A0A093HQZ4_STRCA Loading...

Integrin beta-1-binding protein 1

AlphaFold DB , UniProt , Accession A0A093HQZ4, Species STRCA (Struthio camelus australis), Gene n/a, Length 200 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
1M42.3Very low44.7Very low218 Ų218179 Ų179100%1.07487%0.865SS**  0151.20-81.6162.175.700109.2
2F46.1Very low44.6Very low196 Ų196174.2 Ų174.286%0.8686%0.864SS**  trans84.3109.5177.3-56.7-72.8000118.6
3R54.3Low44.1Very low255 Ų255169.4 Ų169.496%0.96286%0.858SS**  trans-96.1152.8177.6-77.9178.6171.8177.7-2.9110.8
4K45.7Very low44.3Very low215 Ų215165.1 Ų165.194%0.93585%0.851SS**  trans-75.5145.9176.6-167.7176.1-173.3174.20112.3
5G39.7Very low44.1Very low71 Ų71166.4 Ų166.473%0.73285%0.852SS**  trans120.7115.6138.400000120.8
6K46Very low43.5Very low208 Ų208162.4 Ų162.490%0.90484%0.843SS**  101.7121120.4-149164.7-176.5171.80121
7K43.4Very low43.5Very low171 Ų171160.2 Ų160.274%0.74385%0.845SS**  trans-10.5142.5158.7-81.9-178.6169.8-176.70119.4
8R46.2Very low43.3Very low237 Ų237162.4 Ų162.489%0.89485%0.85SS**  trans-118.5122154.3-66.9179.173169.11.5110
9H48.5Very low43.2Very low156 Ų156162.9 Ų162.972%0.72285%0.852SS**  trans-132.5129.9151.4-57.7-69.7000106
10S41.9Very low43.2Very low121 Ų121159.6 Ų159.685%0.84684%0.843SS**  trans-167129.6150.627.60000110.9
11S38Very low43.1Very low121 Ų121158.4 Ų158.485%0.84684%0.842SS**  trans-64.6152.3172.537.30000113.8
12S43.8Very low42.9Very low121 Ų121157.1 Ų157.185%0.84683%0.831SS**  trans-119.5128160.767.10000111.1
13S37.8Very low42.7Very low112 Ų112152.7 Ų152.778%0.78382%0.824SS**  trans-86150.9173.544.80000112.8
14S46.9Very low42.1Very low109 Ų109150.7 Ų150.776%0.76282%0.822SS**  trans-162.8109.6150.3-68.50000107
15Q40.4Very low41.8Very low185 Ų185145.5 Ų145.586%0.86481%0.813SS**  55136.296.9-79.8-174.6-14.700113.3
16S35.2Very low41.9Very low102 Ų102148.5 Ų148.571%0.71382%0.817SS**  cis171.3135-16.340.70000104.6
17S43.6Very low41.6Very low126 Ų126145 Ų14588%0.88181%0.808SS**  trans-175.2116.9151.5410000111.4
18E40.3Very low41.5Very low199 Ų199142.6 Ų142.693%0.9381%0.813SS**  trans-76.3147.7165.2-57.6174.4114.200110.1
19I40.5Very low41.3Very low172 Ų172136 Ų13688%0.88280%0.802SS**  trans-157.6136.1136.6-160159.7000111.6
20S42.7Very low41.1Very low97 Ų97136.9 Ų136.968%0.67881%0.812SS**  trans-89.1149.9176.9166.20000111.2
21T42.3Very low40.9Very low135 Ų135135.1 Ų135.183%0.82881%0.813SS**  trans178.6110.3131.736.90000113.4
22K37.6Very low41.1Very low191 Ų191133.3 Ų133.383%0.8381%0.814SS**  33.7111.5123.7-145.3173-172.6178.70120.2
23S41.3Very low40.8Very low103 Ų103135.6 Ų135.672%0.7282%0.815SS**  39.2132.1129.9-37.20000121.1
24K41.3Very low41Very low213 Ų213135.3 Ų135.393%0.92681%0.813SS**  -171143.5124.2-104.6166.5-174.9-175.80113.9
25S40.2Very low41.2Very low106 Ų106142.2 Ų142.274%0.74182%0.823SS**  trans-95-174.7177.144.10000112
26V41.6Very low41.3Very low133 Ų133139.3 Ų139.381%0.80682%0.823SS**  trans89.5106159-107.10000121.5
27D39Very low41.8Very low136 Ų136140 Ų14073%0.72783%0.827SS**  29.3135.5125.2-159.724.1000122
28S42.2Very low42Very low120 Ų120140 Ų14084%0.83982%0.823SS**  trans-155.5131.5140.3-220000111.5
29S41.6Very low42.3Very low97 Ų97137.7 Ų137.768%0.67882%0.821SS**  trans-94174.3-178.2-146.10000112.6
30L44.2Very low42.5Very low175 Ų175133.8 Ų133.892%0.91682%0.815SS**  trans90.9120.4156.1-63.9154.7000120.4
31G38.9Very low42.5Very low84 Ų84134.4 Ų134.487%0.86682%0.819SS**  trans141.9109.9135.400000116.1
32G42.3Very low42.8Very low84 Ų84135.6 Ų135.687%0.86682%0.82SS**  trans152.890.2158.500000115.3
33L37.8Very low43.2Very low168 Ų168134.1 Ų134.188%0.8882%0.821SS**  trans-78.3145.7179.1-69.8165000113.5
34S40.8Very low43.8Very low106 Ų106135.2 Ų135.274%0.74182%0.824SS**  trans68.9127.5140.2-60.10000121.4
35R50.8Low43.8Very low255 Ų255132 Ų13296%0.96282%0.817SS**  -168.1121.8122.7-102.5166.1174.2-150.6-4.7112
36S42.4Very low44.1Very low124 Ų124131.6 Ų131.687%0.86781%0.813SS**  trans-68.1149.9172.3-67.80000113.3
37S46.4Very low44.1Very low115 Ų115130.6 Ų130.680%0.80481%0.808SS**  -163.8129.4129.653.30000111.8
38T47.3Very low44.3Very low128 Ų128133.7 Ų133.779%0.78582%0.815SS**  trans-47146164.922.50000114.6
39V46.8Very low44.5Very low149 Ų149133 Ų13390%0.90381%0.81SS**  -175.9156.9106-860000113
40A45.8Very low44.6Very low91 Ų91134 Ų13475%0.75282%0.817SS**  trans-58.9154.6-167.300000118.7
41S42.7Very low44.3Very low109 Ų109128.4 Ų128.476%0.76280%0.801SS**  trans-167.4101.1139.6-74.80000107.7
42L49Very low44.6Very low161 Ų161132.9 Ų132.984%0.84380%0.8SS**  72.6105.6101.3-74.5163.1000113.1T44L42-T44 PolarHBondContact O-N 3.38Å
43D44.7Very low44.5Very low160 Ų160133.4 Ų133.486%0.85679%0.791SS**  trans-52.2127.7172.5-57.4-73000111.8
44T55.2Low44.8Very low126 Ų126132.4 Ų132.477%0.77379%0.786SS**  trans-127.592152.433.70000107.2L42 S46L42-T44 PolarHBondContact O-N 3.38Å; T44-S46 PolarHBondContact O-N 3.32Å
45D41.3Very low44.8Very low146 Ų146131.3 Ų131.378%0.78178%0.778SS**  trans-65.982.7167.5-166.99.9000108.4T47D45-T47 PolarHBondContact O-N 3.05Å
46S45.1Very low44.6Very low96 Ų96126.3 Ų126.367%0.67177%0.771SS**  trans-90.988166.1-61.40000106.7T44 K48T44-S46 PolarHBondContact O-N 3.32Å; S46-K48 VanDerWaalsContact C-N 3.35Å; S46-K48 PolarHBondContact O-N 3.3Å
47T41.9Very low44.8Very low113 Ų113124.3 Ų124.369%0.69376%0.757SS**  trans-43102.5160.743.90000108.4D45 S49D45-T47 PolarHBondContact O-N 3.05Å; T47-S49 PolarHBondContact O-N 3.46Å
48K43.6Very low45.2Very low200 Ų200123.7 Ų123.787%0.8775%0.745SS**  trans-64.391.3161.7-77.8-176.6177.2178.30105S46 S50S46-K48 VanDerWaalsContact C-N 3.35Å; S46-K48 PolarHBondContact O-N 3.3Å; K48-S50 VanDerWaalsContact C-N 3.32Å; K48-S50 PolarHBondContact O-N 2.86Å
49S46.4Very low46.1Very low107 Ų107120.2 Ų120.275%0.74872%0.723SS**  trans-56.5110.2156.459.80000105T47 G51T47-S49 PolarHBondContact O-N 3.46Å; S49-G51 PolarHBondContact O-N 2.85Å
50S43.6Very low47.9Very low117 Ų117116.8 Ų116.882%0.81871%0.705SS**  trans-64.173.5157.650.20000106.2K48 Q52K48-S50 VanDerWaalsContact C-N 3.32Å; K48-S50 PolarHBondContact O-N 2.86Å; S50-Q52 PolarHBondContact O-N 3.46Å
51G37.3Very low50.3Low57 Ų57113.7 Ų113.759%0.58868%0.68SS**  trans-64.293.5164.100000105.7S49 S53S49-G51 PolarHBondContact O-N 2.85Å; G51-S53 PolarHBondContact O-N 3.22Å
52Q46.5Very low52.8Low178 Ų178113.5 Ų113.583%0.83267%0.666SS**  trans-50.687.8157.1-167.2104.11800106.5S50 N54S50-Q52 PolarHBondContact O-N 3.46Å; Q52-N54 PolarHBondContact O-N 3.38Å
53S38.9Very low55.1Low96 Ų96107.3 Ų107.367%0.67163%0.633SS**  trans-72.693.8170.7440000105.5G51 S55G51-S53 PolarHBondContact O-N 3.22Å; S53-S55 PolarHBondContact O-N 2.98Å
54N44.1Very low57.6Low146 Ų146105.8 Ų105.878%0.78162%0.615SS**  trans-59.876.6148.7-100.119.8000106.6Q52 N56Q52-N54 PolarHBondContact O-N 3.38Å; N54-N56 PolarHBondContact O-N 2.86Å
55S41.3Very low59.6Low84 Ų8499.8 Ų99.859%0.58758%0.578SS**  trans-74.283.616249.10000105.9S53 S57S53-S55 PolarHBondContact O-N 2.98Å; S55-S57 PolarHBondContact O-N 3.28Å
56N45.9Very low62.3Low149 Ų14994.2 Ų94.280%0.79755%0.547SS*.  trans-61.171.6136.6-82.1-7000105.6N54 D58N54-N56 PolarHBondContact O-N 2.86Å; N56-D58 VanDerWaalsContact C-N 3.34Å; N56-D58 PolarHBondContact O-N 2.69Å
57S47.6Very low64.8Low83 Ų8392.2 Ų92.258%0.5853%0.525SS*.  trans-65.2108.6166.3510000103.7S55 T59S55-S57 PolarHBondContact O-N 3.28Å; S57-T59 VanDerWaalsContact C-N 3.34Å; S57-T59 PolarHBondContact O-N 3.01Å
58D53.5Low67.4Low102 Ų10287.3 Ų87.355%0.54550%0.495SS..  trans-48.4109166.3-76.2-46.4000106N56 C60 K116N56-D58 VanDerWaalsContact C-N 3.34Å; N56-D58 PolarHBondContact O-N 2.69Å; D58-C60 PolarHBondContact O-N 3.43Å; D58-K116 WeakPolarHBondContact OD1-CE 3.19Å; D58-K116 IonicContact OD1-NZ 2.69Å; D58-K116 PolarHBondContact OD1-NZ 2.86Å
59T67.8Low70Confident54 Ų5478.3 Ų78.333%0.33146%0.459SS..  trans-72.467.5-174.643.60000108.7S57S57-T59 VanDerWaalsContact C-N 3.34Å; S57-T59 PolarHBondContact O-N 3.01Å
