4 Ų38.459%0.58919%0.187SC*.Hα-helixtrans-60.9-37178.2-46.60000113F465 K471F465-T467 PolarHBondContact O-N 3.11Å; T467-K471 WeakPolarHBondContact O-CG 3.34Å; T467-K471 PolarHBondContact O-N 2.96Å
468Q93.5Very high92.7Very high26 Ų2644.2 Ų44.212%0.12121%0.212CC..Hα-helixtrans-72.1-36.9177-177.963.52.900111.2Y283 V284 F465 K466 E470 K471 R472Y283-Q468 HydrophobicContact CE1-CG 4.49Å; V284-Q468 PolarHBondContact O-NE2 3.05Å; F465-Q468 HydrophobicContact CB-CB 4.05Å; F465-Q468 PolarHBondContact O-N 3.28Å; F465-Q468 VanDerWaalsContact O-N 3.16Å; K466-Q468 VanDerWaalsContact C-N 3.3Å; K466-Q468 PolarHBondContact O-N 3.14Å; Q468-E470 VanDerWaalsContact C-N 3.35Å; Q468-K471 PolarHBondContact O-N 2.97Å; Q468-R472 VanDerWaalsContact O-CG 3.25Å; Q468-R472 WeakPolarHBondContact O-CG 3.31Å; Q468-R472 PolarHBondContact O-N 3.13Å
469E93.6Very high92.5Very high5 Ų548.6 Ų48.62%0.02323%0.232CC..Hα-helixtrans-62.1-41.6174.5177.764.5174.400111.7Y283 R458 A462 F465 K466 K471 R472 I473Y283-E469 PolarHBondContact OH-OE2 3.46Å; R458-E469 IonicContact CZ-OE1 3.7Å; R458-E469 IonicContact NH1-OE1 2.77Å; R458-E469 IonicContact NH2-OE1 2.8Å; R458-E469 PolarHBondContact NH2-OE1 2.97Å; R458-E469 IonicContact NH2-OE2 2.62Å; A462-E469 HydrophobicContact CB-CB 4.43Å; A462-E469 HydrophobicContact CB-CG 4.14Å; F465-E469 PolarHBondContact O-N 3.29Å; K466-E469 WeakPolarHBondContact O-CB 3.17Å; K466-E469 PolarHBondContact O-N 2.82Å; K466-E469 VanDerWaalsContact O-N 3.11Å; E469-K471 PolarHBondContact O-N 3.25Å; E469-R472 WeakPolarHBondContact O-CB 3.32Å; E469-R472 PolarHBondContact O-N 3.49Å; E469-R472 VanDerWaalsContact O-N 3.15Å; E469-R472 IonicContact OE2-NE 3.41Å; E469-I473 HydrophobicContact CG-CD1 3.98Å; E469-I473 HydrophobicContact CG-CG1 4.5Å; E469-I473 VanDerWaalsContact O-CG1 3.32Å; E469-I473 WeakPolarHBondContact O-CG1 3.42Å; E469-I473 PolarHBondContact O-N 3.42Å
470E92.6Very high92.2Very high110 Ų11044.7 Ų44.751%0.51422%0.215SC..Hα-helixtrans-59.6-44.9174.2-71.8169.5-166.700112.4K466 Q468 R472 I473 N474K466-E470 PolarHBondContact O-N 2.96Å; Q468-E470 VanDerWaalsContact C-N 3.35Å; E470-R472 VanDerWaalsContact C-N 3.29Å; E470-R472 PolarHBondContact O-N 3.48Å; E470-I473 PolarHBondContact O-N 3.18Å; E470-N474 PolarHBondContact O-N 2.83Å; E470-N474 PolarHBondContact O-ND2 2.64Å; E470-N474 PolarHBondContact O-OD1 3.29Å
471K93.4Very high91.8Very high120 Ų12047.4 Ų47.452%0.52223%0.227SC..Hα-helixtrans-59.4-40.6174.7-70.4176.4-177.6178.80111.9T467 Q468 E469 N474 F475T467-K471 WeakPolarHBondContact O-CG 3.34Å; T467-K471 PolarHBondContact O-N 2.96Å; Q468-K471 PolarHBondContact O-N 2.97Å; E469-K471 PolarHBondContact O-N 3.25Å; K471-N474 PolarHBondContact O-N 3.23Å; K471-F475 WeakPolarHBondContact O-CB 3.03Å; K471-F475 PolarHBondContact O-N 2.58Å
