A0A5K4F2L0_SCHMA Loading...

LSDAT_euk domain-containing protein

AlphaFold DB (A0A5K4F298), UniProt , Accession A0A5K4F2L0, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 141 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
1M42.9Very low50.5Low243 Ų243166.8 Ų166.8100%1.19784%0.843SS**  01030-65.2178.6179.800106.2
2T55.5Low50.9Low146 Ų146162.3 Ų162.390%0.89683%0.83SS**  trans-140.899.4-1749.30000106.9
3E46.2Very low50.8Low189 Ų189163.1 Ų163.188%0.88384%0.836SS**  trans-86.3137.3163-84.4-149.3106.500108.8
4Q44.9Very low51.1Low173 Ų173165.1 Ų165.181%0.80884%0.835SS**  -172.5113128.3-104.1-1741.400112.7
5I59.2Low50.9Low129 Ų129165.4 Ų165.466%0.66283%0.832SS**  trans68.5108.7138.3-47.7151.3000118.7
6P54.1Low50.3Low111 Ų111169.4 Ų169.472%0.72183%0.834SS**  trans-82.8129.3163.831.1-28.4000111.9Q8P6-Q8 PolarHBondContact O-N 3.39Å
7F52.1Low50.8Low205 Ų205166.1 Ų166.190%0.89982%0.819SS**  trans-71.1103.6171.7-128.9-92.1000109.8R9F7-R9 PolarHBondContact O-N 3.25Å
8Q52Low50.5Low171 Ų171162.3 Ų162.380%0.79981%0.812SS**  trans-82.8107.1170.5-72.6-168.9-300110.2P6P6-Q8 PolarHBondContact O-N 3.39Å
9R50.2Low50.5Low239 Ų239165 Ų16590%0.90281%0.811SS**  trans-98.994.1169.6-160.9179.2-167.5-177.44.2108.4F7 S11F7-R9 PolarHBondContact O-N 3.25Å; R9-S11 PolarHBondContact O-N 3.41Å
10T51.1Low50.4Low117 Ų117163.6 Ų163.672%0.71881%0.813SS**  trans-80.7111173.5610000109.4
11S47.6Very low49.9Very low112 Ų112159.7 Ų159.778%0.78381%0.814SS**  trans-94.2117.6164.5172.10000107.9R9R9-S11 PolarHBondContact O-N 3.41Å
12T54.5Low50.3Low113 Ų113153.6 Ų153.669%0.69380%0.796SS**  trans-95.5107170.457.30000109.2K14T12-K14 PolarHBondContact O-N 3.35Å
13L49.6Very low49.8Very low172 Ų172153.3 Ų153.390%0.90179%0.793SS**  trans-64.1116.3161.4-90.7154000108.7
14K55.2Low49.6Very low191 Ų191147.4 Ų147.483%0.8378%0.783SS**  trans-123.8107.9167.3-82.1-172.1175-177.80110.8T12T12-K14 PolarHBondContact O-N 3.35Å
15H48.6Very low49.4Very low170 Ų170147 Ų14779%0.78778%0.781SS**  trans42.2112.2149.5-110.4-84000120.2I17H15-I17 PolarHBondContact O-N 3.28Å
16R40.4Very low48.6Very low230 Ų230148.6 Ų148.687%0.86879%0.791SS**  trans-56.4115.6153.8-172.3-179.9-172.2177.72.8108.9
17I59.9Low48.3Very low112 Ų112149.3 Ų149.357%0.57479%0.789SS**  trans-105.7109.1166.1-59.8174.1000106.8H15 R19H15-I17 PolarHBondContact O-N 3.28Å; I17-R19 HydrophobicContact CG2-CG 3.56Å; I17-R19 PolarHBondContact O-N 3.28Å
18S45.2Very low48Very low99 Ų99147.5 Ų147.569%0.69279%0.789SS**  trans-73.2104.1163.8-59.20000107.7
19R49.5Very low47.7Very low213 Ų213146 Ų14680%0.80479%0.786SS**  trans-94.198.7171.3-64-168.7-171.9-146.41.3109.2I17I17-R19 HydrophobicContact CG2-CG 3.56Å; I17-R19 PolarHBondContact O-N 3.28Å
20T49.1Very low47.5Very low137 Ų137142.4 Ų142.484%0.8479%0.785SS**  trans-69.6118.7155.149.20000107.5S22T20-S22 PolarHBondContact O-N 3.48Å
21G41Very low47Very low82 Ų82144.5 Ų144.585%0.84579%0.79SS**  trans-73.5113.917700000111
22S49.8Very low46.8Very low115 Ų115145.8 Ų145.880%0.80479%0.793SS**PPolyproline II helixtrans-80.4134.4165.4178.10000109.4T20 G24T20-S22 PolarHBondContact O-N 3.48Å; S22-G24 PolarHBondContact O-N 3.35Å
23V46.4Very low46.1Very low140 Ų140143.4 Ų143.485%0.84879%0.791SS**PPolyproline II helixtrans-71.7121.5168.3175.70000107.8
24G41.1Very low45.6Very low65 Ų65140.4 Ų140.467%0.6779%0.785SS**PPolyproline II helixtrans-91.2134.2174.100000111S22S22-G24 PolarHBondContact O-N 3.35Å
25Q41.8Very low45Very low164 Ų164138.3 Ų138.377%0.76678%0.781SS**  trans-92.1113.1-179.9176.3179.1-11.900109
26D41.9Very low44.7Very low163 Ų163136.4 Ų136.487%0.87278%0.777SS**  trans-88.3106.7172.2-73.5-32.6000109.5
27N47.1Very low44.8Very low125 Ų125133 Ų13367%0.66877%0.774SS**  trans-78.1120.8168.5-80.5-27.1000109.5
28N46.5Very low43.9Very low168 Ų168132.9 Ų132.990%0.89878%0.783SS**  trans-110.4115.6165.5-98.9-18.5000110
29N44.7Very low43.7Very low138 Ų138133.5 Ų133.574%0.73879%0.788SS**  trans-75.3128.8174.9-68.1-30.1000110.4
30N45.4Very low43.4Very low165 Ų165126.6 Ų126.688%0.88278%0.782SS**  trans-135.5109.9153.1-91.4-19.7000108.1
31I41.8Very low43Very low161 Ų161127 Ų12783%0.82678%0.778SS**  trans-96112175.4-65.7168.3000106.8
32T42.9Very low42.9Very low139 Ų139131.5 Ų131.585%0.85378%0.782SS**  trans-151.3118160.5-41.20000111
33G40.6Very low42.8Very low63 Ų63131 Ų13165%0.64978%0.775SS**  trans62.292.2140.700000120
34S38.5Very low42.6Very low109 Ų109128.4 Ų128.476%0.76278%0.777SS**  31.4139.2124.564.20000122.6
35I43.6Very low43Very low146 Ų146132.3 Ų132.375%0.74978%0.78SS**  trans119103.2145.1-55166.3000116.1
36N42.6Very low43.3Very low131 Ų131133.3 Ų133.370%0.70179%0.785SS**  trans47.3120.9134.4-58.4-13000124.3
37I41.4Very low43.5Very low157 Ų157133.9 Ų133.981%0.80578%0.783SS**  46.9112.7120.2-47.6161.8000117.5
38S41.8Very low43.2Very low110 Ų110136.9 Ų136.977%0.76979%0.793SS**  -171.3149.4119.7-1610000112.3
39S39.5Very low42.9Very low113 Ų113132.9 Ų132.979%0.7978%0.778SS**  trans-47.4152.4178.352.60000117.5
40G44.7Very low42.7Very low67 Ų67130.6 Ų130.669%0.69177%0.773SS**  trans136.3124.7139.500000116.5
41I39.3Very low42.8Very low147 Ų147128.6 Ų128.675%0.75476%0.761SS**  trans87.495.3151.1-49.6167.3000115.8T43I41-T43 HydrophobicContact CG2-CG2 3.71Å; I41-T43 PolarHBondContact O-N 3.16Å