60C84.7Confident72.4Confident78 Ų7874.4 Ų74.453%0.52743%0.433SS..  trans-98.6117.8178.2-167.50000108D58 V114D58-C60 PolarHBondContact O-N 3.43Å; C60-V114 WeakPolarHBondContact CA-O 3.31Å
61A95.1Very high74.8Confident26 Ų2669.8 Ų69.822%0.21540%0.399CS..EExtended strand (participates in β ladder)trans-124.2136.1175.100000109.7F63 G113 V114 V186A61-F63 HydrophobicContact CB-CD2 4.48Å; A61-F63 HydrophobicContact CB-CE2 3.51Å; A61-F63 HydrophobicContact CB-CZ 3.69Å; A61-G113 CarbonylContact O-C 3.58Å; A61-G113 WeakPolarHBondContact O-CA 3.33Å; A61-V114 PolarHBondContact N-O 3.09Å; A61-V114 PolarHBondContact O-N 3.02Å; A61-V186 HydrophobicContact CB-CG1 4.2Å; A61-V186 HydrophobicContact CB-CG2 4.01Å
62E96.3Very high77.5Confident104 Ų10472.3 Ų72.349%0.48640%0.396SS..EExtended strand (participates in β ladder)trans-111.8138.1179.9-65.1-173162.200110.7I111 M112E62-I111 HydrophobicContact CB-CG2 4.14Å; E62-I111 HydrophobicContact CG-CG2 4.35Å; E62-M112 CarbonylContact C-O 3.59Å; E62-M112 WeakPolarHBondContact CA-O 3.38Å
63F97.1Very high79.4Confident31 Ų3170.8 Ų70.814%0.13639%0.386CS..EExtended strand (participates in β ladder)trans-135140-175.4-57-86.5000110.3A61 V65 M112 V114 Q179 A182 I183 V186A61-F63 HydrophobicContact CB-CD2 4.48Å; A61-F63 HydrophobicContact CB-CE2 3.51Å; A61-F63 HydrophobicContact CB-CZ 3.69Å; F63-V65 HydrophobicContact CB-CG1 4.43Å; F63-M112 PolarHBondContact N-O 2.92Å; F63-M112 PolarHBondContact O-N 3.43Å; F63-V114 HydrophobicContact CD2-CG2 4.27Å; F63-V114 HydrophobicContact CE2-CG2 4.19Å; F63-Q179 HydrophobicContact CB-CG 4.48Å; F63-Q179 HydrophobicContact CD1-CG 3.84Å; F63-A182 HydrophobicContact CE1-CB 3.96Å; F63-A182 HydrophobicContact CZ-CB 4.25Å; F63-I183 HydrophobicContact CB-CD1 3.87Å; F63-I183 HydrophobicContact CB-CG1 4.1Å; F63-I183 HydrophobicContact CD1-CD1 4.26Å; F63-I183 HydrophobicContact CD1-CG1 3.81Å; F63-I183 HydrophobicContact CD2-CD1 4.15Å; F63-I183 HydrophobicContact CD2-CG1 3.43Å; F63-I183 VanDerWaalsContact CD2-CG1 3.43Å; F63-I183 HydrophobicContact CE1-CG1 4.01Å; F63-I183 HydrophobicContact CE2-CB 4.5Å; F63-I183 HydrophobicContact CE2-CG1 3.64Å; F63-I183 HydrophobicContact CG-CD1 3.84Å; F63-I183 HydrophobicContact CG-CG1 3.49Å; F63-I183 VanDerWaalsContact CG-CG1 3.49Å; F63-I183 HydrophobicContact CZ-CG1 3.93Å; F63-V186 HydrophobicContact CZ-CG2 4.3Å
64R97.3Very high81.7Confident128 Ų12866.8 Ų66.848%0.48336%0.358SS..EExtended strand (participates in β ladder)trans-84.5122.8170.8-69.1173.7176.1-94.1-6.4109.7E109 F110 Q179R64-E109 IonicContact NH1-OE2 2.7Å; R64-E109 PolarHBondContact NH1-OE2 2.83Å; R64-F110 WeakPolarHBondContact CA-O 3.36Å; R64-Q179 PolarHBondContact O-NE2 3.15Å; R64-Q179 PolarHBondContact O-OE1 3.17Å
65V97.3Very high83.5Confident0 Ų066.8 Ų66.80%035%0.351CS..EExtended strand (participates in β ladder)trans-137158.1-178.3-60.90000110.2F63 F110 M112 Y172 I183F63-V65 HydrophobicContact CB-CG1 4.43Å; V65-F110 PolarHBondContact N-O 2.97Å; V65-F110 PolarHBondContact O-N 3.28Å; V65-M112 HydrophobicContact CG1-CB 4.3Å; V65-M112 HydrophobicContact CG1-SD 4.5Å; V65-M112 HydrophobicContact CG2-CB 3.76Å; V65-M112 HydrophobicContact CG2-CE 4.14Å; V65-Y172 HydrophobicContact CG2-CD1 4.31Å; V65-I183 HydrophobicContact CG1-CD1 4.11Å
66K97.8Very high84.9Confident29 Ų2968.6 Ų68.613%0.12635%0.345CS..EExtended strand (participates in β ladder)trans-99.8145.2169.9-67-178.7165.2-168.80109.9P105 G106 E107 E109 Y172 Q173K66-P105 HydrophobicContact CB-CB 3.98Å; K66-P105 HydrophobicContact CB-CG 3.86Å; K66-P105 HydrophobicContact CD-CG 4.16Å; K66-G106 WeakPolarHBondContact CD-O 3.32Å; K66-E107 IonicContact NZ-OE1 2.84Å; K66-E107 IonicContact NZ-OE2 3.38Å; K66-E107 PolarHBondContact NZ-OE2 3.42Å; K66-E109 HydrophobicContact CG-CG 4.42Å; K66-Y172 CarbonylContact O-C 3.58Å; K66-Y172 WeakPolarHBondContact O-CA 3.38Å; K66-Q173 HydrophobicContact CB-CB 4.3Å; K66-Q173 PolarHBondContact N-O 3.19Å; K66-Q173 PolarHBondContact O-N 2.84Å
67Y97.3Very high85.9Confident55 Ų5565.2 Ų65.222%0.21633%0.333CS..EExtended strand (participates in β ladder)trans-95.5123.6178.4-178.9-125.9000110.5G69 A70 P105 H131 Y172Y67-G69 WeakPolarHBondContact CE2-O 3.3Å; Y67-G69 VanDerWaalsContact CZ-C 3.44Å; Y67-G69 VanDerWaalsContact CZ-CA 3.49Å; Y67-G69 VanDerWaalsContact OH-C 3.27Å; Y67-A70 WeakPolarHBondContact OH-CB 3.31Å; Y67-A70 PolarHBondContact OH-N 3.49Å; Y67-P105 VanDerWaalsContact O-CB 3.27Å; Y67-P105 WeakPolarHBondContact O-CB 3.44Å; Y67-H131 AromaticContact CZ-NE2 3.91Å; Y67-Y172 AromaticContact CD2-CD1 3.71Å; Y67-Y172 HydrophobicContact CD2-CD1 3.71Å; Y67-Y172 AromaticContact CD2-CE1 3.41Å; Y67-Y172 HydrophobicContact CD2-CE1 3.41Å; Y67-Y172 VanDerWaalsContact CD2-CE1 3.41Å; Y67-Y172 AromaticContact CE2-CE1 3.93Å; Y67-Y172 HydrophobicContact CE2-CE1 3.93Å; Y67-Y172 HydrophobicContact CG-CE1 4.38Å
68V97Very high87Confident9 Ų965.2 Ų65.26%0.05532%0.324CS..EExtended strand (participates in β ladder)trans-87.3-46.3178.5179.70000109.9P102 P105 L154 V171 Q173V68-P102 HydrophobicContact CG1-CG 4.07Å; V68-P102 VanDerWaalsContact CG1-O 3.27Å; V68-P102 WeakPolarHBondContact CG1-O 3.4Å; V68-P102 VanDerWaalsContact O-CD 3.28Å; V68-P102 WeakPolarHBondContact O-CD 3.31Å; V68-P102 WeakPolarHBondContact O-CG 3.33Å; V68-P105 HydrophobicContact CB-CB 4.48Å; V68-P105 HydrophobicContact CG2-CB 3.92Å; V68-P105 HydrophobicContact CG2-CG 4.18Å; V68-L154 HydrophobicContact CG2-CD2 4.12Å; V68-V171 HydrophobicContact CB-CB 3.98Å; V68-V171 HydrophobicContact CB-CG1 3.89Å; V68-V171 WeakPolarHBondContact CB-O 3.37Å; V68-V171 HydrophobicContact CG1-CB 4.4Å; V68-V171 HydrophobicContact CG1-CG1 4.21Å; V68-V171 HydrophobicContact CG2-CG1 3.99Å; V68-V171 PolarHBondContact N-O 3.5Å; V68-Q173 HydrophobicContact CG2-CB 4.16Å
69G96.7Very high87.7Confident11 Ų1160.7 Ų60.711%0.11330%0.3CS..EExtended strand (participates in β ladder)trans156.3-173.7178.700000112.6Y67 V171Y67-G69 WeakPolarHBondContact CE2-O 3.3Å; Y67-G69 VanDerWaalsContact CZ-C 3.44Å; Y67-G69 VanDerWaalsContact CZ-CA 3.49Å; Y67-G69 VanDerWaalsContact OH-C 3.27Å; G69-V171 PolarHBondContact N-O 2.88Å; G69-V171 PolarHBondContact O-N 3.29Å
70A96.8Very high87.7Confident26 Ų2664 Ų6422%0.21531%0.31CS..EExtended strand (participates in β ladder)trans-139.5154.117700000112.2Y67 E72 L169 W170Y67-A70 WeakPolarHBondContact OH-CB 3.31Å; Y67-A70 PolarHBondContact OH-N 3.49Å; A70-E72 HydrophobicContact CB-CG 4.23Å; A70-L169 CarbonylContact C-O 3.54Å; A70-L169 WeakPolarHBondContact CA-O 3.32Å; A70-L169 WeakPolarHBondContact CB-O 3.41Å; A70-W170 HydrophobicContact CB-CD2 4.04Å; A70-W170 HydrophobicContact CB-CE3 3.4Å; A70-W170 VanDerWaalsContact CB-CE3 3.4Å; A70-W170 HydrophobicContact CB-CH2 4.42Å; A70-W170 HydrophobicContact CB-CZ3 3.61Å
71I95Very high87.1Confident20 Ų2066.1 Ų66.110%0.10332%0.316CS..EExtended strand (participates in β ladder)trans-121.1101.3169.2-53.7173000106L74 Y91 A95 L101 S168 L169I71-L74 HydrophobicContact CG2-CD1 4.07Å; I71-L74 HydrophobicContact CG2-CD2 3.68Å; I71-L74 HydrophobicContact CG2-CG 3.92Å; I71-Y91 HydrophobicContact CD1-CD1 4.38Å; I71-Y91 HydrophobicContact CD1-CE1 3.89Å; I71-A95 HydrophobicContact CD1-CB 3.46Å; I71-A95 VanDerWaalsContact CD1-CB 3.46Å; I71-L101 HydrophobicContact CD1-CD1 3.75Å; I71-L101 HydrophobicContact CD1-CG 4.11Å; I71-L101 HydrophobicContact CG1-CD1 3.97Å; I71-L101 HydrophobicContact CG1-CD2 4.27Å; I71-L101 HydrophobicContact CG1-CG 4.02Å; I71-S168 CarbonylContact O-C 3.53Å; I71-S168 WeakPolarHBondContact O-CA 3.37Å; I71-L169 HydrophobicContact CB-CB 4.39Å; I71-L169 PolarHBondContact N-O 3.5Å; I71-L169 PolarHBondContact O-N 2.84Å
72E93.1Very high86.4Confident110 Ų11065.2 Ų65.251%0.51431%0.308SS..EExtended strand (participates in β ladder)trans-96.1157.9-174.8-63.1-178.8-146.600112A70 L74 W170A70-E72 HydrophobicContact CB-CG 4.23Å; E72-L74 VanDerWaalsContact C-N 3.34Å; E72-L74 PolarHBondContact O-N 3.5Å; E72-W170 HydrophobicContact CG-CH2 3.93Å; E72-W170 HydrophobicContact CG-CZ2 4.3Å; E72-W170 HydrophobicContact CG-CZ3 4.48Å