472R93.7Very high91.4Very high0 Ų049.8 Ų49.80%025%0.246CC..Hα-helixtrans-66.9-39.7178-71.916762120.110.2112.3Y283 V287 F289 D290 N291 Q468 E469 E470 L476Y283-R472 VanDerWaalsContact CE2-CZ 3.44Å; Y283-R472 PolarHBondContact O-NH1 3.01Å; V287-R472 HydrophobicContact CB-CG 4.21Å; V287-R472 HydrophobicContact CG1-CG 4.28Å; F289-R472 VanDerWaalsContact O-CZ 3.31Å; F289-R472 PolarHBondContact O-NH1 3.46Å; F289-R472 PolarHBondContact O-NH2 3.29Å; D290-R472 PolarHBondContact O-NH2 2.96Å; D290-R472 VanDerWaalsContact O-NH2 3.09Å; N291-R472 PolarHBondContact ND2-O 3.12Å; Q468-R472 VanDerWaalsContact O-CG 3.25Å; Q468-R472 WeakPolarHBondContact O-CG 3.31Å; Q468-R472 PolarHBondContact O-N 3.13Å; E469-R472 WeakPolarHBondContact O-CB 3.32Å; E469-R472 PolarHBondContact O-N 3.49Å; E469-R472 VanDerWaalsContact O-N 3.15Å; E469-R472 IonicContact OE2-NE 3.41Å; E470-R472 VanDerWaalsContact C-N 3.29Å; E470-R472 PolarHBondContact O-N 3.48Å; R472-L476 WeakPolarHBondContact O-CB 3.4Å; R472-L476 PolarHBondContact O-N 3.21Å
473I91.3Very high91Very high10 Ų1054.3 Ų54.35%0.05126%0.263CS..Hα-helixtrans-63.9-48.5175.1-70.8169.6000109.9Q297 L298 K301 E469 E470 F475 L476 L477Q297-I473 HydrophobicContact CB-CD1 3.68Å; L298-I473 HydrophobicContact CB-CG2 4.29Å; L298-I473 HydrophobicContact CD1-CG2 3.81Å; K301-I473 HydrophobicContact CD-CG2 4.27Å; E469-I473 HydrophobicContact CG-CD1 3.98Å; E469-I473 HydrophobicContact CG-CG1 4.5Å; E469-I473 VanDerWaalsContact O-CG1 3.32Å; E469-I473 WeakPolarHBondContact O-CG1 3.42Å; E469-I473 PolarHBondContact O-N 3.42Å; E470-I473 PolarHBondContact O-N 3.18Å; I473-F475 VanDerWaalsContact C-N 3.34Å; I473-F475 PolarHBondContact O-N 2.82Å; I473-L476 PolarHBondContact O-N 3.49Å; I473-L476 VanDerWaalsContact O-N 3.14Å; I473-L477 WeakPolarHBondContact O-CB 3.47Å; I473-L477 PolarHBondContact O-N 3.39Å
474N91.8Very high90.5Very high57 Ų5754.5 Ų54.531%0.30526%0.262SS..Hα-helixtrans-60.1-43.6178-65.4-13.2000111.9K301 E470 K471 L476 L477 K478K301-N474 WeakPolarHBondContact CD-OD1 3.05Å; K301-N474 WeakPolarHBondContact CE-OD1 3.43Å; K301-N474 PolarHBondContact NZ-OD1 3.46Å; E470-N474 PolarHBondContact O-N 2.83Å; E470-N474 PolarHBondContact O-ND2 2.64Å; E470-N474 PolarHBondContact O-OD1 3.29Å; K471-N474 PolarHBondContact O-N 3.23Å; N474-L476 VanDerWaalsContact C-N 3.33Å; N474-L476 PolarHBondContact O-N 3.34Å; N474-L477 PolarHBondContact O-N 2.66Å; N474-K478 WeakPolarHBondContact O-CG 3.35Å; N474-K478 PolarHBondContact O-N 3.46Å