42N40.2Very low43Very low175 Ų175131.5 Ų131.594%0.93676%0.761SS**  trans-69.9105.4154.3-70.8-41.3000108.9
43T47.9Very low43.3Very low105 Ų105133.8 Ų133.864%0.64475%0.754SS**  trans-118.8117.415844.60000108.1I41 I45I41-T43 HydrophobicContact CG2-CG2 3.71Å; I41-T43 PolarHBondContact O-N 3.16Å; T43-I45 PolarHBondContact O-N 3.47Å
44G41Very low43.8Very low86 Ų86135.1 Ų135.189%0.88776%0.759SS**  trans-62.5106.6177.200000110.2
45I49.1Very low44.2Very low146 Ų146133.5 Ų133.575%0.74975%0.748SS**  trans-99.3106.9160.9-61.4-174.3000105.7T43 Q47T43-I45 PolarHBondContact O-N 3.47Å; I45-Q47 VanDerWaalsContact C-N 3.27Å; I45-Q47 PolarHBondContact O-N 2.93Å
46Q48.3Very low44.6Very low186 Ų186129.1 Ų129.187%0.86973%0.728SS**  trans-54.596.5163.4-75.9-179.2-19.200107.8Q48Q46-Q48 PolarHBondContact O-N 3.34Å
47Q45.8Very low45.1Very low175 Ų175124.4 Ų124.482%0.81870%0.702SS**  trans-77.280.9173.5-146.6172.246.700106.8I45 S49I45-Q47 VanDerWaalsContact C-N 3.27Å; I45-Q47 PolarHBondContact O-N 2.93Å; Q47-S49 PolarHBondContact O-N 3.48Å
48Q42.2Very low45.8Very low187 Ų187124.3 Ų124.387%0.87470%0.698SS**  trans-71.271.7166-161.2174.462.500107Q46 S50Q46-Q48 PolarHBondContact O-N 3.34Å; Q48-S50 PolarHBondContact O-N 3.48Å
49S39.4Very low47Very low85 Ų85127 Ų12759%0.59470%0.696SS**  trans-71.487.7171.961.60000107.6Q47 I51Q47-S49 PolarHBondContact O-N 3.48Å; S49-I51 PolarHBondContact O-N 2.96Å
50S41.5Very low48.8Very low90 Ų90126 Ų12663%0.62968%0.675SS**  trans-62.594.1154.6176.90000106.2Q48 R52Q48-S50 PolarHBondContact O-N 3.48Å; S50-R52 PolarHBondContact O-N 3.03Å
51I47.7Very low50.8Low122 Ų122126.3 Ų126.363%0.62666%0.66SS**  trans-63.388.6163.6-59.4175.4000105S49 R53S49-I51 PolarHBondContact O-N 2.96Å; I51-R53 HydrophobicContact CG2-CG 3.76Å; I51-R53 PolarHBondContact O-N 3.01Å
52R44.3Very low53.2Low222 Ų222120.6 Ų120.684%0.83864%0.637SS**  trans-66.482.9162.4-79.3-164.6-86.4-108.62.4106.2S50 A54S50-R52 PolarHBondContact O-N 3.03Å; R52-A54 PolarHBondContact O-N 3.2Å
53R49.3Very low55.7Low188 Ų188118 Ų11871%0.70962%0.619SS**  trans-52.7114.8172.7-67.4-175.6-172.8102.9-0.6106.2I51 S55I51-R53 HydrophobicContact CG2-CG 3.76Å; I51-R53 PolarHBondContact O-N 3.01Å; R53-S55 PolarHBondContact O-N 3.33Å
54A50.9Low57.7Low90 Ų90116.6 Ų116.674%0.74461%0.607SS**  trans-47.2128.8165.100000106.8R52 V56R52-A54 PolarHBondContact O-N 3.2Å; A54-V56 PolarHBondContact O-N 3.04Å
55S46.9Very low60.2Low76 Ų76119.1 Ų119.153%0.53160%0.596SS.*  trans-52.2103.5-16947.90000110.2R53 M57 Q58R53-S55 PolarHBondContact O-N 3.33Å; S55-M57 PolarHBondContact O-N 2.83Å; S55-Q58 PolarHBondContact O-N 2.97Å
56V53.4Low62.1Low54 Ų54116.6 Ų116.633%0.32758%0.58SS.*G310 helixtrans-56.7-18.8-175.4174.70000112A54 Q58 K59 Y60A54-V56 PolarHBondContact O-N 3.04Å; V56-Q58 VanDerWaalsContact C-N 3.27Å; V56-Q58 PolarHBondContact O-N 3.26Å; V56-K59 PolarHBondContact O-N 2.6Å; V56-Y60 HydrophobicContact CG1-CD2 4.09Å; V56-Y60 HydrophobicContact CG1-CE2 3.95Å
57M52.2Low64Low31 Ų31114.6 Ų114.615%0.15358%0.58CS.*G310 helixtrans-47-43.5174.2-60.3-87.197.900113.5S55 K59 L78 T82 I86 I90S55-M57 PolarHBondContact O-N 2.83Å; M57-K59 PolarHBondContact O-N 3.3Å; M57-L78 HydrophobicContact CE-CB 3.97Å; M57-L78 HydrophobicContact CE-CD2 3.33Å; M57-L78 HydrophobicContact CE-CG 4.23Å; M57-L78 HydrophobicContact SD-CD2 3.39Å; M57-L78 WeakPolarHBondContact SD-CD2 3.25Å; M57-T82 HydrophobicContact CE-CG2 3.94Å; M57-T82 WeakPolarHBondContact CE-OG1 3.34Å; M57-T82 HydrophobicContact SD-CG2 3.87Å; M57-I86 HydrophobicContact SD-CG2 3.84Å; M57-I90 HydrophobicContact SD-CD1 4.45Å
58Q57.2Low66.1Low155 Ų155110.1 Ų110.172%0.72458%0.581SS**G310 helixtrans-72.1-29.4-174.1-75.6-176.8-54.400113S55 V56 Y60S55-Q58 PolarHBondContact O-N 2.97Å; V56-Q58 VanDerWaalsContact C-N 3.27Å; V56-Q58 PolarHBondContact O-N 3.26Å; Q58-Y60 PolarHBondContact O-N 3.23Å; Q58-Y60 VanDerWaalsContact O-N 3.15Å
59K65.4Low67.9Low166 Ų166105.9 Ų105.972%0.72256%0.564SS**G310 helixtrans-67.8-16.3-176.2-172.8166.3177.1171.30112.9V56 M57V56-K59 PolarHBondContact O-N 2.6Å; M57-K59 PolarHBondContact O-N 3.3Å
60Y77.5Confident70.2Confident92 Ų92109.8 Ų109.836%0.36158%0.578SS.*G310 helixtrans-137.534.4-170.8-57.5-70.5000113.4V56 Q58 C76 K77V56-Y60 HydrophobicContact CG1-CD2 4.09Å; V56-Y60 HydrophobicContact CG1-CE2 3.95Å; Q58-Y60 PolarHBondContact O-N 3.23Å; Q58-Y60 VanDerWaalsContact O-N 3.15Å; Y60-C76 WeakPolarHBondContact O-CA 3.31Å; Y60-K77 VanDerWaalsContact CB-CB 3.44Å; Y60-K77 HydrophobicContact CD1-CD 4.39Å; Y60-K77 HydrophobicContact CD2-CD 3.97Å; Y60-K77 HydrophobicContact CE2-CD 4.48Å; Y60-K77 HydrophobicContact CG-CB 4.16Å; Y60-K77 HydrophobicContact CG-CD 3.92Å; Y60-K77 PolarHBondContact O-N 2.82Å
61M86.8Confident72.3Confident75 Ų75111.6 Ų111.637%0.36958%0.577SS.*EExtended strand (participates in β ladder)trans-110.3134.4169.5-173.4162.368.700109.9F75 C76 I90M61-F75 WeakPolarHBondContact CA-O 3.26Å; M61-C76 HydrophobicContact CB-CB 4.22Å; M61-C76 HydrophobicContact CG-CB 3.98Å; M61-C76 HydrophobicContact SD-CB 4.17Å; M61-I90 HydrophobicContact SD-CG2 4.39Å