73K87.1Confident85.6Confident146 Ų14667.9 Ų67.964%0.63532%0.32SS*.EExtended strand (participates in β ladder)trans57.141.9171.7-52.9-176.3-178.2-179.60113.9K75 C167 S168K73-K75 PolarHBondContact O-N 2.92Å; K73-C167 PolarHBondContact N-O 3.24Å; K73-S168 PolarHBondContact N-OG 3.43Å
74L87.3Confident85.3Confident12 Ų1267.2 Ų67.26%0.06332%0.322CS..EExtended strand (participates in β ladder)trans-68.6128.3170-66.6173.2000109.6I71 E72 L82 Y91 E166 C167 L169I71-L74 HydrophobicContact CG2-CD1 4.07Å; I71-L74 HydrophobicContact CG2-CD2 3.68Å; I71-L74 HydrophobicContact CG2-CG 3.92Å; E72-L74 VanDerWaalsContact C-N 3.34Å; E72-L74 PolarHBondContact O-N 3.5Å; L74-L82 HydrophobicContact CD1-CD1 4.45Å; L74-Y91 HydrophobicContact CD1-CE1 4.05Å; L74-Y91 WeakPolarHBondContact CD2-OH 3.22Å; L74-E166 WeakPolarHBondContact O-CA 3.28Å; L74-C167 HydrophobicContact CB-CB 4.5Å; L74-C167 VanDerWaalsContact CB-O 3.31Å; L74-C167 WeakPolarHBondContact CB-O 3.42Å; L74-C167 PolarHBondContact N-O 3.11Å; L74-C167 PolarHBondContact O-N 3.01Å; L74-L169 HydrophobicContact CD1-CD1 3.92Å; L74-L169 HydrophobicContact CD1-CG 3.83Å
75K81.8Confident85.1Confident146 Ų14663.8 Ų63.864%0.63532%0.316SS*.EExtended strand (participates in β ladder)trans-63.4147.8178.2-68.6-178.7179.6176.90110.9K73 S77 E78 S79K73-K75 PolarHBondContact O-N 2.92Å; K75-S77 PolarHBondContact O-N 3.23Å; K75-E78 PolarHBondContact O-N 3.43Å; K75-S79 PolarHBondContact O-N 3.15Å; K75-S79 VanDerWaalsContact O-N 3.09Å
76Y70.3Confident85Confident122 Ų12270 Ų7048%0.47835%0.349SS..Hα-helixtrans-46.9-35.9176.7-170.7-103000114.9E78 S79 K80 E165Y76-E78 VanDerWaalsContact C-N 3.32Å; Y76-E78 PolarHBondContact O-N 2.93Å; Y76-S79 WeakPolarHBondContact CA-OG 3.14Å; Y76-S79 PolarHBondContact O-N 3.02Å; Y76-S79 PolarHBondContact O-OG 3.43Å; Y76-K80 HydrophobicContact CD1-CD 4.43Å; Y76-K80 HydrophobicContact CE1-CD 3.76Å; Y76-K80 VanDerWaalsContact CE1-CE 3.42Å; Y76-K80 HydrophobicContact CE1-CG 4.02Å; Y76-K80 PolarHBondContact O-N 2.89Å; Y76-K80 VanDerWaalsContact OH-CE 3.26Å; Y76-K80 WeakPolarHBondContact OH-CE 3.45Å; Y76-E165 WeakPolarHBondContact CB-O 3.34Å; Y76-E165 PolarHBondContact N-O 3.18Å
77S67.1Low84.8Confident77 Ų7772.2 Ų72.254%0.53836%0.362SS..Hα-helixtrans-63.9-35.8178.853.40000113.3K75 N81K75-S77 PolarHBondContact O-N 3.23Å; S77-N81 PolarHBondContact O-ND2 3.26Å
78E70.3Confident84.6Confident83 Ų8369.6 Ų69.639%0.38835%0.352SS..Hα-helixtrans-82.5-34.3177.3-65.3178.3-162.300110.5K75 Y76 K80 N81 Y91K75-E78 PolarHBondContact O-N 3.43Å; Y76-E78 VanDerWaalsContact C-N 3.32Å; Y76-E78 PolarHBondContact O-N 2.93Å; E78-K80 VanDerWaalsContact C-N 3.33Å; E78-K80 PolarHBondContact O-N 2.95Å; E78-N81 PolarHBondContact O-N 2.83Å; E78-Y91 PolarHBondContact OE2-OH 2.77Å
79S68.1Low84.5Confident7 Ų770.7 Ų70.75%0.04936%0.357CS..Hα-helixtrans-69.5-28.1179.978.10000114.1K75 Y76 N81 L82 K158 C167K75-S79 PolarHBondContact O-N 3.15Å; K75-S79 VanDerWaalsContact O-N 3.09Å; Y76-S79 WeakPolarHBondContact CA-OG 3.14Å; Y76-S79 PolarHBondContact O-N 3.02Å; Y76-S79 PolarHBondContact O-OG 3.43Å; S79-N81 VanDerWaalsContact C-N 3.29Å; S79-N81 PolarHBondContact O-N 3.36Å; S79-L82 WeakPolarHBondContact O-CB 3.27Å; S79-L82 PolarHBondContact O-N 3.49Å; S79-L82 VanDerWaalsContact O-N 3.13Å; S79-K158 PolarHBondContact O-NZ 2.9Å; S79-K158 VanDerWaalsContact O-NZ 3.15Å; S79-C167 WeakPolarHBondContact CB-SG 3.48Å
80K68.2Low84.5Confident125 Ų12575 Ų7554%0.54338%0.377SS..THydrogen-bonded Turntrans-61.9-34.5172-102.3-171.1170.8178.10113Y76 E78 L82Y76-K80 HydrophobicContact CD1-CD 4.43Å; Y76-K80 HydrophobicContact CE1-CD 3.76Å; Y76-K80 VanDerWaalsContact CE1-CE 3.42Å; Y76-K80 HydrophobicContact CE1-CG 4.02Å; Y76-K80 PolarHBondContact O-N 2.89Å; Y76-K80 VanDerWaalsContact OH-CE 3.26Å; Y76-K80 WeakPolarHBondContact OH-CE 3.45Å; E78-K80 VanDerWaalsContact C-N 3.33Å; E78-K80 PolarHBondContact O-N 2.95Å; K80-L82 PolarHBondContact O-N 3.45Å
81N72.8Confident84.4Confident121 Ų12176.2 Ų76.265%0.64738%0.377SS*.THydrogen-bonded Turntrans-74.5-8.3177.3-62.5-38.6000112.3S77 E78 S79 D87S77-N81 PolarHBondContact O-ND2 3.26Å; E78-N81 PolarHBondContact O-N 2.83Å; S79-N81 VanDerWaalsContact C-N 3.29Å; S79-N81 PolarHBondContact O-N 3.36Å; N81-D87 VanDerWaalsContact O-CB 3.31Å; N81-D87 WeakPolarHBondContact O-CB 3.27Å
82L79.8Confident84.4Confident7 Ų775.3 Ų75.34%0.03737%0.372CS..  trans-102.245.4178.9-55.3176.8000111.3L74 S79 K80 D87 Y91 K158 L169L74-L82 HydrophobicContact CD1-CD1 4.45Å; S79-L82 WeakPolarHBondContact O-CB 3.27Å; S79-L82 PolarHBondContact O-N 3.49Å; S79-L82 VanDerWaalsContact O-N 3.13Å; K80-L82 PolarHBondContact O-N 3.45Å; L82-D87 HydrophobicContact CD2-CB 4.35Å; L82-Y91 HydrophobicContact CD1-CD2 4.47Å; L82-Y91 HydrophobicContact CD1-CG 4.33Å; L82-Y91 HydrophobicContact CD2-CD2 3.87Å; L82-Y91 HydrophobicContact CD2-CG 3.79Å; L82-K158 PolarHBondContact O-NZ 3.34Å; L82-L169 HydrophobicContact CD1-CD1 4.15Å; L82-L169 HydrophobicContact CD1-CD2 4.42Å
83E80Confident84.5Confident161 Ų16172.5 Ų72.575%0.75236%0.36SS*.  trans-78.3-38.6-178.5-164.3166.9-168.100111.1R140E83-R140 PolarHBondContact O-NH2 2.87Å
84G89.7Confident84.9Confident17 Ų1768.3 Ų68.318%0.17535%0.347CS..SBendtrans-90.6158.9179.100000114.8L86 D87 L88G84-L86 VanDerWaalsContact C-N 3.31Å; G84-D87 WeakPolarHBondContact CA-OD2 3.49Å; G84-D87 PolarHBondContact N-OD2 2.96Å; G84-D87 PolarHBondContact O-N 3.44Å; G84-L88 PolarHBondContact O-N 2.92Å
85P94.1Very high85.2Confident55 Ų5567.9 Ų67.936%0.35735%0.345SS..Hα-helixtrans-66.1-33.117227.6-33.4000112.5L88 I89 V142P85-L88 PolarHBondContact O-N 2.81Å; P85-I89 WeakPolarHBondContact O-CG1 3.41Å; P85-I89 PolarHBondContact O-N 2.89Å; P85-I89 VanDerWaalsContact O-N 3.15Å; P85-V142 HydrophobicContact CB-CG1 4.33Å; P85-V142 HydrophobicContact CB-CG2 3.83Å
86L94.3Very high85.9Confident131 Ų13161.4 Ų61.469%0.68632%0.317SS*.Hα-helixtrans-70.2-37.5178-63179.3000111.8G84 L88 I89 N90G84-L86 VanDerWaalsContact C-N 3.31Å; L86-L88 VanDerWaalsContact C-N 3.31Å; L86-L88 PolarHBondContact O-N 2.79Å; L86-I89 PolarHBondContact O-N 3.38Å; L86-N90 WeakPolarHBondContact O-CB 3.36Å; L86-N90 PolarHBondContact O-N 3.38Å
87D93.3Very high87.1Confident75 Ų7562.3 Ų62.340%0.40133%0.326SS..Hα-helixtrans-64.9-39.5176.9-51.9-46.7000110.9N81 L82 G84 N90 Y91N81-D87 VanDerWaalsContact O-CB 3.31Å; N81-D87 WeakPolarHBondContact O-CB 3.27Å; L82-D87 HydrophobicContact CD2-CB 4.35Å; G84-D87 WeakPolarHBondContact CA-OD2 3.49Å; G84-D87 PolarHBondContact N-OD2 2.96Å; G84-D87 PolarHBondContact O-N 3.44Å; D87-N90 PolarHBondContact O-N 2.93Å; D87-Y91 VanDerWaalsContact O-CB 3.32Å; D87-Y91 WeakPolarHBondContact O-CB 3.44Å; D87-Y91 PolarHBondContact O-N 2.88Å
88L94Very high88.5Confident1 Ų163.2 Ų63.21%0.00533%0.325CS..Hα-helixtrans-62.3-45.9175178.560.1000112G84 P85 L86 Y91 I92 V142 A156 K158 L169G84-L88 PolarHBondContact O-N 2.92Å; P85-L88 PolarHBondContact O-N 2.81Å; L86-L88 VanDerWaalsContact C-N 3.31Å; L86-L88 PolarHBondContact O-N 2.79Å; L88-Y91 PolarHBondContact O-N 2.78Å; L88-I92 HydrophobicContact CD1-CD1 4.11Å; L88-I92 HydrophobicContact CG-CD1 4.24Å; L88-I92 WeakPolarHBondContact O-CG1 3.37Å; L88-I92 PolarHBondContact O-N 3.33Å; L88-I92 VanDerWaalsContact O-N 3.15Å; L88-V142 HydrophobicContact CD2-CB 4.4Å; L88-V142 HydrophobicContact CD2-CG2 3.91Å; L88-A156 HydrophobicContact CD2-CB 3.97Å; L88-A156 HydrophobicContact CG-CB 4.21Å; L88-K158 HydrophobicContact CD2-CB 4.36Å; L88-L169 HydrophobicContact CD1-CD1 3.76Å; L88-L169 HydrophobicContact CD1-CD2 3.48Å; L88-L169 VanDerWaalsContact CD1-CD2 3.48Å; L88-L169 HydrophobicContact CD1-CG 4.19Å