475F91.8Very high89.9Confident64 Ų6458.4 Ų58.428%0.28128%0.283SS..Hα-helixtrans-60.7-43175.7173-97.4000111.8V287 K288 K471 I473 K479V287-F475 HydrophobicContact CB-CB 4.43Å; V287-F475 HydrophobicContact CB-CG 4.37Å; V287-F475 HydrophobicContact CG2-CB 4.4Å; V287-F475 HydrophobicContact CG2-CD1 4.22Å; V287-F475 HydrophobicContact CG2-CD2 4.05Å; V287-F475 HydrophobicContact CG2-CE2 4.43Å; V287-F475 HydrophobicContact CG2-CG 3.94Å; K288-F475 HydrophobicContact CD-CZ 4.41Å; K288-F475 HydrophobicContact CG-CE1 3.9Å; K288-F475 HydrophobicContact CG-CZ 3.76Å; K471-F475 WeakPolarHBondContact O-CB 3.03Å; K471-F475 PolarHBondContact O-N 2.58Å; I473-F475 VanDerWaalsContact C-N 3.34Å; I473-F475 PolarHBondContact O-N 2.82Å; F475-K479 HydrophobicContact CE1-CD 4.39Å; F475-K479 WeakPolarHBondContact O-CB 3.41Å; F475-K479 PolarHBondContact O-N 3.25Å
476L89.6Confident89.3Confident6 Ų660.2 Ų60.23%0.03130%0.297CS..Hα-helixtrans-67-39.8179.2-172.362.1000111.6L298 M317 R472 I473 N474 K479 I480L298-L476 HydrophobicContact CD1-CD2 4.43Å; L298-L476 HydrophobicContact CD2-CD2 3.86Å; M317-L476 HydrophobicContact CE-CD1 3.8Å; M317-L476 HydrophobicContact CE-CG 4.3Å; R472-L476 WeakPolarHBondContact O-CB 3.4Å; R472-L476 PolarHBondContact O-N 3.21Å; I473-L476 PolarHBondContact O-N 3.49Å; I473-L476 VanDerWaalsContact O-N 3.14Å; N474-L476 VanDerWaalsContact C-N 3.33Å; N474-L476 PolarHBondContact O-N 3.34Å; L476-K479 WeakPolarHBondContact O-CB 3.39Å; L476-K479 PolarHBondContact O-N 3.41Å; L476-I480 HydrophobicContact CG-CD1 4.34Å; L476-I480 VanDerWaalsContact O-CG1 3.31Å; L476-I480 WeakPolarHBondContact O-CG1 3.44Å; L476-I480 PolarHBondContact O-N 3.15Å
477L88.8Confident88.6Confident5 Ų560.8 Ų60.83%0.02630%0.297CS..Hα-helixtrans-62.3-50.6176.7-170.163.2000111.4L298 K301 A302 D305 I307 I473 N474 K479 I480 Q481L298-L477 HydrophobicContact CD1-CB 4.4Å; K301-L477 HydrophobicContact CG-CD2 4.36Å; A302-L477 HydrophobicContact CB-CD1 3.82Å; D305-L477 VanDerWaalsContact OD2-CD2 3.29Å; D305-L477 WeakPolarHBondContact OD2-CD2 3.5Å; I307-L477 HydrophobicContact CD1-CD1 3.66Å; I307-L477 HydrophobicContact CD1-CD2 3.67Å; I307-L477 HydrophobicContact CD1-CG 3.64Å; I473-L477 WeakPolarHBondContact O-CB 3.47Å; I473-L477 PolarHBondContact O-N 3.39Å; N474-L477 PolarHBondContact O-N 2.66Å; L477-K479 PolarHBondContact O-N 3.29Å; L477-I480 WeakPolarHBondContact O-CA 3.49Å; L477-I480 WeakPolarHBondContact O-CB 3.32Å; L477-I480 PolarHBondContact O-N 2.89Å; L477-Q481 PolarHBondContact O-N 3.4Å
478K90.2Very high87.9Confident148 Ų14861.5 Ų61.564%0.64329%0.294SS*.Hα-helixtrans-56.4-38.5173.9-72.6-175.5178-169.20112.4N474 I480 Q481 A482N474-K478 WeakPolarHBondContact O-CG 3.35Å; N474-K478 PolarHBondContact O-N 3.46Å; K478-I480 VanDerWaalsContact C-N 3.34Å; K478-Q481 PolarHBondContact O-N 2.76Å; K478-A482 WeakPolarHBondContact O-CB 3.48Å; K478-A482 PolarHBondContact O-N 3.45Å