62G89.9Confident74.3Confident27 Ų27109.7 Ų109.728%0.27857%0.571SS.*EExtended strand (participates in β ladder)trans-172.3-167.8-176.500000113.8F75G62-F75 VanDerWaalsContact C-CE1 3.49Å; G62-F75 PolarHBondContact N-O 3.5Å; G62-F75 WeakPolarHBondContact O-CD1 3.42Å; G62-F75 PolarHBondContact O-N 2.86Å
63E92.2Very high76.5Confident119 Ų119100.9 Ų100.956%0.55655%0.546SS*.EExtended strand (participates in β ladder)trans-123.1141176.6-73.2-175.1174.600109.5T72 A73 R74E63-T72 HydrophobicContact CB-CG2 3.76Å; E63-T72 HydrophobicContact CG-CG2 4.28Å; E63-A73 CarbonylContact C-O 3.54Å; E63-A73 VanDerWaalsContact CA-O 3.31Å; E63-A73 WeakPolarHBondContact CA-O 3.37Å; E63-R74 HydrophobicContact CG-CG 3.64Å; E63-R74 WeakPolarHBondContact OE1-CG 3.42Å; E63-R74 IonicContact OE1-CZ 3.57Å; E63-R74 IonicContact OE1-NE 2.85Å; E63-R74 PolarHBondContact OE1-NE 2.83Å; E63-R74 IonicContact OE1-NH2 2.75Å
64I91.1Very high78.5Confident77 Ų7797.9 Ų97.940%0.39553%0.534SS..EExtended strand (participates in β ladder)trans-117.6124.3174.6-175.7170.9000108.7F66 T72 A73 F75I64-F66 HydrophobicContact CD1-CE1 4.25Å; I64-F66 HydrophobicContact CD1-CZ 4.48Å; I64-F66 HydrophobicContact CG2-CE2 4.01Å; I64-F66 HydrophobicContact CG2-CZ 3.95Å; I64-T72 CarbonylContact O-C 3.56Å; I64-T72 WeakPolarHBondContact O-CA 3.35Å; I64-A73 HydrophobicContact CG2-CB 3.94Å; I64-A73 PolarHBondContact N-O 2.91Å; I64-A73 PolarHBondContact O-N 2.93Å; I64-F75 HydrophobicContact CB-CD1 4.27Å; I64-F75 HydrophobicContact CB-CE1 4.28Å; I64-F75 HydrophobicContact CG2-CD1 4.22Å
65E92.8Very high80.5Confident139 Ų13998.3 Ų98.365%0.6552%0.52SS*.EExtended strand (participates in β ladder)trans-95.3126.8170.8-173-179.1168.300108.9T67E65-T67 PolarHBondContact O-N 3.29Å
66F90.1Very high82.6Confident93 Ų9396.1 Ų96.141%0.40850%0.504SS..  trans-88.1108.3179.9-67.1-81.6000109.9I64 G68 L69 Q71 A73I64-F66 HydrophobicContact CD1-CE1 4.25Å; I64-F66 HydrophobicContact CD1-CZ 4.48Å; I64-F66 HydrophobicContact CG2-CE2 4.01Å; I64-F66 HydrophobicContact CG2-CZ 3.95Å; F66-G68 PolarHBondContact O-N 2.87Å; F66-G68 VanDerWaalsContact O-N 3.16Å; F66-L69 HydrophobicContact CB-CB 3.97Å; F66-L69 HydrophobicContact CB-CD1 4.11Å; F66-L69 HydrophobicContact CB-CG 4.43Å; F66-L69 CarbonylContact O-C 3.43Å; F66-L69 PolarHBondContact O-N 3.41Å; F66-Q71 PolarHBondContact N-O 2.99Å; F66-A73 HydrophobicContact CE2-CB 3.78Å; F66-A73 HydrophobicContact CZ-CB 4.49Å
67T87.2Confident84.4Confident144 Ų14499.1 Ų99.188%0.88351%0.513SS*.THydrogen-bonded Turntrans-54.6124.7178.557.20000111.4E65 L69E65-T67 PolarHBondContact O-N 3.29Å; T67-L69 VanDerWaalsContact C-N 3.34Å
68G90.9Very high86.1Confident81 Ų81100.6 Ų100.684%0.83552%0.521SS*.THydrogen-bonded Turntrans87.5-4.7-178.100000115.2F66F66-G68 PolarHBondContact O-N 2.87Å; F66-G68 VanDerWaalsContact O-N 3.16Å
69L80.1Confident87.6Confident97 Ų9797 Ų9751%0.50851%0.506SS..SBendtrans-123.3108.3169.2-56.7173.6000105.2F66 T67 Q71F66-L69 HydrophobicContact CB-CB 3.97Å; F66-L69 HydrophobicContact CB-CD1 4.11Å; F66-L69 HydrophobicContact CB-CG 4.43Å; F66-L69 CarbonylContact O-C 3.43Å; F66-L69 PolarHBondContact O-N 3.41Å; T67-L69 VanDerWaalsContact C-N 3.34Å; L69-Q71 HydrophobicContact CB-CB 4.49Å; L69-Q71 PolarHBondContact O-N 3.29Å
70N86.2Confident88.7Confident167 Ų16795.3 Ų95.389%0.89352%0.515SS*.  trans-66.259.6180-64.4-30.1000112.1
71Q86.5Confident89.3Confident128 Ų12898.9 Ų98.960%0.59854%0.535SS*.  trans-144.3128.8-167.9-71-175.383.200108.1F66 L69F66-Q71 PolarHBondContact N-O 2.99Å; L69-Q71 HydrophobicContact CB-CB 4.49Å; L69-Q71 PolarHBondContact O-N 3.29Å
72T88.5Confident89.4Confident83 Ų8396.7 Ų96.751%0.50953%0.526SS..EExtended strand (participates in β ladder)trans-112.1133.3175.8-54.20000108.5E63 I64E63-T72 HydrophobicContact CB-CG2 3.76Å; E63-T72 HydrophobicContact CG-CG2 4.28Å; I64-T72 CarbonylContact O-C 3.56Å; I64-T72 WeakPolarHBondContact O-CA 3.35Å
73A90.6Very high89.5Confident37 Ų3799 Ų9931%0.30654%0.536SS..EExtended strand (participates in β ladder)trans-113.1140.1174.400000111.1E63 I64 F66E63-A73 CarbonylContact C-O 3.54Å; E63-A73 VanDerWaalsContact CA-O 3.31Å; E63-A73 WeakPolarHBondContact CA-O 3.37Å; I64-A73 HydrophobicContact CG2-CB 3.94Å; I64-A73 PolarHBondContact N-O 2.91Å; I64-A73 PolarHBondContact O-N 2.93Å; F66-A73 HydrophobicContact CE2-CB 3.78Å; F66-A73 HydrophobicContact CZ-CB 4.49Å
74R91.9Very high89.5Confident125 Ų12598.3 Ų98.347%0.47254%0.536SS..EExtended strand (participates in β ladder)trans-86.1138.2171.5-71.9170.2177.8173.71.5109.9E63 W95E63-R74 HydrophobicContact CG-CG 3.64Å; E63-R74 WeakPolarHBondContact OE1-CG 3.42Å; E63-R74 IonicContact OE1-CZ 3.57Å; E63-R74 IonicContact OE1-NE 2.85Å; E63-R74 PolarHBondContact OE1-NE 2.83Å; E63-R74 IonicContact OE1-NH2 2.75Å; R74-W95 HydrophobicContact CB-CD2 4.16Å; R74-W95 HydrophobicContact CB-CZ2 3.96Å; R74-W95 PolarHBondContact NH1-O 3.2Å; R74-W95 VanDerWaalsContact NH1-O 3.1Å
75F92.7Very high89.6Confident99 Ų9997.2 Ų97.243%0.43454%0.536SS..EExtended strand (participates in β ladder)trans-135.3152.8176.571-89.5000111.4M61 G62 I64M61-F75 WeakPolarHBondContact CA-O 3.26Å; G62-F75 VanDerWaalsContact C-CE1 3.49Å; G62-F75 PolarHBondContact N-O 3.5Å; G62-F75 WeakPolarHBondContact O-CD1 3.42Å; G62-F75 PolarHBondContact O-N 2.86Å; I64-F75 HydrophobicContact CB-CD1 4.27Å; I64-F75 HydrophobicContact CB-CE1 4.28Å; I64-F75 HydrophobicContact CG2-CD1 4.22Å