89I95.9Very high89.6Confident32 Ų3262.2 Ų62.216%0.16434%0.337CS..Hα-helixtrans-60.7-52.9176.7-67.4165.1000109.6P85 L86 Y91 I92 D93 V142 Y144P85-I89 WeakPolarHBondContact O-CG1 3.41Å; P85-I89 PolarHBondContact O-N 2.89Å; P85-I89 VanDerWaalsContact O-N 3.15Å; L86-I89 PolarHBondContact O-N 3.38Å; I89-Y91 VanDerWaalsContact C-N 3.26Å; I89-Y91 PolarHBondContact O-N 3.43Å; I89-I92 PolarHBondContact O-N 3.15Å; I89-D93 PolarHBondContact O-N 3.48Å; I89-V142 HydrophobicContact CD1-CG1 3.93Å; I89-V142 HydrophobicContact CG1-CG1 4.16Å; I89-Y144 HydrophobicContact CD1-CD1 4.31Å; I89-Y144 HydrophobicContact CD1-CD2 4.38Å; I89-Y144 HydrophobicContact CD1-CG 3.93Å; I89-Y144 HydrophobicContact CG1-CD1 3.87Å; I89-Y144 HydrophobicContact CG1-CD2 4.12Å; I89-Y144 HydrophobicContact CG1-CE1 4.21Å; I89-Y144 HydrophobicContact CG1-CE2 4.44Å; I89-Y144 HydrophobicContact CG1-CG 3.83Å; I89-Y144 HydrophobicContact CG2-CD2 3.81Å; I89-Y144 HydrophobicContact CG2-CE2 3.85Å; I89-Y144 HydrophobicContact CG2-CG 4.39Å
90N94.7Very high90.9Very high100 Ų10068 Ų6854%0.53536%0.361SS..Hα-helixtrans-59.6-36.6-179.1-179.274.4000112.5L86 D87 D93 V94L86-N90 WeakPolarHBondContact O-CB 3.36Å; L86-N90 PolarHBondContact O-N 3.38Å; D87-N90 PolarHBondContact O-N 2.93Å; N90-D93 PolarHBondContact O-N 2.86Å; N90-V94 VanDerWaalsContact O-CG2 3.32Å; N90-V94 WeakPolarHBondContact O-CG2 3.5Å; N90-V94 PolarHBondContact O-N 3.49Å
91Y94.7Very high92.2Very high53 Ų5362.3 Ų62.321%0.20834%0.337CS..Hα-helixtrans-65.5-40.2175.8-171.2-85000112.2I71 L74 E78 L82 D87 L88 I89 A95 L169I71-Y91 HydrophobicContact CD1-CD1 4.38Å; I71-Y91 HydrophobicContact CD1-CE1 3.89Å; L74-Y91 HydrophobicContact CD1-CE1 4.05Å; L74-Y91 WeakPolarHBondContact CD2-OH 3.22Å; E78-Y91 PolarHBondContact OE2-OH 2.77Å; L82-Y91 HydrophobicContact CD1-CD2 4.47Å; L82-Y91 HydrophobicContact CD1-CG 4.33Å; L82-Y91 HydrophobicContact CD2-CD2 3.87Å; L82-Y91 HydrophobicContact CD2-CG 3.79Å; D87-Y91 VanDerWaalsContact O-CB 3.32Å; D87-Y91 WeakPolarHBondContact O-CB 3.44Å; D87-Y91 PolarHBondContact O-N 2.88Å; L88-Y91 PolarHBondContact O-N 2.78Å; I89-Y91 VanDerWaalsContact C-N 3.26Å; I89-Y91 PolarHBondContact O-N 3.43Å; Y91-A95 WeakPolarHBondContact O-CB 3.14Å; Y91-A95 PolarHBondContact O-N 3.13Å; Y91-L169 HydrophobicContact CD1-CD1 3.55Å; Y91-L169 HydrophobicContact CE1-CD1 3.87Å
92I95.5Very high93.4Very high0 Ų059.5 Ų59.50%033%0.325CS..Hα-helixtrans-66.7-42.5176.1-67.5164.3000110.3L88 I89 V94 A95 Q96 L101 Y144 A156 L169 V171L88-I92 HydrophobicContact CD1-CD1 4.11Å; L88-I92 HydrophobicContact CG-CD1 4.24Å; L88-I92 WeakPolarHBondContact O-CG1 3.37Å; L88-I92 PolarHBondContact O-N 3.33Å; L88-I92 VanDerWaalsContact O-N 3.15Å; I89-I92 PolarHBondContact O-N 3.15Å; I92-V94 VanDerWaalsContact C-N 3.35Å; I92-V94 PolarHBondContact O-N 3.29Å; I92-A95 CarbonylContact O-C 3.58Å; I92-A95 WeakPolarHBondContact O-CB 3.11Å; I92-A95 PolarHBondContact O-N 3.23Å; I92-A95 VanDerWaalsContact O-N 3.11Å; I92-Q96 HydrophobicContact CG2-CG 4.46Å; I92-Q96 WeakPolarHBondContact O-CG 3.16Å; I92-Q96 PolarHBondContact O-N 3.47Å; I92-L101 HydrophobicContact CG2-CD1 4.13Å; I92-Y144 WeakPolarHBondContact CG2-OH 3.48Å; I92-A156 HydrophobicContact CD1-CB 3.33Å; I92-L169 HydrophobicContact CG1-CD1 4.46Å; I92-V171 HydrophobicContact CD1-CG2 3.79Å; I92-V171 HydrophobicContact CG1-CG2 4.16Å; I92-V171 HydrophobicContact CG2-CG2 4.11Å
93D95Very high94Very high51 Ų5163.3 Ų63.327%0.27334%0.341SS..Hα-helixtrans-58.7-46.6177.2-64.7-17.3000111.3I89 N90 A95 Q96 Q97I89-D93 PolarHBondContact O-N 3.48Å; N90-D93 PolarHBondContact O-N 2.86Å; D93-A95 VanDerWaalsContact C-N 3.34Å; D93-A95 PolarHBondContact O-N 3.31Å; D93-Q96 PolarHBondContact O-N 3.03Å; D93-Q97 VanDerWaalsContact O-CG 3.3Å; D93-Q97 WeakPolarHBondContact O-CG 3.4Å; D93-Q97 PolarHBondContact O-N 3.43Å
94V95.3Very high94.6Very high58 Ų5860.5 Ų60.535%0.35234%0.335SS..Hα-helixtrans-63.4-41.2175.21730000110.8N90 I92 Q96 Q97 D98N90-V94 VanDerWaalsContact O-CG2 3.32Å; N90-V94 WeakPolarHBondContact O-CG2 3.5Å; N90-V94 PolarHBondContact O-N 3.49Å; I92-V94 VanDerWaalsContact C-N 3.35Å; I92-V94 PolarHBondContact O-N 3.29Å; V94-Q96 VanDerWaalsContact C-N 3.29Å; V94-Q96 PolarHBondContact O-N 3.49Å; V94-Q97 PolarHBondContact O-N 3.01Å; V94-D98 WeakPolarHBondContact O-CB 3.32Å; V94-D98 PolarHBondContact O-N 3.14Å
95A95.5Very high94.9Very high3 Ų360 Ų603%0.02533%0.329CS..Hα-helixtrans-64.8-32.4177.500000113I71 Y91 I92 D93 G99 K100 L101I71-A95 HydrophobicContact CD1-CB 3.46Å; I71-A95 VanDerWaalsContact CD1-CB 3.46Å; Y91-A95 WeakPolarHBondContact O-CB 3.14Å; Y91-A95 PolarHBondContact O-N 3.13Å; I92-A95 CarbonylContact O-C 3.58Å; I92-A95 WeakPolarHBondContact O-CB 3.11Å; I92-A95 PolarHBondContact O-N 3.23Å; I92-A95 VanDerWaalsContact O-N 3.11Å; D93-A95 VanDerWaalsContact C-N 3.34Å; D93-A95 PolarHBondContact O-N 3.31Å; A95-G99 PolarHBondContact O-N 3.18Å; A95-K100 HydrophobicContact CB-CB 4.29Å; A95-K100 HydrophobicContact CB-CD 4.49Å; A95-K100 WeakPolarHBondContact O-CB 3.35Å; A95-K100 PolarHBondContact O-N 3.45Å; A95-L101 HydrophobicContact CB-CD1 4.36Å; A95-L101 PolarHBondContact O-N 2.85Å
96Q95.8Very high94.9Very high11 Ų1159.7 Ų59.75%0.05134%0.336CS..Hα-helixtrans-71.2-41.2172.6-70.9178.9-42.200111.8I92 D93 V94 D98 G99 L101 P102 F103I92-Q96 HydrophobicContact CG2-CG 4.46Å; I92-Q96 WeakPolarHBondContact O-CG 3.16Å; I92-Q96 PolarHBondContact O-N 3.47Å; D93-Q96 PolarHBondContact O-N 3.03Å; V94-Q96 VanDerWaalsContact C-N 3.29Å; V94-Q96 PolarHBondContact O-N 3.49Å; Q96-D98 VanDerWaalsContact C-N 3.32Å; Q96-D98 PolarHBondContact O-N 2.9Å; Q96-G99 PolarHBondContact O-N 3.14Å; Q96-L101 WeakPolarHBondContact CA-O 3.32Å; Q96-L101 HydrophobicContact CG-CB 3.79Å; Q96-P102 PolarHBondContact NE2-O 3.48Å; Q96-F103 HydrophobicContact CB-CD1 3.91Å; Q96-F103 HydrophobicContact CB-CD2 4.41Å; Q96-F103 HydrophobicContact CB-CE1 3.56Å; Q96-F103 HydrophobicContact CB-CE2 4.09Å; Q96-F103 HydrophobicContact CB-CG 4.33Å; Q96-F103 HydrophobicContact CB-CZ 3.67Å; Q96-F103 HydrophobicContact CG-CD1 4.45Å; Q96-F103 VanDerWaalsContact O-CE2 3.31Å; Q96-F103 WeakPolarHBondContact O-CE2 3.33Å
97Q95.6Very high94.8Very high140 Ų14060.8 Ų60.865%0.65434%0.337SS*.Hα-helixtrans-62.7-38.3174.4-69.3171.127.100112.4D93 V94 G99 F103D93-Q97 VanDerWaalsContact O-CG 3.3Å; D93-Q97 WeakPolarHBondContact O-CG 3.4Å; D93-Q97 PolarHBondContact O-N 3.43Å; V94-Q97 PolarHBondContact O-N 3.01Å; Q97-G99 PolarHBondContact O-N 3.26Å; Q97-F103 HydrophobicContact CG-CZ 4.19Å
98D95.9Very high94.9Very high96 Ų9662.7 Ų62.751%0.51334%0.344SS..THydrogen-bonded Turntrans-71.1-9.8174.4-76.1-7.4000113.2V94 Q96 K100V94-D98 WeakPolarHBondContact O-CB 3.32Å; V94-D98 PolarHBondContact O-N 3.14Å; Q96-D98 VanDerWaalsContact C-N 3.32Å; Q96-D98 PolarHBondContact O-N 2.9Å; D98-K100 VanDerWaalsContact C-N 3.3Å; D98-K100 HydrophobicContact CB-CD 4.26Å; D98-K100 HydrophobicContact CB-CG 4.14Å; D98-K100 PolarHBondContact O-N 2.53Å; D98-K100 IonicContact OD2-NZ 3.89Å; D98-K100 PolarHBondContact OD2-NZ 3.36Å
99G94.1Very high95Very high63 Ų6365.5 Ų65.565%0.64936%0.357SS*.THydrogen-bonded Turntrans73.915.1-176.100000114.8A95 Q96 Q97A95-G99 PolarHBondContact O-N 3.18Å; Q96-G99 PolarHBondContact O-N 3.14Å; Q97-G99 PolarHBondContact O-N 3.26Å
100K95.1Very high95Very high128 Ų12864.8 Ų64.856%0.55735%0.352SS*.SBendtrans-74.8-29.2173.4-63.6171.3-176.5145.40111.9A95 D98A95-K100 HydrophobicContact CB-CB 4.29Å; A95-K100 HydrophobicContact CB-CD 4.49Å; A95-K100 WeakPolarHBondContact O-CB 3.35Å; A95-K100 PolarHBondContact O-N 3.45Å; D98-K100 VanDerWaalsContact C-N 3.3Å; D98-K100 HydrophobicContact CB-CD 4.26Å; D98-K100 HydrophobicContact CB-CG 4.14Å; D98-K100 PolarHBondContact O-N 2.53Å; D98-K100 IonicContact OD2-NZ 3.89Å; D98-K100 PolarHBondContact OD2-NZ 3.36Å
101L96.1Very high95.2Very high6 Ų660.5 Ų60.53%0.03133%0.33CS..SBendtrans-125.6144.8172.4-71.4175.7000109.7I71 I92 A95 Q96 V171I71-L101 HydrophobicContact CD1-CD1 3.75Å; I71-L101 HydrophobicContact CD1-CG 4.11Å; I71-L101 HydrophobicContact CG1-CD1 3.97Å; I71-L101 HydrophobicContact CG1-CD2 4.27Å; I71-L101 HydrophobicContact CG1-CG 4.02Å; I92-L101 HydrophobicContact CG2-CD1 4.13Å; A95-L101 HydrophobicContact CB-CD1 4.36Å; A95-L101 PolarHBondContact O-N 2.85Å; Q96-L101 WeakPolarHBondContact CA-O 3.32Å; Q96-L101 HydrophobicContact CG-CB 3.79Å; L101-V171 HydrophobicContact CD1-CG2 4.03Å