479K88.1Confident87Confident103 Ų10364.5 Ų64.545%0.44831%0.311SS..Hα-helixtrans-67.8-32.8176.6-177.8179.3179.6-179.20112.7F475 L476 L477 K483F475-K479 HydrophobicContact CE1-CD 4.39Å; F475-K479 WeakPolarHBondContact O-CB 3.41Å; F475-K479 PolarHBondContact O-N 3.25Å; L476-K479 WeakPolarHBondContact O-CB 3.39Å; L476-K479 PolarHBondContact O-N 3.41Å; L477-K479 PolarHBondContact O-N 3.29Å; K479-K483 WeakPolarHBondContact O-CG 3.33Å; K479-K483 PolarHBondContact O-N 2.93Å
480I85.8Confident85.8Confident5 Ų568.7 Ų68.73%0.02633%0.333CS..Hα-helixtrans-71.1-47.9175-68.6163.6000109.6I309 N313 M317 L476 L477 K478 K483 Q484I309-I480 HydrophobicContact CG2-CG2 4.05Å; N313-I480 HydrophobicContact CB-CG2 4.45Å; M317-I480 HydrophobicContact CE-CD1 3.74Å; M317-I480 HydrophobicContact CE-CG1 3.66Å; M317-I480 HydrophobicContact SD-CD1 4.35Å; L476-I480 HydrophobicContact CG-CD1 4.34Å; L476-I480 VanDerWaalsContact O-CG1 3.31Å; L476-I480 WeakPolarHBondContact O-CG1 3.44Å; L476-I480 PolarHBondContact O-N 3.15Å; L477-I480 WeakPolarHBondContact O-CA 3.49Å; L477-I480 WeakPolarHBondContact O-CB 3.32Å; L477-I480 PolarHBondContact O-N 2.89Å; K478-I480 VanDerWaalsContact C-N 3.34Å; I480-K483 WeakPolarHBondContact O-CB 3.36Å; I480-K483 PolarHBondContact O-N 2.8Å; I480-K483 VanDerWaalsContact O-N 3.13Å; I480-Q484 PolarHBondContact O-N 3.49Å; I480-Q484 VanDerWaalsContact O-N 3.08Å
481Q86.4Confident84.4Confident66 Ų6669 Ų6931%0.30834%0.337SS..Hα-helixtrans-57.1-52.1178-70.2175.4-5400111.7I307 L477 K478 K483 Q484 D485I307-Q481 HydrophobicContact CD1-CG 4.04Å; I307-Q481 HydrophobicContact CG1-CG 4.4Å; I307-Q481 HydrophobicContact CG2-CG 4.15Å; L477-Q481 PolarHBondContact O-N 3.4Å; K478-Q481 PolarHBondContact O-N 2.76Å; Q481-K483 PolarHBondContact O-N 3.34Å; Q481-Q484 WeakPolarHBondContact O-CA 3.45Å; Q481-Q484 WeakPolarHBondContact O-CB 3.5Å; Q481-Q484 PolarHBondContact O-N 2.81Å; Q481-D485 PolarHBondContact O-N 3.25Å
482A86.6Confident82.7Confident49 Ų4970.8 Ų70.841%0.40535%0.345SS..Hα-helixtrans-57.1-30.8178.700000113.2K478 T486K478-A482 WeakPolarHBondContact O-CB 3.48Å; K478-A482 PolarHBondContact O-N 3.45Å; A482-T486 WeakPolarHBondContact O-CB 3.43Å; A482-T486 PolarHBondContact O-N 3.49Å; A482-T486 VanDerWaalsContact O-N 3.11Å; A482-T486 PolarHBondContact O-OG1 2.86Å