76C91.4Very high89.5Confident29 Ų2993.7 Ų93.720%0.19652%0.521CS..EExtended strand (participates in β ladder)trans-144.4129.5170.8-178.50000108.8Y60 M61 W95Y60-C76 WeakPolarHBondContact O-CA 3.31Å; M61-C76 HydrophobicContact CB-CB 4.22Å; M61-C76 HydrophobicContact CG-CB 3.98Å; M61-C76 HydrophobicContact SD-CB 4.17Å; C76-W95 HydrophobicContact CB-CZ2 4.17Å
77K90.6Very high89.6Confident118 Ų11892.6 Ų92.651%0.51352%0.518SS..  trans-81125172.1-173.9-177.2177.9177.80109.5Y60Y60-K77 VanDerWaalsContact CB-CB 3.44Å; Y60-K77 HydrophobicContact CD1-CD 4.39Å; Y60-K77 HydrophobicContact CD2-CD 3.97Å; Y60-K77 HydrophobicContact CE2-CD 4.48Å; Y60-K77 HydrophobicContact CG-CB 4.16Å; Y60-K77 HydrophobicContact CG-CD 3.92Å; Y60-K77 PolarHBondContact O-N 2.82Å
78L88.6Confident89.8Confident62 Ų6292.8 Ų92.833%0.32550%0.503SS..  trans-109151.5175.4-50.4179.8000111.6M57 T82 L87 I90M57-L78 HydrophobicContact CE-CB 3.97Å; M57-L78 HydrophobicContact CE-CD2 3.33Å; M57-L78 HydrophobicContact CE-CG 4.23Å; M57-L78 HydrophobicContact SD-CD2 3.39Å; M57-L78 WeakPolarHBondContact SD-CD2 3.25Å; L78-T82 HydrophobicContact CD2-CG2 4.46Å; L78-L87 HydrophobicContact CD1-CD1 3.98Å; L78-I90 HydrophobicContact CD2-CD1 3.89Å
79N88Confident89.8Confident79 Ų7992.1 Ų92.142%0.42248%0.48SS..  trans-84.7154.4167.8-65.2-15.4000109.3E81 T82N79-E81 PolarHBondContact O-N 3.48Å; N79-T82 PolarHBondContact N-OG1 3.18Å; N79-T82 VanDerWaalsContact O-CB 3.23Å; N79-T82 WeakPolarHBondContact O-CB 3.31Å; N79-T82 PolarHBondContact O-N 2.96Å; N79-T82 PolarHBondContact O-OG1 2.94Å
80S89.6Confident90.4Very high130 Ų13088.1 Ų88.191%0.90946%0.459SS*.THydrogen-bonded Turntrans-59.9-26176.850.20000113.9T82S80-T82 VanDerWaalsContact C-N 3.31Å
81E90.4Very high90.7Very high168 Ų16882.4 Ų82.479%0.78543%0.428SS*.THydrogen-bonded Turntrans-86.10.7177.5-62.6172.6-172.900113.2N79 P83N79-E81 PolarHBondContact O-N 3.48Å; E81-P83 WeakPolarHBondContact O-CD 3.31Å
82T88.8Confident91Very high28 Ų2883.1 Ų83.117%0.17243%0.43CS..  trans-69.7121.3-177.9-49.90000109.2M57 L78 N79 S80 I86M57-T82 HydrophobicContact CE-CG2 3.94Å; M57-T82 WeakPolarHBondContact CE-OG1 3.34Å; M57-T82 HydrophobicContact SD-CG2 3.87Å; L78-T82 HydrophobicContact CD2-CG2 4.46Å; N79-T82 PolarHBondContact N-OG1 3.18Å; N79-T82 VanDerWaalsContact O-CB 3.23Å; N79-T82 WeakPolarHBondContact O-CB 3.31Å; N79-T82 PolarHBondContact O-N 2.96Å; N79-T82 PolarHBondContact O-OG1 2.94Å; S80-T82 VanDerWaalsContact C-N 3.31Å; T82-I86 HydrophobicContact CG2-CB 3.91Å; T82-I86 HydrophobicContact CG2-CG1 4.44Å; T82-I86 HydrophobicContact CG2-CG2 3.98Å
83P92Very high91.1Very high75 Ų7587.6 Ų87.649%0.48744%0.437SS..  trans-71.2147.3-179.527.8-32.5000111.3E81 S85 I86E81-P83 WeakPolarHBondContact O-CD 3.31Å; P83-S85 PolarHBondContact O-N 3.46Å; P83-I86 HydrophobicContact CG-CG1 3.92Å; P83-I86 WeakPolarHBondContact O-CB 3.37Å; P83-I86 PolarHBondContact O-N 3.15Å
84D91.6Very high91.2Very high105 Ų10592.3 Ų92.356%0.56145%0.451SS*.Hα-helixtrans-58.3-23.4-178.3-64.7-6.5000114.1I86 L87 R88D84-I86 PolarHBondContact O-N 2.92Å; D84-L87 PolarHBondContact O-N 3.38Å; D84-R88 VanDerWaalsContact CB-NH1 3.31Å; D84-R88 WeakPolarHBondContact O-CG 3.49Å; D84-R88 PolarHBondContact O-N 3.12Å
85S92.8Very high91.2Very high55 Ų5589.1 Ų89.139%0.38544%0.439SS..Hα-helixtrans-58.5-38.6174.5530000111.8P83 R88 D89P83-S85 PolarHBondContact O-N 3.46Å; S85-R88 PolarHBondContact O-N 3.36Å; S85-D89 WeakPolarHBondContact O-CB 3.39Å; S85-D89 PolarHBondContact O-N 2.98Å
86I91.5Very high91.2Very high65 Ų6587.3 Ų87.333%0.33345%0.448SS..Hα-helixtrans-69.6-41.3177-59.7-63.9000110.4M57 T82 P83 D84 D89 I90M57-I86 HydrophobicContact SD-CG2 3.84Å; T82-I86 HydrophobicContact CG2-CB 3.91Å; T82-I86 HydrophobicContact CG2-CG1 4.44Å; T82-I86 HydrophobicContact CG2-CG2 3.98Å; P83-I86 HydrophobicContact CG-CG1 3.92Å; P83-I86 WeakPolarHBondContact O-CB 3.37Å; P83-I86 PolarHBondContact O-N 3.15Å; D84-I86 PolarHBondContact O-N 2.92Å; I86-D89 WeakPolarHBondContact O-CB 3.42Å; I86-D89 PolarHBondContact O-N 3.45Å; I86-I90 HydrophobicContact CG2-CD1 3.98Å; I86-I90 VanDerWaalsContact O-CG1 3.29Å; I86-I90 WeakPolarHBondContact O-CG1 3.23Å; I86-I90 PolarHBondContact O-N 2.98Å
87L91.3Very high91.2Very high69 Ų6989.8 Ų89.836%0.36146%0.459SS..Hα-helixtrans-60.1-47.3174.817761000110.9L78 D84 D89 I90 L91L78-L87 HydrophobicContact CD1-CD1 3.98Å; D84-L87 PolarHBondContact O-N 3.38Å; L87-D89 VanDerWaalsContact C-N 3.3Å; L87-D89 PolarHBondContact O-N 2.98Å; L87-I90 PolarHBondContact O-N 2.85Å; L87-L91 HydrophobicContact CD1-CD1 4.21Å; L87-L91 HydrophobicContact CD1-CG 4.16Å; L87-L91 HydrophobicContact CG-CD1 4.16Å; L87-L91 HydrophobicContact CG-CG 4.49Å; L87-L91 VanDerWaalsContact O-CG 3.31Å; L87-L91 WeakPolarHBondContact O-CG 3.45Å; L87-L91 PolarHBondContact O-N 2.98Å
88R90.8Very high91.2Very high149 Ų14990.8 Ų90.856%0.56246%0.463SS*.Hα-helixtrans-58.2-42.4176-73.5-172.5-73.1-91.24.4112D84 S85 L91 K92D84-R88 VanDerWaalsContact CB-NH1 3.31Å; D84-R88 WeakPolarHBondContact O-CG 3.49Å; D84-R88 PolarHBondContact O-N 3.12Å; S85-R88 PolarHBondContact O-N 3.36Å; R88-L91 PolarHBondContact O-N 2.7Å; R88-K92 VanDerWaalsContact O-CB 3.25Å; R88-K92 WeakPolarHBondContact O-CB 3.44Å; R88-K92 PolarHBondContact O-N 2.89Å