102P96.2Very high95.3Very high61 Ų6158 Ų5840%0.39632%0.32SS..  trans-73150.9171.931.5-33.9000110.9V68 Q96V68-P102 HydrophobicContact CG1-CG 4.07Å; V68-P102 VanDerWaalsContact CG1-O 3.27Å; V68-P102 WeakPolarHBondContact CG1-O 3.4Å; V68-P102 VanDerWaalsContact O-CD 3.28Å; V68-P102 WeakPolarHBondContact O-CD 3.31Å; V68-P102 WeakPolarHBondContact O-CG 3.33Å; Q96-P102 PolarHBondContact NE2-O 3.48Å
103F93Very high95.4Very high88 Ų8858.3 Ų58.339%0.38632%0.322SS..SBendtrans-71.9-33.7170.5-75.3-79.7000112.4Q96 Q97 L148Q96-F103 HydrophobicContact CB-CD1 3.91Å; Q96-F103 HydrophobicContact CB-CD2 4.41Å; Q96-F103 HydrophobicContact CB-CE1 3.56Å; Q96-F103 HydrophobicContact CB-CE2 4.09Å; Q96-F103 HydrophobicContact CB-CG 4.33Å; Q96-F103 HydrophobicContact CB-CZ 3.67Å; Q96-F103 HydrophobicContact CG-CD1 4.45Å; Q96-F103 VanDerWaalsContact O-CE2 3.31Å; Q96-F103 WeakPolarHBondContact O-CE2 3.33Å; Q97-F103 HydrophobicContact CG-CZ 4.19Å; F103-L148 HydrophobicContact CB-CD1 4.11Å; F103-L148 HydrophobicContact CD1-CD1 4.23Å; F103-L148 HydrophobicContact CD1-CD2 4.25Å
104V93.4Very high95.5Very high101 Ų10155.9 Ų55.961%0.61231%0.309SS*.SBendtrans-121.1125-177.7-176.10000108.2
105P95.1Very high95.5Very high7 Ų754.1 Ų54.15%0.04530%0.3CS..  trans-67.3167.1176.829.3-35000111.6K66 Y67 V68 Q173K66-P105 HydrophobicContact CB-CB 3.98Å; K66-P105 HydrophobicContact CB-CG 3.86Å; K66-P105 HydrophobicContact CD-CG 4.16Å; Y67-P105 VanDerWaalsContact O-CB 3.27Å; Y67-P105 WeakPolarHBondContact O-CB 3.44Å; V68-P105 HydrophobicContact CB-CB 4.48Å; V68-P105 HydrophobicContact CG2-CB 3.92Å; V68-P105 HydrophobicContact CG2-CG 4.18Å; P105-Q173 HydrophobicContact CG-CB 3.96Å; P105-Q173 HydrophobicContact CG-CG 4.44Å; P105-Q173 VanDerWaalsContact CG-OE1 3.31Å
106G93.5Very high95.4Very high49 Ų4957.5 Ų57.551%0.50531%0.314SS..  trans-61.9168.9168.800000113K66 E108K66-G106 WeakPolarHBondContact CD-O 3.32Å; G106-E108 VanDerWaalsContact C-N 3.26Å; G106-E108 PolarHBondContact O-N 2.89Å
107E93.3Very high95.3Very high153 Ų15365 Ų6572%0.71534%0.343SS*.SBendtrans-75.6-15178.4-68.1-55.5146.500113.9K66K66-E107 IonicContact NZ-OE1 2.84Å; K66-E107 IonicContact NZ-OE2 3.38Å; K66-E107 PolarHBondContact NZ-OE2 3.42Å
108E94.4Very high95.3Very high116 Ų11658.5 Ų58.554%0.54231%0.314SS..  trans-67.2131.5-179.2-169175.5-17700112.1G106 F110G106-E108 VanDerWaalsContact C-N 3.26Å; G106-E108 PolarHBondContact O-N 2.89Å; E108-F110 HydrophobicContact CB-CE2 4.2Å; E108-F110 HydrophobicContact CB-CZ 4.25Å; E108-F110 VanDerWaalsContact CD-CZ 3.48Å; E108-F110 HydrophobicContact CG-CE1 4.27Å; E108-F110 HydrophobicContact CG-CE2 4.07Å; E108-F110 HydrophobicContact CG-CZ 3.77Å
109E96.1Very high95.4Very high59 Ų5954.2 Ų54.228%0.27629%0.29SS..EExtended strand (participates in β ladder)trans-98.8141.3174.3-65.7-167.9151.500111.5R64 K66R64-E109 IonicContact NH1-OE2 2.7Å; R64-E109 PolarHBondContact NH1-OE2 2.83Å; K66-E109 HydrophobicContact CG-CG 4.42Å
110F97.3Very high95.6Very high17 Ų1755 Ų558%0.07528%0.276CS..EExtended strand (participates in β ladder)trans-117.8153.6176.7-60.7-81.4000110.5R64 V65 E108 V121 S122 T123 L130R64-F110 WeakPolarHBondContact CA-O 3.36Å; V65-F110 PolarHBondContact N-O 2.97Å; V65-F110 PolarHBondContact O-N 3.28Å; E108-F110 HydrophobicContact CB-CE2 4.2Å; E108-F110 HydrophobicContact CB-CZ 4.25Å; E108-F110 VanDerWaalsContact CD-CZ 3.48Å; E108-F110 HydrophobicContact CG-CE1 4.27Å; E108-F110 HydrophobicContact CG-CE2 4.07Å; E108-F110 HydrophobicContact CG-CZ 3.77Å; F110-V121 HydrophobicContact CB-CG1 3.79Å; F110-V121 HydrophobicContact CG-CG1 4.36Å; F110-S122 CarbonylContact C-O 3.54Å; F110-S122 WeakPolarHBondContact CA-O 3.38Å; F110-S122 WeakPolarHBondContact CB-O 3.47Å; F110-T123 HydrophobicContact CE1-CG2 4.49Å; F110-L130 HydrophobicContact CD1-CD1 3.85Å; F110-L130 HydrophobicContact CD1-CD2 3.69Å; F110-L130 HydrophobicContact CD1-CG 4.44Å; F110-L130 HydrophobicContact CE1-CD1 3.86Å; F110-L130 HydrophobicContact CE1-CD2 3.36Å; F110-L130 HydrophobicContact CE1-CG 4.27Å; F110-L130 HydrophobicContact CZ-CD2 3.92Å
111I97.5Very high95.7Very high11 Ų1148.9 Ų48.96%0.05625%0.25CC..EExtended strand (participates in β ladder)trans-94.5114.3173.3-64.4170.3000108.2E62 V121 S122 S124 Q126E62-I111 HydrophobicContact CB-CG2 4.14Å; E62-I111 HydrophobicContact CG-CG2 4.35Å; I111-V121 WeakPolarHBondContact O-CA 3.42Å; I111-S122 PolarHBondContact N-O 3.04Å; I111-S122 PolarHBondContact O-N 3Å; I111-S124 WeakPolarHBondContact CD1-O 3.46Å; I111-Q126 HydrophobicContact CD1-CG 3.64Å
112M97.8Very high95.7Very high1 Ų148.8 Ų48.81%0.00525%0.249CC..EExtended strand (participates in β ladder)trans-97.5106.7171.9179.6179.8-78.100109.6E62 F63 V65 V114 I119 K120 V121 Y172 I183E62-M112 CarbonylContact C-O 3.59Å; E62-M112 WeakPolarHBondContact CA-O 3.38Å; F63-M112 PolarHBondContact N-O 2.92Å; F63-M112 PolarHBondContact O-N 3.43Å; V65-M112 HydrophobicContact CG1-CB 4.3Å; V65-M112 HydrophobicContact CG1-SD 4.5Å; V65-M112 HydrophobicContact CG2-CB 3.76Å; V65-M112 HydrophobicContact CG2-CE 4.14Å; M112-V114 HydrophobicContact CG-CG2 4.31Å; M112-I119 HydrophobicContact CE-CG2 4.21Å; M112-I119 HydrophobicContact CG-CG2 3.6Å; M112-I119 HydrophobicContact SD-CG2 4.07Å; M112-K120 CarbonylContact C-O 3.51Å; M112-K120 WeakPolarHBondContact CA-O 3.4Å; M112-V121 HydrophobicContact CE-CG2 4.15Å; M112-V121 HydrophobicContact CG-CG2 4.42Å; M112-Y172 HydrophobicContact CE-CD1 3.79Å; M112-Y172 HydrophobicContact CE-CD2 3.47Å; M112-Y172 VanDerWaalsContact CE-CD2 3.47Å; M112-Y172 HydrophobicContact CE-CE1 4.07Å; M112-Y172 HydrophobicContact CE-CE2 3.74Å; M112-Y172 HydrophobicContact CE-CG 3.49Å; M112-Y172 VanDerWaalsContact CE-CG 3.49Å; M112-I183 HydrophobicContact SD-CD1 4.26Å; M112-I183 HydrophobicContact SD-CG2 4.1Å
113G96.7Very high95.7Very high5 Ų546.7 Ų46.75%0.05224%0.235CC..EExtended strand (participates in β ladder)trans-92.3124.5171.100000111.3A61 I119 K120A61-G113 CarbonylContact O-C 3.58Å; A61-G113 WeakPolarHBondContact O-CA 3.33Å; G113-I119 CarbonylContact O-C 3.58Å; G113-I119 WeakPolarHBondContact O-CA 3.37Å; G113-K120 PolarHBondContact N-O 2.9Å; G113-K120 PolarHBondContact O-N 2.77Å
114V97.3Very high95.7Very high0 Ų045.3 Ų45.30%024%0.237CC..EExtended strand (participates in β ladder)trans-110.4129.5175.6-170.30000108.9C60 A61 F63 M112 I119 I183 V186 L187C60-V114 WeakPolarHBondContact CA-O 3.31Å; A61-V114 PolarHBondContact N-O 3.09Å; A61-V114 PolarHBondContact O-N 3.02Å; F63-V114 HydrophobicContact CD2-CG2 4.27Å; F63-V114 HydrophobicContact CE2-CG2 4.19Å; M112-V114 HydrophobicContact CG-CG2 4.31Å; V114-I119 HydrophobicContact CG1-CG1 4.43Å; V114-I119 HydrophobicContact CG2-CG1 4.43Å; V114-I183 HydrophobicContact CG2-CG2 4.09Å; V114-V186 HydrophobicContact CB-CB 4.49Å; V114-V186 HydrophobicContact CB-CG1 3.9Å; V114-V186 HydrophobicContact CG1-CB 4.26Å; V114-V186 HydrophobicContact CG1-CG1 3.76Å; V114-L187 HydrophobicContact CG1-CB 4.09Å; V114-L187 HydrophobicContact CG1-CD1 4.2Å
115S95.1Very high95.6Very high22 Ų2244.9 Ų44.915%0.15423%0.231CC..EExtended strand (participates in β ladder)trans-151.8179.6179.769.90000111.7Y117 G118S115-Y117 PolarHBondContact O-N 3.03Å; S115-Y117 PolarHBondContact OG-N 2.87Å; S115-G118 PolarHBondContact N-O 2.94Å; S115-G118 PolarHBondContact O-N 2.89Å
116K93.7Very high95.2Very high73 Ų7349.9 Ų49.932%0.31725%0.254SS..THydrogen-bonded Turntrans-56.9-17.8171.273.6-173-174.9-1650114.7D58 L135D58-K116 WeakPolarHBondContact OD1-CE 3.19Å; D58-K116 IonicContact OD1-NZ 2.69Å; D58-K116 PolarHBondContact OD1-NZ 2.86Å; K116-L135 WeakPolarHBondContact O-CD2 3.46Å
117Y94.6Very high94.9Very high170 Ų17056.6 Ų56.667%0.66727%0.265SS*.THydrogen-bonded Turntrans-84.8-17176.1-58.2-70.8000113S115 L135S115-Y117 PolarHBondContact O-N 3.03Å; S115-Y117 PolarHBondContact OG-N 2.87Å; Y117-L135 PolarHBondContact O-N 3.21Å