483K84.6Confident81Confident110 Ų11079 Ų7948%0.47838%0.381SS..Hα-helixtrans-75-30.6174.3-78.8-176.6172.8-164.30113.3K479 I480 Q481 R487K479-K483 WeakPolarHBondContact O-CG 3.33Å; K479-K483 PolarHBondContact O-N 2.93Å; I480-K483 WeakPolarHBondContact O-CB 3.36Å; I480-K483 PolarHBondContact O-N 2.8Å; I480-K483 VanDerWaalsContact O-N 3.13Å; Q481-K483 PolarHBondContact O-N 3.34Å; K483-R487 WeakPolarHBondContact O-CG 3.46Å; K483-R487 PolarHBondContact O-N 3.49Å
484Q83.5Confident79.1Confident27 Ų2785.2 Ų85.213%0.12641%0.413CS..Hα-helixtrans-69.3-52.3173.2-72.5174.5-62.100109.6Q308 N313 I480 Q481 T486 R487 E488Q308-Q484 PolarHBondContact O-NE2 3.16Å; N313-Q484 WeakPolarHBondContact ND2-CG 3.4Å; I480-Q484 PolarHBondContact O-N 3.49Å; I480-Q484 VanDerWaalsContact O-N 3.08Å; Q481-Q484 WeakPolarHBondContact O-CA 3.45Å; Q481-Q484 WeakPolarHBondContact O-CB 3.5Å; Q481-Q484 PolarHBondContact O-N 2.81Å; Q484-T486 VanDerWaalsContact C-N 3.28Å; Q484-T486 PolarHBondContact O-N 3.34Å; Q484-R487 WeakPolarHBondContact O-CA 3.47Å; Q484-R487 WeakPolarHBondContact O-CB 3.35Å; Q484-R487 PolarHBondContact O-N 2.59Å; Q484-E488 PolarHBondContact O-N 3.31Å
485D83Confident76.9Confident87 Ų8791 Ų9147%0.46544%0.438SS..Hα-helixtrans-57-42.2178.7-52.6-19.8000111.7Q481 R487 E488 N489Q481-D485 PolarHBondContact O-N 3.25Å; D485-R487 VanDerWaalsContact C-N 3.31Å; D485-R487 PolarHBondContact O-N 2.84Å; D485-E488 PolarHBondContact O-N 3.33Å; D485-N489 WeakPolarHBondContact O-CB 3.49Å; D485-N489 VanDerWaalsContact O-CG 3.29Å; D485-N489 PolarHBondContact O-N 3.45Å
486T83Confident74.8Confident78 Ų7892 Ų9248%0.47946%0.459SS..Hα-helixtrans-64.3-36.4176.4-55.10000111.9A482 Q484 N490A482-T486 WeakPolarHBondContact O-CB 3.43Å; A482-T486 PolarHBondContact O-N 3.49Å; A482-T486 VanDerWaalsContact O-N 3.11Å; A482-T486 PolarHBondContact O-OG1 2.86Å; Q484-T486 VanDerWaalsContact C-N 3.28Å; Q484-T486 PolarHBondContact O-N 3.34Å; T486-N490 VanDerWaalsContact O-CB 3.28Å; T486-N490 WeakPolarHBondContact O-CB 3.21Å; T486-N490 PolarHBondContact O-N 3.28Å; T486-N490 PolarHBondContact O-ND2 2.93Å; T486-N490 VanDerWaalsContact O-ND2 3.1Å
487R77.7Confident73.1Confident105 Ų10597.8 Ų97.840%0.39649%0.494SS..Hα-helixtrans-71.9-44.9177.1-83.9-175.8-179.7160.88111.5N313 K483 Q484 D485 N490 I491N313-R487 PolarHBondContact OD1-NH1 3.21Å; K483-R487 WeakPolarHBondContact O-CG 3.46Å; K483-R487 PolarHBondContact O-N 3.49Å; Q484-R487 WeakPolarHBondContact O-CA 3.47Å; Q484-R487 WeakPolarHBondContact O-CB 3.35Å; Q484-R487 PolarHBondContact O-N 2.59Å; D485-R487 VanDerWaalsContact C-N 3.31Å; D485-R487 PolarHBondContact O-N 2.84Å; R487-N490 PolarHBondContact O-N 3.06Å; R487-I491 WeakPolarHBondContact O-CD1 3.19Å; R487-I491 WeakPolarHBondContact O-CG1 3.49Å; R487-I491 PolarHBondContact O-N 3.36Å