89D91.9Very high91.2Very high67 Ų6791.9 Ų91.936%0.35847%0.474SS..Hα-helixtrans-64.1-40.8176.2-92.414.7000112.7S85 I86 L87 R93 K94S85-D89 WeakPolarHBondContact O-CB 3.39Å; S85-D89 PolarHBondContact O-N 2.98Å; I86-D89 WeakPolarHBondContact O-CB 3.42Å; I86-D89 PolarHBondContact O-N 3.45Å; L87-D89 VanDerWaalsContact C-N 3.3Å; L87-D89 PolarHBondContact O-N 2.98Å; D89-R93 WeakPolarHBondContact O-CA 3.34Å; D89-R93 VanDerWaalsContact O-CB 3.23Å; D89-R93 WeakPolarHBondContact O-CB 3.42Å; D89-R93 PolarHBondContact O-N 3.05Å; D89-R93 IonicContact OD2-CZ 3.67Å; D89-R93 IonicContact OD2-NH2 3.65Å; D89-R93 PolarHBondContact OD2-NH2 2.8Å; D89-K94 PolarHBondContact O-N 3.42Å
90I92.5Very high91.3Very high13 Ų1390.5 Ų90.57%0.06747%0.469CS..Iπ-helixtrans-62.3-53.1175.8-68.7163.1000109.6M57 M61 L78 I86 L87 K92 K94 W95M57-I90 HydrophobicContact SD-CD1 4.45Å; M61-I90 HydrophobicContact SD-CG2 4.39Å; L78-I90 HydrophobicContact CD2-CD1 3.89Å; I86-I90 HydrophobicContact CG2-CD1 3.98Å; I86-I90 VanDerWaalsContact O-CG1 3.29Å; I86-I90 WeakPolarHBondContact O-CG1 3.23Å; I86-I90 PolarHBondContact O-N 2.98Å; L87-I90 PolarHBondContact O-N 2.85Å; I90-K92 PolarHBondContact O-N 3.04Å; I90-K94 WeakPolarHBondContact O-CA 3.48Å; I90-K94 WeakPolarHBondContact O-CB 3.38Å; I90-K94 PolarHBondContact O-N 2.9Å; I90-K94 VanDerWaalsContact O-N 3.11Å; I90-W95 HydrophobicContact CG2-CD2 4.07Å; I90-W95 HydrophobicContact CG2-CE3 4.5Å; I90-W95 HydrophobicContact CG2-CH2 4.38Å; I90-W95 HydrophobicContact CG2-CZ2 3.95Å; I90-W95 PolarHBondContact O-N 3.22Å
91L92.3Very high91.3Very high46 Ų4689.4 Ų89.424%0.24146%0.458CS..Iπ-helixtrans-58.9-46.5-178.3-64.3176.9000111.6L87 R88 W95 G96 L97L87-L91 HydrophobicContact CD1-CD1 4.21Å; L87-L91 HydrophobicContact CD1-CG 4.16Å; L87-L91 HydrophobicContact CG-CD1 4.16Å; L87-L91 HydrophobicContact CG-CG 4.49Å; L87-L91 VanDerWaalsContact O-CG 3.31Å; L87-L91 WeakPolarHBondContact O-CG 3.45Å; L87-L91 PolarHBondContact O-N 2.98Å; R88-L91 PolarHBondContact O-N 2.7Å; L91-W95 HydrophobicContact CD2-CE3 3.51Å; L91-W95 HydrophobicContact CD2-CZ3 3.5Å; L91-G96 PolarHBondContact O-N 2.9Å; L91-L97 HydrophobicContact CB-CD1 4.27Å; L91-L97 HydrophobicContact CD2-CD1 3.91Å; L91-L97 VanDerWaalsContact O-CB 3.31Å; L91-L97 WeakPolarHBondContact O-CB 3.39Å; L91-L97 WeakPolarHBondContact O-CG 3.46Å; L91-L97 PolarHBondContact O-N 3.46Å
92K92.5Very high91.3Very high143 Ų14385.5 Ų85.562%0.62244%0.441SS*.Iπ-helixtrans-80.5-54.3-175.2-173.6179.6179.6-177.90113.1R88 I90 G96R88-K92 VanDerWaalsContact O-CB 3.25Å; R88-K92 WeakPolarHBondContact O-CB 3.44Å; R88-K92 PolarHBondContact O-N 2.89Å; I90-K92 PolarHBondContact O-N 3.04Å; K92-G96 VanDerWaalsContact O-CA 3.25Å; K92-G96 WeakPolarHBondContact O-CA 3.25Å; K92-G96 PolarHBondContact O-N 3.02Å
93R92.3Very high91.3Very high178 Ų17889.1 Ų89.167%0.67246%0.459SS*.Iπ-helixtrans-90.1-36.7-168.2-178.916953.8161.3-5.8112.8D89D89-R93 WeakPolarHBondContact O-CA 3.34Å; D89-R93 VanDerWaalsContact O-CB 3.23Å; D89-R93 WeakPolarHBondContact O-CB 3.42Å; D89-R93 PolarHBondContact O-N 3.05Å; D89-R93 IonicContact OD2-CZ 3.67Å; D89-R93 IonicContact OD2-NH2 3.65Å; D89-R93 PolarHBondContact OD2-NH2 2.8Å
94K90.8Very high91.3Very high136 Ų13687.3 Ų87.359%0.59144%0.444SS*.Iπ-helixtrans-87.5-42.8-180-64.3-65.2-173.3178.70112.2D89 I90D89-K94 PolarHBondContact O-N 3.42Å; I90-K94 WeakPolarHBondContact O-CA 3.48Å; I90-K94 WeakPolarHBondContact O-CB 3.38Å; I90-K94 PolarHBondContact O-N 2.9Å; I90-K94 VanDerWaalsContact O-N 3.11Å
95W93Very high91.3Very high57 Ų5785.6 Ų85.622%0.21644%0.438CS..SBendtrans-95.1-10.7-178.4-63.3-10.5000114R74 C76 I90 L91 L97R74-W95 HydrophobicContact CB-CD2 4.16Å; R74-W95 HydrophobicContact CB-CZ2 3.96Å; R74-W95 PolarHBondContact NH1-O 3.2Å; R74-W95 VanDerWaalsContact NH1-O 3.1Å; C76-W95 HydrophobicContact CB-CZ2 4.17Å; I90-W95 HydrophobicContact CG2-CD2 4.07Å; I90-W95 HydrophobicContact CG2-CE3 4.5Å; I90-W95 HydrophobicContact CG2-CH2 4.38Å; I90-W95 HydrophobicContact CG2-CZ2 3.95Å; I90-W95 PolarHBondContact O-N 3.22Å; L91-W95 HydrophobicContact CD2-CE3 3.51Å; L91-W95 HydrophobicContact CD2-CZ3 3.5Å; W95-L97 VanDerWaalsContact C-N 3.25Å; W95-L97 HydrophobicContact CB-CG 4.08Å; W95-L97 HydrophobicContact CE3-CD1 4.27Å; W95-L97 PolarHBondContact O-N 3.22Å
96G92.2Very high91.1Very high61 Ų6184.5 Ų84.563%0.62943%0.429SS*.  trans70.221.317600000113.5L91 K92 K98L91-G96 PolarHBondContact O-N 2.9Å; K92-G96 VanDerWaalsContact O-CA 3.25Å; K92-G96 WeakPolarHBondContact O-CA 3.25Å; K92-G96 PolarHBondContact O-N 3.02Å; G96-K98 PolarHBondContact O-N 3.04Å
97L91.3Very high91Very high82 Ų8288 Ų8843%0.42944%0.442SS..PPolyproline II helixtrans-71.5132.6-179.1-57.7-179.6000110L91 W95L91-L97 HydrophobicContact CB-CD1 4.27Å; L91-L97 HydrophobicContact CD2-CD1 3.91Å; L91-L97 VanDerWaalsContact O-CB 3.31Å; L91-L97 WeakPolarHBondContact O-CB 3.39Å; L91-L97 WeakPolarHBondContact O-CG 3.46Å; L91-L97 PolarHBondContact O-N 3.46Å; W95-L97 VanDerWaalsContact C-N 3.25Å; W95-L97 HydrophobicContact CB-CG 4.08Å; W95-L97 HydrophobicContact CE3-CD1 4.27Å; W95-L97 PolarHBondContact O-N 3.22Å