118G95.8Very high95Very high3 Ų354.6 Ų54.63%0.03126%0.259CS..EExtended strand (participates in β ladder)trans124.2-149.2-174.600000112.1S115 H133S115-G118 PolarHBondContact N-O 2.94Å; S115-G118 PolarHBondContact O-N 2.89Å; G118-H133 CarbonylContact C-O 3.58Å; G118-H133 WeakPolarHBondContact CA-O 3.43Å
119I97.9Very high95.1Very high5 Ų551.4 Ų51.43%0.02625%0.248CC..EExtended strand (participates in β ladder)trans-112.8127.3-177.2-55.5172.3000109.5M112 G113 V114 V121 H133 I138 M141 L157 L187M112-I119 HydrophobicContact CE-CG2 4.21Å; M112-I119 HydrophobicContact CG-CG2 3.6Å; M112-I119 HydrophobicContact SD-CG2 4.07Å; G113-I119 CarbonylContact O-C 3.58Å; G113-I119 WeakPolarHBondContact O-CA 3.37Å; V114-I119 HydrophobicContact CG1-CG1 4.43Å; V114-I119 HydrophobicContact CG2-CG1 4.43Å; I119-V121 HydrophobicContact CG2-CG2 4.24Å; I119-H133 HydrophobicContact CB-CB 4.22Å; I119-H133 PolarHBondContact N-O 3.06Å; I119-H133 PolarHBondContact O-N 3.37Å; I119-I138 HydrophobicContact CD1-CD1 3.9Å; I119-I138 HydrophobicContact CG1-CD1 3.96Å; I119-M141 HydrophobicContact CD1-SD 4.07Å; I119-L157 HydrophobicContact CD1-CD1 3.96Å; I119-L157 HydrophobicContact CD1-CD2 4.04Å; I119-L187 HydrophobicContact CD1-CD1 4.36Å; I119-L187 HydrophobicContact CD1-CD2 4.25Å; I119-L187 HydrophobicContact CG1-CD1 4.28Å
120K97.4Very high95Very high79 Ų7951.6 Ų51.634%0.34325%0.25SS..EExtended strand (participates in β ladder)trans-113.2129.9173.2-176.6-174.267.1172.40108.7M112 G113 V129 H131 R132M112-K120 CarbonylContact C-O 3.51Å; M112-K120 WeakPolarHBondContact CA-O 3.4Å; G113-K120 PolarHBondContact N-O 2.9Å; G113-K120 PolarHBondContact O-N 2.77Å; K120-V129 HydrophobicContact CD-CG1 4.39Å; K120-V129 HydrophobicContact CD-CG2 4.44Å; K120-V129 HydrophobicContact CG-CG1 3.86Å; K120-H131 WeakPolarHBondContact CA-O 3.49Å; K120-R132 HydrophobicContact CG-CG 4.38Å
121V97.6Very high94.9Very high1 Ų152.5 Ų52.51%0.00626%0.255CS..EExtended strand (participates in β ladder)trans-116.9123174.9-1740000108.8F110 I111 M112 I119 L130 H131 Y172F110-V121 HydrophobicContact CB-CG1 3.79Å; F110-V121 HydrophobicContact CG-CG1 4.36Å; I111-V121 WeakPolarHBondContact O-CA 3.42Å; M112-V121 HydrophobicContact CE-CG2 4.15Å; M112-V121 HydrophobicContact CG-CG2 4.42Å; I119-V121 HydrophobicContact CG2-CG2 4.24Å; V121-L130 PolarHBondContact O-N 2.81Å; V121-H131 HydrophobicContact CB-CB 4.28Å; V121-H131 PolarHBondContact N-O 2.85Å; V121-H131 PolarHBondContact O-N 3.29Å; V121-H131 VanDerWaalsContact O-N 3.14Å; V121-Y172 HydrophobicContact CG1-CE1 4.33Å; V121-Y172 HydrophobicContact CG2-CE1 4Å
122S97Very high94.9Very high3 Ų360.6 Ų60.62%0.02128%0.284CS..EExtended strand (participates in β ladder)trans-130.3163.1179.356.60000111.8F110 I111 D128F110-S122 CarbonylContact C-O 3.54Å; F110-S122 WeakPolarHBondContact CA-O 3.38Å; F110-S122 WeakPolarHBondContact CB-O 3.47Å; I111-S122 PolarHBondContact N-O 3.04Å; I111-S122 PolarHBondContact O-N 3Å; S122-D128 CarbonylContact C-O 3.55Å; S122-D128 WeakPolarHBondContact CA-O 3.38Å; S122-D128 WeakPolarHBondContact CB-O 3.38Å
123T95.6Very high94.9Very high17 Ų1761.1 Ų61.110%0.10429%0.287CS..EExtended strand (participates in β ladder)trans-57.5157.8168.851.90000111.1F110 D125 Q126 D128 L130F110-T123 HydrophobicContact CE1-CG2 4.49Å; T123-D125 WeakPolarHBondContact CB-OD1 3.31Å; T123-D125 PolarHBondContact O-N 3.13Å; T123-D125 PolarHBondContact OG1-OD1 3.15Å; T123-Q126 WeakPolarHBondContact O-CA 3.4Å; T123-Q126 PolarHBondContact O-N 3.49Å; T123-D128 HydrophobicContact CG2-CB 3.87Å; T123-D128 PolarHBondContact N-O 3.35Å; T123-D128 PolarHBondContact OG1-N 3.23Å; T123-D128 VanDerWaalsContact OG1-N 3.14Å; T123-D128 PolarHBondContact OG1-O 3.43Å; T123-L130 HydrophobicContact CG2-CD1 3.75Å
124S91.9Very high94.9Very high60 Ų6062.3 Ų62.342%0.4230%0.296SS..THydrogen-bonded Turntrans-64-25.2-177.759.70000114.1I111 Q126I111-S124 WeakPolarHBondContact CD1-O 3.46Å; S124-Q126 VanDerWaalsContact C-N 3.3Å
125D91.5Very high94.8Very high92 Ų9263 Ų6349%0.49230%0.299SS..THydrogen-bonded Turntrans-84.6-3.4173.7651.2000113.4T123 Y127T123-D125 WeakPolarHBondContact CB-OD1 3.31Å; T123-D125 PolarHBondContact O-N 3.13Å; T123-D125 PolarHBondContact OG1-OD1 3.15Å; D125-Y127 HydrophobicContact CB-CD2 3.86Å; D125-Y127 HydrophobicContact CB-CE2 4.46Å; D125-Y127 WeakPolarHBondContact O-CD2 3.33Å; D125-Y127 PolarHBondContact O-N 2.85Å; D125-Y127 PolarHBondContact OD1-N 2.78Å
126Q86.4Confident94.8Very high111 Ų11170.6 Ų70.652%0.51933%0.326SS..SBendtrans60.614.5179.9-53.6-176.132.600115.5I111 T123 S124I111-Q126 HydrophobicContact CD1-CG 3.64Å; T123-Q126 WeakPolarHBondContact O-CA 3.4Å; T123-Q126 PolarHBondContact O-N 3.49Å; S124-Q126 VanDerWaalsContact C-N 3.3Å
127Y88.5Confident94.9Very high191 Ų19168.8 Ų68.875%0.74932%0.32SS*.SBendtrans-76.4-43.4176.5-81.3-80.6000111.9D125D125-Y127 HydrophobicContact CB-CD2 3.86Å; D125-Y127 HydrophobicContact CB-CE2 4.46Å; D125-Y127 WeakPolarHBondContact O-CD2 3.33Å; D125-Y127 PolarHBondContact O-N 2.85Å; D125-Y127 PolarHBondContact OD1-N 2.78Å
128D94.3Very high94.9Very high110 Ų11061.2 Ų61.259%0.58829%0.291SS*.  trans-111.1131.2-174.9-70.4-38.1000111.8S122 T123S122-D128 CarbonylContact C-O 3.55Å; S122-D128 WeakPolarHBondContact CA-O 3.38Å; S122-D128 WeakPolarHBondContact CB-O 3.38Å; T123-D128 HydrophobicContact CG2-CB 3.87Å; T123-D128 PolarHBondContact N-O 3.35Å; T123-D128 PolarHBondContact OG1-N 3.23Å; T123-D128 VanDerWaalsContact OG1-N 3.14Å; T123-D128 PolarHBondContact OG1-O 3.43Å
129V96.3Very high94.9Very high50 Ų5065 Ų6530%0.30331%0.313SS..EExtended strand (participates in β ladder)trans-99.9113.4173.9-177.80000109K120 R132K120-V129 HydrophobicContact CD-CG1 4.39Å; K120-V129 HydrophobicContact CD-CG2 4.44Å; K120-V129 HydrophobicContact CG-CG1 3.86Å; V129-R132 HydrophobicContact CG1-CG 3.91Å
130L94.7Very high94.7Very high63 Ų6369.4 Ų69.433%0.3333%0.329SS..EExtended strand (participates in β ladder)trans-73.8-51.6179-76.373.4000110.7F110 V121 T123F110-L130 HydrophobicContact CD1-CD1 3.85Å; F110-L130 HydrophobicContact CD1-CD2 3.69Å; F110-L130 HydrophobicContact CD1-CG 4.44Å; F110-L130 HydrophobicContact CE1-CD1 3.86Å; F110-L130 HydrophobicContact CE1-CD2 3.36Å; F110-L130 HydrophobicContact CE1-CG 4.27Å; F110-L130 HydrophobicContact CZ-CD2 3.92Å; V121-L130 PolarHBondContact O-N 2.81Å; T123-L130 HydrophobicContact CG2-CD1 3.75Å
131H96.1Very high94.7Very high36 Ų3667.2 Ų67.217%0.16732%0.321CS..EExtended strand (participates in β ladder)trans-138.8145.3-171.7-55.4-59.1000112.5Y67 K120 V121 W170Y67-H131 AromaticContact CZ-NE2 3.91Å; K120-H131 WeakPolarHBondContact CA-O 3.49Å; V121-H131 HydrophobicContact CB-CB 4.28Å; V121-H131 PolarHBondContact N-O 2.85Å; V121-H131 PolarHBondContact O-N 3.29Å; V121-H131 VanDerWaalsContact O-N 3.14Å; H131-W170 AromaticContact CE1-CZ3 3.4Å; H131-W170 VanDerWaalsContact CE1-CZ3 3.4Å; H131-W170 WeakPolarHBondContact CE1-CZ3 3.27Å; H131-W170 AromaticContact ND1-CZ3 3.57Å; H131-W170 AromaticContact NE2-CZ3 3.9Å
132R97Very high94.6Very high180 Ų18067.9 Ų67.968%0.67933%0.325SS*.EExtended strand (participates in β ladder)trans-130102.2168.7-70.6-176.6174.786.9-3.9108.4K120 V129 A134K120-R132 HydrophobicContact CG-CG 4.38Å; V129-R132 HydrophobicContact CG1-CG 3.91Å; R132-A134 PolarHBondContact O-N 2.96Å
133H97.3Very high94.6Very high13 Ų1369.7 Ų69.76%0.0634%0.337CS..EExtended strand (participates in β ladder)trans-9495.1175.7-53-52.9000108.2G118 I119 I138 L157 T159 W170 Y172G118-H133 CarbonylContact C-O 3.58Å; G118-H133 WeakPolarHBondContact CA-O 3.43Å; I119-H133 HydrophobicContact CB-CB 4.22Å; I119-H133 PolarHBondContact N-O 3.06Å; I119-H133 PolarHBondContact O-N 3.37Å; H133-I138 HydrophobicContact CB-CD1 4.19Å; H133-I138 HydrophobicContact CB-CG1 4.23Å; H133-L157 HydrophobicContact CB-CD2 3.97Å; H133-L157 WeakPolarHBondContact CD2-CD2 3.32Å; H133-T159 HydrophobicContact CB-CG2 4.31Å; H133-W170 AromaticContact CE1-CD1 3.79Å; H133-W170 AromaticContact CE1-CD2 3.38Å; H133-W170 AromaticContact CE1-CE2 3.37Å; H133-W170 AromaticContact CE1-CE3 3.86Å; H133-W170 AromaticContact CE1-CG 3.7Å; H133-W170 AromaticContact CE1-CZ2 3.87Å; H133-W170 AromaticContact CE1-NE1 3.57Å; H133-W170 AromaticContact ND1-NE1 3.9Å; H133-W170 AromaticContact NE2-CD2 3.91Å; H133-W170 AromaticContact NE2-CG 3.91Å; H133-Y172 PolarHBondContact NE2-OH 3.44Å