488E77.6Confident71.2Confident111 Ų111104.5 Ų104.552%0.51953%0.53SS..Hα-helixtrans-59.4-51.5176.9-73.4-178.2-179.900110.3Q484 D485 N490 I491 F492Q484-E488 PolarHBondContact O-N 3.31Å; D485-E488 PolarHBondContact O-N 3.33Å; E488-N490 PolarHBondContact O-N 3.12Å; E488-I491 WeakPolarHBondContact O-CB 3.5Å; E488-I491 PolarHBondContact O-N 3.47Å; E488-F492 HydrophobicContact CB-CE2 4.24Å; E488-F492 WeakPolarHBondContact O-CD2 3.32Å; E488-F492 PolarHBondContact O-N 2.93Å
489N73.8Confident69.1Low89 Ų89106 Ų10648%0.47654%0.539SS..Hα-helixtrans-57.5-45.5176.7-72.7-14000112.1D485 I491 F492 F493D485-N489 WeakPolarHBondContact O-CB 3.49Å; D485-N489 VanDerWaalsContact O-CG 3.29Å; D485-N489 PolarHBondContact O-N 3.45Å; N489-I491 VanDerWaalsContact C-N 3.28Å; N489-I491 PolarHBondContact O-N 2.81Å; N489-F492 PolarHBondContact O-N 2.85Å; N489-F493 HydrophobicContact CB-CE2 4.42Å; N489-F493 WeakPolarHBondContact O-CD2 3.34Å; N489-F493 PolarHBondContact O-N 3.02Å
490N68.8Low67.6Low93 Ų93106.5 Ų106.550%0.49755%0.551SS.*Hα-helixtrans-65.8-28177.2-73.8-22.8000113.4T486 R487 E488 I494T486-N490 VanDerWaalsContact O-CB 3.28Å; T486-N490 WeakPolarHBondContact O-CB 3.21Å; T486-N490 PolarHBondContact O-N 3.28Å; T486-N490 PolarHBondContact O-ND2 2.93Å; T486-N490 VanDerWaalsContact O-ND2 3.1Å; R487-N490 PolarHBondContact O-N 3.06Å; E488-N490 PolarHBondContact O-N 3.12Å; N490-I494 WeakPolarHBondContact O-CD1 3.33Å; N490-I494 VanDerWaalsContact O-CG1 3.32Å; N490-I494 WeakPolarHBondContact O-CG1 3.45Å
491I62.3Low65.4Low117 Ų117117.5 Ų117.560%0.659%0.592SS**Hα-helixtrans-70.5-42.3172.4-69.8161.9000109.8R487 E488 N489 F493 I494R487-I491 WeakPolarHBondContact O-CD1 3.19Å; R487-I491 WeakPolarHBondContact O-CG1 3.49Å; R487-I491 PolarHBondContact O-N 3.36Å; E488-I491 WeakPolarHBondContact O-CB 3.5Å; E488-I491 PolarHBondContact O-N 3.47Å; N489-I491 VanDerWaalsContact C-N 3.28Å; N489-I491 PolarHBondContact O-N 2.81Å; I491-F493 VanDerWaalsContact C-N 3.28Å; I491-F493 PolarHBondContact O-N 3.38Å; I491-I494 PolarHBondContact O-N 2.73Å; I491-I494 VanDerWaalsContact O-N 3.09Å
492F58.5Low63.5Low157 Ų157119.8 Ų119.869%0.68961%0.61SS**Hα-helixtrans-64.2-28.6175.5-70.9-68.4000113.5E488 N489 I494E488-F492 HydrophobicContact CB-CE2 4.24Å; E488-F492 WeakPolarHBondContact O-CD2 3.32Å; E488-F492 PolarHBondContact O-N 2.93Å; N489-F492 PolarHBondContact O-N 2.85Å; F492-I494 VanDerWaalsContact C-N 3.26Å; F492-I494 PolarHBondContact O-N 2.72Å
493F58Low61.2Low172 Ų172126.6 Ų126.675%0.75463%0.634SS**THydrogen-bonded Turntrans-78-3.9174.2-73.4-68.1000114.3N489 I491N489-F493 HydrophobicContact CB-CE2 4.42Å; N489-F493 WeakPolarHBondContact O-CD2 3.34Å; N489-F493 PolarHBondContact O-N 3.02Å; I491-F493 VanDerWaalsContact C-N 3.28Å; I491-F493 PolarHBondContact O-N 3.38Å