98K90.2Very high90.7Very high139 Ų13987.2 Ų87.260%0.60445%0.451SS*.PPolyproline II helixtrans-65.2140.3170.6-176.3171.5165.8-174.20109.2G96 S134G96-K98 PolarHBondContact O-N 3.04Å; K98-S134 VanDerWaalsContact CD-OG 3.29Å; K98-S134 WeakPolarHBondContact CD-OG 3.44Å
99P88.9Confident90.3Very high84 Ų8486.1 Ų86.155%0.54546%0.46SS..PPolyproline II helixtrans-53.8126174.4-26.435.1000110.8
100P89.6Confident89.6Confident50 Ų5089 Ų8933%0.32548%0.476SS..PPolyproline II helixtrans-71143.6-178.628.3-34000111.5I103 S134 L136P100-I103 HydrophobicContact CB-CG1 4.47Å; P100-I103 HydrophobicContact CG-CD1 4.44Å; P100-I103 HydrophobicContact CG-CG1 4.09Å; P100-S134 WeakPolarHBondContact CA-O 3.31Å; P100-S134 WeakPolarHBondContact CB-O 3.29Å; P100-L136 HydrophobicContact CB-CB 3.68Å; P100-L136 HydrophobicContact CG-CB 3.96Å; P100-L136 HydrophobicContact CG-CD2 4.17Å
101T90.2Very high88.8Confident108 Ų10893 Ų9366%0.66349%0.493SS*.SBendtrans-88.3-21.3174.554.40000112.3S134T101-S134 PolarHBondContact N-O 3.04Å
102L89.9Confident87.8Confident85 Ų8599 Ų9945%0.44552%0.52SS..EExtended strand (participates in β ladder)trans-141131.3178.6179.763.8000108.9I104 L136L102-I104 HydrophobicContact CD2-CD1 4.12Å; L102-I104 HydrophobicContact CD2-CG1 4.1Å; L102-I104 HydrophobicContact CG-CG1 4.06Å; L102-L136 PolarHBondContact O-N 2.84Å
103I90.5Very high86.9Confident105 Ų105101.8 Ų101.854%0.53853%0.532SS..EExtended strand (participates in β ladder)trans-111123.6173.4-59.5174.1000107.2P100 V138P100-I103 HydrophobicContact CB-CG1 4.47Å; P100-I103 HydrophobicContact CG-CD1 4.44Å; P100-I103 HydrophobicContact CG-CG1 4.09Å; I103-V138 HydrophobicContact CG2-CG2 4.26Å
104I90.2Very high86.4Confident36 Ų3699.9 Ų99.919%0.18553%0.529CS..EExtended strand (participates in β ladder)trans-111.9115.1175.4-53.6173.4000107.6L102 V106 L125 A128 L136 V138L102-I104 HydrophobicContact CD2-CD1 4.12Å; L102-I104 HydrophobicContact CD2-CG1 4.1Å; L102-I104 HydrophobicContact CG-CG1 4.06Å; I104-V106 HydrophobicContact CG2-CG2 4.29Å; I104-L125 HydrophobicContact CB-CD1 4.4Å; I104-L125 HydrophobicContact CD1-CD1 3.94Å; I104-L125 HydrophobicContact CG2-CD1 3.7Å; I104-A128 HydrophobicContact CD1-CB 3.91Å; I104-L136 PolarHBondContact N-O 2.83Å; I104-V138 PolarHBondContact O-N 3.38Å
105T91.9Very high86.1Confident69 Ų69104.3 Ų104.342%0.42354%0.541SS..EExtended strand (participates in β ladder)trans-101.2123.9175.7-45.80000109.8F107 V138T105-F107 HydrophobicContact CG2-CD2 3.97Å; T105-F107 HydrophobicContact CG2-CE1 4.17Å; T105-F107 HydrophobicContact CG2-CE2 3.22Å; T105-F107 HydrophobicContact CG2-CZ 3.34Å; T105-V138 WeakPolarHBondContact CA-O 3.42Å; T105-V138 HydrophobicContact CG2-CB 4.43Å; T105-V138 HydrophobicContact CG2-CG1 4.47Å
106V88.9Confident86Confident32 Ų32109.2 Ų109.219%0.19457%0.565CS.*EExtended strand (participates in β ladder)trans-110.5123178.6-176.60000109I104 F121 L125 V138 Q140I104-V106 HydrophobicContact CG2-CG2 4.29Å; V106-F121 HydrophobicContact CG1-CE1 4.35Å; V106-F121 HydrophobicContact CG1-CZ 3.98Å; V106-F121 HydrophobicContact CG2-CZ 4.36Å; V106-L125 HydrophobicContact CG2-CD2 4.11Å; V106-V138 PolarHBondContact N-O 2.99Å; V106-Q140 PolarHBondContact O-N 2.75Å
107F89.3Confident85.8Confident139 Ų139110 Ų11061%0.6155%0.554SS**EExtended strand (participates in β ladder)trans-118.1139.2173.4-59.8-86.4000109.4T105 Q140T105-F107 HydrophobicContact CG2-CD2 3.97Å; T105-F107 HydrophobicContact CG2-CE1 4.17Å; T105-F107 HydrophobicContact CG2-CE2 3.22Å; T105-F107 HydrophobicContact CG2-CZ 3.34Å; F107-Q140 HydrophobicContact CD1-CB 3.97Å; F107-Q140 HydrophobicContact CD1-CG 4.44Å; F107-Q140 HydrophobicContact CE1-CB 3.99Å; F107-Q140 HydrophobicContact CE1-CG 4.37Å
108G85.9Confident85.7Confident53 Ų53111.4 Ų111.455%0.54656%0.556SS.*  trans146.1-179.6171.100000113.3
109T81.2Confident85.7Confident125 Ų125109.5 Ų109.577%0.76755%0.551SS**  trans-105178.3177.964.10000110.9
110D78.9Confident85.8Confident127 Ų127110.2 Ų110.268%0.67955%0.549SS*.  trans-58.8137.6177.4-76.6-54.9000114.1E112D110-E112 HydrophobicContact CB-CG 4.41Å; D110-E112 PolarHBondContact O-N 3.33Å
111F73.8Confident85.9Confident98 Ų98112.1 Ų112.143%0.4355%0.552SS.*  trans-91.672.7171.6-61.3-81.3000110.8L117F111-L117 HydrophobicContact CD1-CD2 4.43Å
112E71.9Confident85.9Confident171 Ų171113.9 Ų113.980%0.79955%0.551SS**  trans-67.9-39.6-177.6-75.7-177.1160.600113.1D110 K114D110-E112 HydrophobicContact CB-CG 4.41Å; D110-E112 PolarHBondContact O-N 3.33Å; E112-K114 PolarHBondContact O-N 2.94Å
113K73.1Confident86Confident203 Ų203116.3 Ų116.388%0.88356%0.558SS**SBendtrans-85.3-11.1-166.7-66172.8-176.8157.70115.1
114K82Confident86.1Confident138 Ų138113.4 Ų113.460%0.655%0.554SS**  trans-126.573.1-171.2-63.2-174.3-179.7-179.40112.3E112 K116 L117 K118E112-K114 PolarHBondContact O-N 2.94Å; K114-K116 VanDerWaalsContact C-N 3.28Å; K114-K116 PolarHBondContact O-N 2.9Å; K114-L117 HydrophobicContact CB-CB 3.75Å; K114-L117 HydrophobicContact CB-CD2 4.38Å; K114-L117 HydrophobicContact CD-CD2 3.93Å; K114-L117 PolarHBondContact O-N 3.1Å; K114-K118 PolarHBondContact O-N 3Å