134A96.6Very high94.7Very high29 Ų2970 Ų7024%0.2434%0.336CS..EExtended strand (participates in β ladder)trans-62.2140-179.800000110.9R132 Y136 L137 I138R132-A134 PolarHBondContact O-N 2.96Å; A134-Y136 VanDerWaalsContact C-N 3.25Å; A134-Y136 HydrophobicContact CB-CD1 3.71Å; A134-Y136 HydrophobicContact CB-CE1 3.47Å; A134-Y136 VanDerWaalsContact CB-CE1 3.47Å; A134-Y136 PolarHBondContact O-N 3.37Å; A134-Y136 VanDerWaalsContact O-N 3.15Å; A134-L137 HydrophobicContact CB-CD1 4.33Å; A134-L137 HydrophobicContact CB-CG 4.46Å; A134-L137 PolarHBondContact O-N 3.44Å; A134-I138 PolarHBondContact O-N 3.46Å
135L95.5Very high94.9Very high14 Ų1471.4 Ų71.47%0.07334%0.339CS..G310 helixtrans-54.9-40.3-172-168.468000112.9K116 Y117 L137 I138 L187 A190 F191 V194K116-L135 WeakPolarHBondContact O-CD2 3.46Å; Y117-L135 PolarHBondContact O-N 3.21Å; L135-L137 PolarHBondContact O-N 3.32Å; L135-I138 PolarHBondContact O-N 2.89Å; L135-L187 HydrophobicContact CD1-CD1 3.62Å; L135-A190 HydrophobicContact CD1-CB 4.42Å; L135-A190 HydrophobicContact CD2-CB 4.45Å; L135-F191 HydrophobicContact CD1-CD1 3.87Å; L135-F191 HydrophobicContact CD1-CD2 4.29Å; L135-F191 HydrophobicContact CD1-CE1 3.58Å; L135-F191 HydrophobicContact CD1-CE2 4.04Å; L135-F191 HydrophobicContact CD1-CG 4.22Å; L135-F191 HydrophobicContact CD1-CZ 3.68Å; L135-F191 HydrophobicContact CD2-CD1 4.15Å; L135-F191 HydrophobicContact CD2-CE1 4.42Å; L135-F191 HydrophobicContact CG-CD1 3.86Å; L135-F191 HydrophobicContact CG-CE1 3.64Å; L135-F191 HydrophobicContact CG-CZ 4.23Å; L135-V194 HydrophobicContact CD2-CB 4.49Å; L135-V194 HydrophobicContact CD2-CG2 3.84Å
136Y94.8Very high94.9Very high182 Ų18268 Ų6871%0.71432%0.321SS*.G310 helixtrans-70-15.4-17977.6-84.8000114.5A134A134-Y136 VanDerWaalsContact C-N 3.25Å; A134-Y136 HydrophobicContact CB-CD1 3.71Å; A134-Y136 HydrophobicContact CB-CE1 3.47Å; A134-Y136 VanDerWaalsContact CB-CE1 3.47Å; A134-Y136 PolarHBondContact O-N 3.37Å; A134-Y136 VanDerWaalsContact O-N 3.15Å
137L95.6Very high95.2Very high36 Ų3665.8 Ų65.819%0.18833%0.328CS..G310 helixtrans-96.2-10.5176.8-64.2178.7000112.6A134 L135 V139 T159 T160A134-L137 HydrophobicContact CB-CD1 4.33Å; A134-L137 HydrophobicContact CB-CG 4.46Å; A134-L137 PolarHBondContact O-N 3.44Å; L135-L137 PolarHBondContact O-N 3.32Å; L137-V139 PolarHBondContact O-N 3.43Å; L137-T159 CarbonylContact O-C 3.58Å; L137-T159 VanDerWaalsContact O-CA 3.27Å; L137-T159 WeakPolarHBondContact O-CA 3.35Å; L137-T160 PolarHBondContact O-N 3.39Å
138I96Very high95.3Very high11 Ų1161 Ų616%0.05632%0.315CS..EExtended strand (participates in β ladder)trans-79116.8178.5-64.9171.7000108.4I119 H133 A134 L135 L157 T159 L187 F191I119-I138 HydrophobicContact CD1-CD1 3.9Å; I119-I138 HydrophobicContact CG1-CD1 3.96Å; H133-I138 HydrophobicContact CB-CD1 4.19Å; H133-I138 HydrophobicContact CB-CG1 4.23Å; A134-I138 PolarHBondContact O-N 3.46Å; L135-I138 PolarHBondContact O-N 2.89Å; I138-L157 HydrophobicContact CD1-CD1 4.3Å; I138-L157 HydrophobicContact CG1-CD1 4.2Å; I138-L157 HydrophobicContact CG2-CD1 3.62Å; I138-T159 HydrophobicContact CG1-CG2 4.27Å; I138-L187 HydrophobicContact CD1-CD1 4.22Å; I138-L187 HydrophobicContact CG2-CD2 4.47Å; I138-F191 HydrophobicContact CB-CZ 4.03Å; I138-F191 HydrophobicContact CG2-CE2 4.41Å; I138-F191 HydrophobicContact CG2-CZ 3.94Å
139V94.1Very high95Very high81 Ų8159.4 Ų59.449%0.49132%0.324SS..EExtended strand (participates in β ladder)trans-85.4-44.3178.3179.90000110.5L137 K158 T160L137-V139 PolarHBondContact O-N 3.43Å; V139-K158 HydrophobicContact CB-CD 4.32Å; V139-K158 HydrophobicContact CB-CG 4.23Å; V139-K158 HydrophobicContact CG1-CD 4.21Å; V139-K158 PolarHBondContact N-O 2.78Å; V139-T160 HydrophobicContact CG2-CG2 3.87Å
140R94.5Very high94.7Very high99 Ų9960.3 Ų60.337%0.37434%0.337SS..EExtended strand (participates in β ladder)trans-161.2149-177.4-177.1-174.9-71-94.66.8110.4E83 V142 K158E83-R140 PolarHBondContact O-NH2 2.87Å; R140-V142 HydrophobicContact CG-CG2 3.85Å; R140-K158 PolarHBondContact N-O 2.91Å; R140-K158 PolarHBondContact O-N 2.83Å
141M96.9Very high94.4Very high32 Ų3259.4 Ų59.416%0.15834%0.343CS..EExtended strand (participates in β ladder)trans-123.9134.6162.6-169.5168.171.200109.6I119 L155 A156 L157 I183 C184 L187I119-M141 HydrophobicContact CD1-SD 4.07Å; M141-L155 HydrophobicContact CG-CD2 4.49Å; M141-A156 CarbonylContact C-O 3.57Å; M141-A156 WeakPolarHBondContact CA-O 3.18Å; M141-L157 HydrophobicContact CB-CD1 3.91Å; M141-L157 HydrophobicContact CG-CD1 4.11Å; M141-L157 HydrophobicContact SD-CD1 4.19Å; M141-I183 HydrophobicContact CE-CG2 3.71Å; M141-I183 HydrophobicContact SD-CG2 4.2Å; M141-C184 HydrophobicContact CE-CB 4.17Å; M141-L187 HydrophobicContact CB-CD2 3.84Å; M141-L187 HydrophobicContact CE-CB 3.92Å; M141-L187 HydrophobicContact CE-CD2 3.4Å; M141-L187 VanDerWaalsContact CE-CD2 3.4Å; M141-L187 HydrophobicContact CE-CG 4.31Å; M141-L187 HydrophobicContact CG-CD2 4.47Å; M141-L187 HydrophobicContact SD-CD2 3.79Å
142V97.1Very high94.4Very high16 Ų1661.6 Ų61.610%0.09735%0.352CS..EExtended strand (participates in β ladder)trans-123.5128.3179-178.10000109.1P85 L88 I89 R140 Y144 L155 A156P85-V142 HydrophobicContact CB-CG1 4.33Å; P85-V142 HydrophobicContact CB-CG2 3.83Å; L88-V142 HydrophobicContact CD2-CB 4.4Å; L88-V142 HydrophobicContact CD2-CG2 3.91Å; I89-V142 HydrophobicContact CD1-CG1 3.93Å; I89-V142 HydrophobicContact CG1-CG1 4.16Å; R140-V142 HydrophobicContact CG-CG2 3.85Å; V142-Y144 HydrophobicContact CG1-CD1 4.4Å; V142-L155 WeakPolarHBondContact O-CA 3.19Å; V142-A156 PolarHBondContact N-O 2.91Å; V142-A156 PolarHBondContact O-N 2.89Å
143C96.9Very high94.4Very high40 Ų4053.2 Ų53.227%0.2732%0.321SS..EExtended strand (participates in β ladder)trans-99.6128.7169.5175.20000109.1L154 L155 A180C143-L154 VanDerWaalsContact CA-O 3.32Å; C143-L154 WeakPolarHBondContact CA-O 3.48Å; C143-L155 HydrophobicContact CB-CD2 3.73Å; C143-A180 HydrophobicContact CB-CB 4.48Å; C143-A180 WeakPolarHBondContact SG-CB 3.3Å
144Y96.7Very high94.4Very high23 Ų2352.7 Ų52.79%0.0932%0.318CS..EExtended strand (participates in β ladder)trans-148.5165.3178.268-74.7000111.7I89 I92 V142 S153 L154 A156I89-Y144 HydrophobicContact CD1-CD1 4.31Å; I89-Y144 HydrophobicContact CD1-CD2 4.38Å; I89-Y144 HydrophobicContact CD1-CG 3.93Å; I89-Y144 HydrophobicContact CG1-CD1 3.87Å; I89-Y144 HydrophobicContact CG1-CD2 4.12Å; I89-Y144 HydrophobicContact CG1-CE1 4.21Å; I89-Y144 HydrophobicContact CG1-CE2 4.44Å; I89-Y144 HydrophobicContact CG1-CG 3.83Å; I89-Y144 HydrophobicContact CG2-CD2 3.81Å; I89-Y144 HydrophobicContact CG2-CE2 3.85Å; I89-Y144 HydrophobicContact CG2-CG 4.39Å; I92-Y144 WeakPolarHBondContact CG2-OH 3.48Å; V142-Y144 HydrophobicContact CG1-CD1 4.4Å; Y144-S153 WeakPolarHBondContact O-CA 3.34Å; Y144-L154 HydrophobicContact CD1-CB 4.25Å; Y144-L154 HydrophobicContact CE1-CB 3.78Å; Y144-L154 HydrophobicContact CE2-CB 4.36Å; Y144-L154 HydrophobicContact CE2-CD1 4.06Å; Y144-L154 PolarHBondContact N-O 3.16Å; Y144-L154 PolarHBondContact O-N 2.9Å; Y144-A156 HydrophobicContact CE1-CB 3.95Å
145D96Very high94.4Very high90 Ų9051.4 Ų51.448%0.48131%0.307SS..EExtended strand (participates in β ladder)trans-83137.6174.8-170.2-70.8000109.7G147D145-G147 PolarHBondContact O-N 2.88Å; D145-G147 PolarHBondContact OD1-N 3.14Å