494I51.6Low59.2Low141 Ų141126.6 Ų126.672%0.72364%0.643SS**  trans-107.961.5174.8-52.4160.2000108.6N490 I491 F492N490-I494 WeakPolarHBondContact O-CD1 3.33Å; N490-I494 VanDerWaalsContact O-CG1 3.32Å; N490-I494 WeakPolarHBondContact O-CG1 3.45Å; I491-I494 PolarHBondContact O-N 2.73Å; I491-I494 VanDerWaalsContact O-N 3.09Å; F492-I494 VanDerWaalsContact C-N 3.26Å; F492-I494 PolarHBondContact O-N 2.72Å
495E45.5Very low57Low177 Ų177131.6 Ų131.683%0.82767%0.671SS**  trans-114.898.6160-154167.2-150.100106.7V497E495-V497 PolarHBondContact O-N 2.82Å
496A48.2Very low55Low87 Ų87134.9 Ų134.972%0.71968%0.683SS**  trans-67.4115.9178.300000108.7N498A496-N498 VanDerWaalsContact C-N 3.35Å; A496-N498 PolarHBondContact O-N 3.45Å
497V52.8Low52.8Low127 Ų127137.8 Ų137.877%0.7770%0.696SS**  trans-57.2101.8162.8175.90000107.2E495 E499E495-V497 PolarHBondContact O-N 2.82Å; V497-E499 HydrophobicContact CG1-CG 4.1Å; V497-E499 PolarHBondContact O-N 2.71Å
498N48.8Very low51Low146 Ų146139 Ų13978%0.78172%0.715SS**  trans-96.476.4173.4-140.116.6000107.4A496 T500A496-N498 VanDerWaalsContact C-N 3.35Å; A496-N498 PolarHBondContact O-N 3.45Å; N498-T500 VanDerWaalsContact C-N 3.34Å; N498-T500 PolarHBondContact O-N 2.9Å
499E46.5Very low49.2Very low178 Ų178145 Ų14583%0.83275%0.747SS**  trans-72.392.4167-93.7-173162.600109V497V497-E499 HydrophobicContact CG1-CG 4.1Å; V497-E499 PolarHBondContact O-N 2.71Å
500T55.7Low48Very low114 Ų114147.8 Ų147.870%0.69976%0.761SS**  trans-14497.515527.60000110.5N498N498-T500 VanDerWaalsContact C-N 3.34Å; N498-T500 PolarHBondContact O-N 2.9Å
501R40.6Very low46.9Very low236 Ų236150.6 Ų150.689%0.89178%0.775SS**  trans-164.1107.1137.5-110.8-175.4-116.8-172.7-1.4109.2
502V47.1Very low46Very low114 Ų114152.5 Ų152.569%0.69179%0.785SS**  64.910498.4178.40000112.1
503H37.7Very low45.3Very low193 Ų193152.2 Ų152.289%0.89479%0.79SS**  trans-140.8100140-104.2-69.2000109.9
504T43.5Very low44.5Very low110 Ų110151 Ų15168%0.67579%0.792SS**  trans-67.8124.6145.99.80000108.2
505N37.3Very low44Very low132 Ų132151.7 Ų151.771%0.70680%0.797SS**  175126.9125.3-93.7-9000112.6
506Q40.3Very low43.9Very low155 Ų155149.9 Ų149.972%0.72480%0.795SS**  trans45.8115135.9-79.2162.2-42.200119.8
507N37.3Very low43.6Very low140 Ų140154.7 Ų154.775%0.74980%0.801SS**  163.2141.394.1-99.6-13.9000114.1
508V38.9Very low42.8Very low131 Ų131157 Ų15779%0.79480%0.803SS**  trans75.6118.4146.6-179.10000115
509I39.8Very low42.2Very low235 Ų235158 Ų158100%1.20581%0.805SS**  cis-138.7033.1-65.4175.5000110

Retrieved 509 of 509 residues in 1463.6 ms (Link to these results)