115R85.8Confident86.2Confident228 Ų228113.2 Ų113.286%0.8655%0.553SS**Hα-helixtrans-51.2-42.3179.8-175.5175.6175.9149.4-1.7113.4K118 M119R115-K118 PolarHBondContact O-N 2.92Å; R115-M119 PolarHBondContact O-N 2.8Å
116K89.6Confident86.1Confident161 Ų161117.9 Ų117.970%0.756%0.563SS**Hα-helixtrans-64.5-43.4178.3-169.8174.4-178.4178.70111.8K114 M119 I120K114-K116 VanDerWaalsContact C-N 3.28Å; K114-K116 PolarHBondContact O-N 2.9Å; K116-M119 PolarHBondContact O-N 3Å; K116-I120 HydrophobicContact CG-CD1 3.93Å; K116-I120 VanDerWaalsContact O-CG1 3.31Å; K116-I120 WeakPolarHBondContact O-CG1 3.29Å; K116-I120 PolarHBondContact O-N 3.4Å
117L89Confident86.2Confident77 Ų77123.8 Ų123.840%0.40359%0.586SS.*Hα-helixtrans-65-45.8177.5-175.361.9000111.2F111 K114 M119 I120 F121F111-L117 HydrophobicContact CD1-CD2 4.43Å; K114-L117 HydrophobicContact CB-CB 3.75Å; K114-L117 HydrophobicContact CB-CD2 4.38Å; K114-L117 HydrophobicContact CD-CD2 3.93Å; K114-L117 PolarHBondContact O-N 3.1Å; L117-M119 VanDerWaalsContact C-N 3.26Å; L117-M119 PolarHBondContact O-N 3.17Å; L117-I120 PolarHBondContact O-N 2.73Å; L117-F121 VanDerWaalsContact O-CB 3.26Å; L117-F121 WeakPolarHBondContact O-CB 3.31Å; L117-F121 PolarHBondContact O-N 3.1Å
118K88.7Confident86.2Confident112 Ų112118.7 Ų118.749%0.48757%0.569SS.*Hα-helixtrans-55.7-42.2175.4-174.4171.3-176.1166.60111.6K114 R115 K122K114-K118 PolarHBondContact O-N 3Å; R115-K118 PolarHBondContact O-N 2.92Å; K118-K122 VanDerWaalsContact O-CB 3.25Å; K118-K122 WeakPolarHBondContact O-CB 3.23Å; K118-K122 PolarHBondContact O-N 3.18Å
119M90.8Very high86.2Confident98 Ų98117.3 Ų117.348%0.48355%0.553SS.*Hα-helixtrans-68.4-45.6178.3-175.1170.16600112.6R115 K116 L117 K123R115-M119 PolarHBondContact O-N 2.8Å; K116-M119 PolarHBondContact O-N 3Å; L117-M119 VanDerWaalsContact C-N 3.26Å; L117-M119 PolarHBondContact O-N 3.17Å; M119-K123 HydrophobicContact CG-CD 4.36Å; M119-K123 WeakPolarHBondContact O-CB 3.41Å; M119-K123 WeakPolarHBondContact O-CG 3.47Å; M119-K123 PolarHBondContact O-N 2.76Å
120I91.8Very high86.4Confident99 Ų99118 Ų11851%0.50855%0.547SS..Hα-helixtrans-64.2-46.8179-67.7167.1000110.2K116 L117 K122 K123 G124K116-I120 HydrophobicContact CG-CD1 3.93Å; K116-I120 VanDerWaalsContact O-CG1 3.31Å; K116-I120 WeakPolarHBondContact O-CG1 3.29Å; K116-I120 PolarHBondContact O-N 3.4Å; L117-I120 PolarHBondContact O-N 2.73Å; I120-K122 PolarHBondContact O-N 3.47Å; I120-K123 PolarHBondContact O-N 2.98Å; I120-G124 PolarHBondContact O-N 3.04Å
121F90.3Very high86.5Confident91 Ų91116.5 Ų116.540%0.39955%0.547SS..Hα-helixtrans-58.5-49.9177.7-178.4-102.6000111.5V106 L117 K123 G124 L125V106-F121 HydrophobicContact CG1-CE1 4.35Å; V106-F121 HydrophobicContact CG1-CZ 3.98Å; V106-F121 HydrophobicContact CG2-CZ 4.36Å; L117-F121 VanDerWaalsContact O-CB 3.26Å; L117-F121 WeakPolarHBondContact O-CB 3.31Å; L117-F121 PolarHBondContact O-N 3.1Å; F121-K123 PolarHBondContact O-N 3.19Å; F121-G124 PolarHBondContact O-N 3.22Å; F121-L125 HydrophobicContact CE1-CD2 4.23Å; F121-L125 HydrophobicContact CZ-CD2 4.45Å; F121-L125 WeakPolarHBondContact O-CB 3.25Å; F121-L125 PolarHBondContact O-N 2.89Å
122K90.1Very high86.2Confident145 Ų145112.8 Ų112.863%0.6354%0.536SS*.Hα-helixtrans-57.9-46.5176.8-172.2-179.273.7165.40112K118 I120 L125 W126K118-K122 VanDerWaalsContact O-CB 3.25Å; K118-K122 WeakPolarHBondContact O-CB 3.23Å; K118-K122 PolarHBondContact O-N 3.18Å; I120-K122 PolarHBondContact O-N 3.47Å; K122-L125 PolarHBondContact O-N 3.39Å; K122-W126 VanDerWaalsContact O-CB 3.31Å; K122-W126 WeakPolarHBondContact O-CB 3.35Å; K122-W126 PolarHBondContact O-N 2.9Å
123K92.6Very high85.7Confident135 Ų135109.6 Ų109.659%0.58753%0.533SS*.Hα-helixtrans-64.1-43179.3-77.3-174.6174.5-1700111.9M119 I120 F121 K127M119-K123 HydrophobicContact CG-CD 4.36Å; M119-K123 WeakPolarHBondContact O-CB 3.41Å; M119-K123 WeakPolarHBondContact O-CG 3.47Å; M119-K123 PolarHBondContact O-N 2.76Å; I120-K123 PolarHBondContact O-N 2.98Å; F121-K123 PolarHBondContact O-N 3.19Å; K123-K127 WeakPolarHBondContact O-CB 3.11Å; K123-K127 PolarHBondContact O-N 3.44Å
124G92.1Very high85.7Confident44 Ų44100.9 Ų100.945%0.45450%0.497SS..Hα-helixtrans-62.3-46.7177.200000112I120 F121 K127 A128I120-G124 PolarHBondContact O-N 3.04Å; F121-G124 PolarHBondContact O-N 3.22Å; G124-K127 PolarHBondContact O-N 3.11Å; G124-A128 WeakPolarHBondContact O-CB 3.06Å; G124-A128 PolarHBondContact O-N 3.18Å
125L92.1Very high85.3Confident32 Ų3295.5 Ų95.517%0.16848%0.479CS..Hα-helixtrans-66-41.7179.7-174.660.9000112.3I104 V106 F121 K122 A128 A129 Q137I104-L125 HydrophobicContact CB-CD1 4.4Å; I104-L125 HydrophobicContact CD1-CD1 3.94Å; I104-L125 HydrophobicContact CG2-CD1 3.7Å; V106-L125 HydrophobicContact CG2-CD2 4.11Å; F121-L125 HydrophobicContact CE1-CD2 4.23Å; F121-L125 HydrophobicContact CZ-CD2 4.45Å; F121-L125 WeakPolarHBondContact O-CB 3.25Å; F121-L125 PolarHBondContact O-N 2.89Å; K122-L125 PolarHBondContact O-N 3.39Å; L125-A128 PolarHBondContact O-N 2.81Å; L125-A129 PolarHBondContact O-N 3.26Å; L125-Q137 PolarHBondContact O-NE2 2.87Å
126W90.9Very high85Confident168 Ų16887.6 Ų87.664%0.63645%0.453SS*.Hα-helixtrans-60.7-48.9174.3-180-93.9000111.5K122 A128 A129 E130K122-W126 VanDerWaalsContact O-CB 3.31Å; K122-W126 WeakPolarHBondContact O-CB 3.35Å; K122-W126 PolarHBondContact O-N 2.9Å; W126-A128 VanDerWaalsContact C-N 3.3Å; W126-A128 PolarHBondContact O-N 3.47Å; W126-A129 PolarHBondContact O-N 2.97Å; W126-A129 VanDerWaalsContact O-N 3.12Å; W126-E130 PolarHBondContact NE1-OE2 3.38Å; W126-E130 WeakPolarHBondContact O-CB 3.47Å; W126-E130 PolarHBondContact O-N 2.92Å
127K90.8Very high84.3Confident155 Ų15583.4 Ų83.467%0.67444%0.436SS*.Hα-helixtrans-60.4-40.6179.1-171.2176.5-177.7-178.90111.8K123 G124 S131K123-K127 WeakPolarHBondContact O-CB 3.11Å; K123-K127 PolarHBondContact O-N 3.44Å; G124-K127 PolarHBondContact O-N 3.11Å; K127-S131 VanDerWaalsContact O-CB 3.25Å; K127-S131 WeakPolarHBondContact O-CB 3.25Å; K127-S131 PolarHBondContact O-N 3.26Å; K127-S131 PolarHBondContact O-OG 3.4Å; K127-S131 VanDerWaalsContact O-OG 3.1Å
128A88.3Confident84Confident32 Ų3282.8 Ų82.826%0.26444%0.435SS..Hα-helixtrans-61.6-44.5175.500000111.6I104 G124 L125 W126 S131 G132I104-A128 HydrophobicContact CD1-CB 3.91Å; G124-A128 WeakPolarHBondContact O-CB 3.06Å; G124-A128 PolarHBondContact O-N 3.18Å; L125-A128 PolarHBondContact O-N 2.81Å; W126-A128 VanDerWaalsContact C-N 3.3Å; W126-A128 PolarHBondContact O-N 3.47Å; A128-S131 PolarHBondContact O-OG 3.39Å; A128-G132 PolarHBondContact O-N 2.98Å
129A86.7Confident83.4Confident24 Ų2482.7 Ų82.720%0.19844%0.439CS..Hα-helixtrans-71.4-34.8-179.600000114.2L125 W126 A135 Q137L125-A129 PolarHBondContact O-N 3.26Å; W126-A129 PolarHBondContact O-N 2.97Å; W126-A129 VanDerWaalsContact O-N 3.12Å; A129-A135 HydrophobicContact CB-CB 4.2Å; A129-Q137 HydrophobicContact CB-CG 4.36Å
130E85.9Confident82.6Confident139 Ų13983.8 Ų83.865%0.6544%0.443SS*.Hα-helixtrans-73.4-34.1176.8-172.5169.3-157.900112W126W126-E130 PolarHBondContact NE1-OE2 3.38Å; W126-E130 WeakPolarHBondContact O-CB 3.47Å; W126-E130 PolarHBondContact O-N 2.92Å
131S79.8Confident80.9Confident97 Ų9787.1 Ų87.168%0.67847%0.473SS*.Hα-helixtrans-72.5-30-179.868.10000114.1K127 A128K127-S131 VanDerWaalsContact O-CB 3.25Å; K127-S131 WeakPolarHBondContact O-CB 3.25Å; K127-S131 PolarHBondContact O-N 3.26Å; K127-S131 PolarHBondContact O-OG 3.4Å; K127-S131 VanDerWaalsContact O-OG 3.1Å; A128-S131 PolarHBondContact O-OG 3.39Å
132G67.3Low80.4Confident19 Ų1987 Ų8720%0.19648%0.477CS..SBendtrans-88.8115.1176.200000109.2A128 S134 A135A128-G132 PolarHBondContact O-N 2.98Å; G132-S134 PolarHBondContact O-N 3.5Å; G132-A135 PolarHBondContact O-N 3.34Å
133S61.9Low79.9Confident104 Ų10483.9 Ų83.973%0.72747%0.469SS*.THydrogen-bonded Turntrans-59.74.517955.80000115.2
134S72.7Confident79.2Confident20 Ų2081.1 Ų81.114%0.1446%0.462CS..THydrogen-bonded Turntrans-162.543.9172.1-56.50000111.3K98 P100 T101 G132 L136K98-S134 VanDerWaalsContact CD-OG 3.29Å; K98-S134 WeakPolarHBondContact CD-OG 3.44Å; P100-S134 WeakPolarHBondContact CA-O 3.31Å; P100-S134 WeakPolarHBondContact CB-O 3.29Å; T101-S134 PolarHBondContact N-O 3.04Å; G132-S134 PolarHBondContact O-N 3.5Å; S134-L136 PolarHBondContact O-N 2.88Å
135A74.6Confident78.5Confident25 Ų2583.2 Ų83.221%0.20746%0.463CS..EExtended strand (participates in β ladder)trans-71.4129.4176.800000110.9A129 G132A129-A135 HydrophobicContact CB-CB 4.2Å; G132-A135 PolarHBondContact O-N 3.34Å
136L79Confident77.6Confident63 Ų6386.4 Ų86.433%0.3348%0.481SS..EExtended strand (participates in β ladder)trans-104.1123173.8-175.265.7000109.7P100 L102 I104 S134 V138P100-L136 HydrophobicContact CB-CB 3.68Å; P100-L136 HydrophobicContact CG-CB 3.96Å; P100-L136 HydrophobicContact CG-CD2 4.17Å; L102-L136 PolarHBondContact O-N 2.84Å; I104-L136 PolarHBondContact N-O 2.83Å; S134-L136 PolarHBondContact O-N 2.88Å; L136-V138 HydrophobicContact CD2-CG2 4.45Å; L136-V138 HydrophobicContact CG-CG2 4.39Å
137Q75.9Confident76.7Confident73 Ų7381 Ų8134%0.34147%0.471SS..EExtended strand (participates in β ladder)trans-96.4121.3173.6-65.7179.9-600109.3L125 A129L125-Q137 PolarHBondContact O-NE2 2.87Å; A129-Q137 HydrophobicContact CB-CG 4.36Å
138V81.3Confident75.7Confident63 Ų6375.7 Ų75.738%0.38246%0.457SS..EExtended strand (participates in β ladder)trans-107.8115.3172.6-177.50000107.4I103 I104 T105 V106 L136I103-V138 HydrophobicContact CG2-CG2 4.26Å; I104-V138 PolarHBondContact O-N 3.38Å; T105-V138 WeakPolarHBondContact CA-O 3.42Å; T105-V138 HydrophobicContact CG2-CB 4.43Å; T105-V138 HydrophobicContact CG2-CG1 4.47Å; V106-V138 PolarHBondContact N-O 2.99Å; L136-V138 HydrophobicContact CD2-CG2 4.45Å; L136-V138 HydrophobicContact CG-CG2 4.39Å
139I76.8Confident74.8Confident111 Ų11179.1 Ų79.157%0.56947%0.471SS*.EExtended strand (participates in β ladder)trans-107.5119.5178-58.4173.9000107.2
140Q73.5Confident73.8Confident120 Ų12083.7 Ų83.756%0.56149%0.494SS*.EExtended strand (participates in β ladder)trans-105.4111.3171-171.3173-37.400107.9V106 F107V106-Q140 PolarHBondContact O-N 2.75Å; F107-Q140 HydrophobicContact CD1-CB 3.97Å; F107-Q140 HydrophobicContact CD1-CG 4.44Å; F107-Q140 HydrophobicContact CE1-CB 3.99Å; F107-Q140 HydrophobicContact CE1-CG 4.37Å
141C56.3Low72.7Confident170 Ų17078.6 Ų78.6100%1.14948%0.48SS*.  trans-83.60173.6-58.90000111.4

Retrieved 141 of 141 residues in 195.7 ms (Link to these results)