146D92.6Very high94.5Very high21 Ų2150.8 Ų50.811%0.11230%0.304CS..  trans-65.5-15-178.972.3-10000114.1L148 K152 L154D146-L148 HydrophobicContact CB-CG 4.32Å; D146-L148 PolarHBondContact O-N 2.87Å; D146-L148 VanDerWaalsContact O-N 3.15Å; D146-L148 PolarHBondContact OD1-N 2.92Å; D146-L148 VanDerWaalsContact OD1-N 3.17Å; D146-K152 HydrophobicContact CB-CB 4.5Å; D146-K152 PolarHBondContact N-O 3.18Å; D146-K152 PolarHBondContact OD1-N 3.23Å; D146-K152 WeakPolarHBondContact OD2-CB 3.37Å; D146-L154 HydrophobicContact CB-CD1 3.85Å; D146-L154 HydrophobicContact CB-CG 4.04Å
147G91.4Very high94.7Very high64 Ų6442.2 Ų42.266%0.6627%0.271SS*.SBendtrans69.97.7177.300000114.1D145 G149D145-G147 PolarHBondContact O-N 2.88Å; D145-G147 PolarHBondContact OD1-N 3.14Å; G147-G149 VanDerWaalsContact C-N 3.3Å
148L90.6Very high94.7Very high91 Ų9141.3 Ų41.348%0.47627%0.265SS..SBendtrans-90.44.2-177.2-57-177.5000112.9F103 D146 A150F103-L148 HydrophobicContact CB-CD1 4.11Å; F103-L148 HydrophobicContact CD1-CD1 4.23Å; F103-L148 HydrophobicContact CD1-CD2 4.25Å; D146-L148 HydrophobicContact CB-CG 4.32Å; D146-L148 PolarHBondContact O-N 2.87Å; D146-L148 VanDerWaalsContact O-N 3.15Å; D146-L148 PolarHBondContact OD1-N 2.92Å; D146-L148 VanDerWaalsContact OD1-N 3.17Å; L148-A150 VanDerWaalsContact C-N 3.29Å; L148-A150 PolarHBondContact O-N 2.95Å
149G89.3Confident94.7Very high77 Ų7741.3 Ų41.379%0.79427%0.266SS*.SBendtrans85.9-11.5176.300000114.9G147 G151G147-G149 VanDerWaalsContact C-N 3.3Å; G149-G151 VanDerWaalsContact C-N 3.28Å
150A89.2Confident94.7Very high68 Ų6838.6 Ų38.656%0.56225%0.25SC*.SBendtrans-80.7-9.4172.800000113.1L148 K152L148-A150 VanDerWaalsContact C-N 3.29Å; L148-A150 PolarHBondContact O-N 2.95Å; A150-K152 VanDerWaalsContact C-N 3.34Å; A150-K152 HydrophobicContact CB-CG 4.11Å; A150-K152 PolarHBondContact O-N 2.87Å
151G89Confident94.6Very high44 Ų4436.2 Ų36.245%0.45424%0.244SC..  trans64.237.4179.500000112.4G149G149-G151 VanDerWaalsContact C-N 3.28Å
152K94.5Very high94.2Very high83 Ų8338.9 Ų38.936%0.36127%0.271SS..PPolyproline II helixtrans-81.3141.2177.2-59-59.6-174.2-178.50109.1D146 A150 Q173D146-K152 HydrophobicContact CB-CB 4.5Å; D146-K152 PolarHBondContact N-O 3.18Å; D146-K152 PolarHBondContact OD1-N 3.23Å; D146-K152 WeakPolarHBondContact OD2-CB 3.37Å; A150-K152 VanDerWaalsContact C-N 3.34Å; A150-K152 HydrophobicContact CB-CG 4.11Å; A150-K152 PolarHBondContact O-N 2.87Å; K152-Q173 HydrophobicContact CB-CG 4.24Å
153S97.1Very high93.7Very high3 Ų341 Ų412%0.02129%0.291CS..EExtended strand (participates in β ladder)trans-98.5121.9179.2-54.80000110Y144 C174 L177Y144-S153 WeakPolarHBondContact O-CA 3.34Å; S153-C174 PolarHBondContact O-N 3.28Å; S153-L177 VanDerWaalsContact OG-CA 3.22Å; S153-L177 WeakPolarHBondContact OG-CA 3.38Å; S153-L177 WeakPolarHBondContact OG-CB 3.43Å; S153-L177 PolarHBondContact OG-N 3.11Å
154L97.4Very high93Very high3 Ų342.7 Ų42.72%0.01630%0.303CS..EExtended strand (participates in β ladder)trans-99.4143.8176.1-62.6-178.9000110.7V68 C143 Y144 D146 Y172 Q173V68-L154 HydrophobicContact CG2-CD2 4.12Å; C143-L154 VanDerWaalsContact CA-O 3.32Å; C143-L154 WeakPolarHBondContact CA-O 3.48Å; Y144-L154 HydrophobicContact CD1-CB 4.25Å; Y144-L154 HydrophobicContact CE1-CB 3.78Å; Y144-L154 HydrophobicContact CE2-CB 4.36Å; Y144-L154 HydrophobicContact CE2-CD1 4.06Å; Y144-L154 PolarHBondContact N-O 3.16Å; Y144-L154 PolarHBondContact O-N 2.9Å; D146-L154 HydrophobicContact CB-CD1 3.85Å; D146-L154 HydrophobicContact CB-CG 4.04Å; L154-Y172 CarbonylContact C-O 3.51Å; L154-Y172 WeakPolarHBondContact CA-O 3.41Å; L154-Q173 HydrophobicContact CD2-CB 3.73Å; L154-Q173 HydrophobicContact CD2-CG 3.93Å
155L98Very high92.5Very high1 Ų147.8 Ų47.81%0.00533%0.327CS..EExtended strand (participates in β ladder)trans-111.1113.3169.1-69.7176.5000108.6M141 V142 C143 V171 Y172 C174 A180 I183M141-L155 HydrophobicContact CG-CD2 4.49Å; V142-L155 WeakPolarHBondContact O-CA 3.19Å; C143-L155 HydrophobicContact CB-CD2 3.73Å; L155-V171 WeakPolarHBondContact O-CA 3.38Å; L155-Y172 PolarHBondContact N-O 3.23Å; L155-Y172 PolarHBondContact O-N 2.79Å; L155-C174 WeakPolarHBondContact CD1-SG 3.43Å; L155-A180 HydrophobicContact CD2-CB 4.11Å; L155-A180 HydrophobicContact CG-CB 4.37Å; L155-I183 HydrophobicContact CD1-CB 4.1Å; L155-I183 HydrophobicContact CD1-CD1 3.65Å; L155-I183 HydrophobicContact CD1-CG1 4.47Å; L155-I183 HydrophobicContact CD1-CG2 3.7Å
156A97.6Very high92.2Very high1 Ų147.3 Ų47.31%0.00832%0.322CS..EExtended strand (participates in β ladder)trans-97116.7170.300000109.7L88 I92 M141 V142 Y144L88-A156 HydrophobicContact CD2-CB 3.97Å; L88-A156 HydrophobicContact CG-CB 4.21Å; I92-A156 HydrophobicContact CD1-CB 3.33Å; M141-A156 CarbonylContact C-O 3.57Å; M141-A156 WeakPolarHBondContact CA-O 3.18Å; V142-A156 PolarHBondContact N-O 2.91Å; V142-A156 PolarHBondContact O-N 2.89Å; Y144-A156 HydrophobicContact CE1-CB 3.95Å
157L97.7Very high92.1Very high2 Ų246.8 Ų46.81%0.0132%0.32CS..EExtended strand (participates in β ladder)trans-105.4120.6176.2-175.271.5000109.3I119 H133 I138 M141 T159 L169 W170I119-L157 HydrophobicContact CD1-CD1 3.96Å; I119-L157 HydrophobicContact CD1-CD2 4.04Å; H133-L157 HydrophobicContact CB-CD2 3.97Å; H133-L157 WeakPolarHBondContact CD2-CD2 3.32Å; I138-L157 HydrophobicContact CD1-CD1 4.3Å; I138-L157 HydrophobicContact CG1-CD1 4.2Å; I138-L157 HydrophobicContact CG2-CD1 3.62Å; M141-L157 HydrophobicContact CB-CD1 3.91Å; M141-L157 HydrophobicContact CG-CD1 4.11Å; M141-L157 HydrophobicContact SD-CD1 4.19Å; L157-T159 HydrophobicContact CD2-CG2 3.9Å; L157-T159 HydrophobicContact CG-CG2 3.95Å; L157-L169 CarbonylContact O-C 3.53Å; L157-L169 WeakPolarHBondContact O-CA 3.26Å; L157-W170 HydrophobicContact CB-CB 4.19Å; L157-W170 PolarHBondContact N-O 2.96Å; L157-W170 PolarHBondContact O-N 2.8Å
158K96Very high92.3Very high17 Ų1744.6 Ų44.67%0.07430%0.295CS..EExtended strand (participates in β ladder)trans-97.7118.4170-176.2-178-174-176.40108.5S79 L82 L88 V139 R140 L169S79-K158 PolarHBondContact O-NZ 2.9Å; S79-K158 VanDerWaalsContact O-NZ 3.15Å; L82-K158 PolarHBondContact O-NZ 3.34Å; L88-K158 HydrophobicContact CD2-CB 4.36Å; V139-K158 HydrophobicContact CB-CD 4.32Å; V139-K158 HydrophobicContact CB-CG 4.23Å; V139-K158 HydrophobicContact CG1-CD 4.21Å; V139-K158 PolarHBondContact N-O 2.78Å; R140-K158 PolarHBondContact N-O 2.91Å; R140-K158 PolarHBondContact O-N 2.83Å; K158-L169 HydrophobicContact CB-CD2 3.94Å; K158-L169 HydrophobicContact CG-CD2 3.83Å
159T95.5Very high92.6Very high12 Ų1240.3 Ų40.37%0.07427%0.272CS..EExtended strand (participates in β ladder)trans-114156.1172.564.40000110.4H133 L137 I138 L157 C167 S168 W170H133-T159 HydrophobicContact CB-CG2 4.31Å; L137-T159 CarbonylContact O-C 3.58Å; L137-T159 VanDerWaalsContact O-CA 3.27Å; L137-T159 WeakPolarHBondContact O-CA 3.35Å; I138-T159 HydrophobicContact CG1-CG2 4.27Å; L157-T159 HydrophobicContact CD2-CG2 3.9Å; L157-T159 HydrophobicContact CG-CG2 3.95Å; T159-C167 CarbonylContact O-C 3.57Å; T159-C167 WeakPolarHBondContact O-CA 3.35Å; T159-S168 PolarHBondContact N-O 3.38Å; T159-S168 PolarHBondContact O-N 3.2Å; T159-W170 PolarHBondContact OG1-NE1 3.09Å
160T94.1Very high93Very high24 Ų2437.7 Ų37.715%0.14724%0.238CC..EExtended strand (participates in β ladder)trans-116.7164.6172.4-164.70000110.5L137 V139 S164 E166L137-T160 PolarHBondContact O-N 3.39Å; V139-T160 HydrophobicContact CG2-CG2 3.87Å; T160-S164 WeakPolarHBondContact OG1-CA 3.33Å; T160-E166 WeakPolarHBondContact CA-O 3.34Å; T160-E166 PolarHBondContact OG1-O 3.21Å
161D92.1Very high93.4Very high49 Ų4934.4 Ų34.426%0.26221%0.212SC..  trans-82.8173168.377.7-45.4000112.1A163 S164 E165 E166D161-A163 PolarHBondContact O-N 2.83Å; D161-A163 WeakPolarHBondContact OD2-CB 3.32Å; D161-A163 PolarHBondContact OD2-N 2.84Å; D161-S164 PolarHBondContact O-N 3Å; D161-S164 VanDerWaalsContact O-N 3.09Å; D161-S164 VanDerWaalsContact OD1-CA 3.3Å; D161-S164 WeakPolarHBondContact OD1-CA 3.37Å; D161-S164 PolarHBondContact OD1-N 3.33Å; D161-E165 PolarHBondContact OD1-N 3.35Å; D161-E166 HydrophobicContact CB-CB 4.43Å; D161-E166 PolarHBondContact N-O 2.88Å; D161-E166 VanDerWaalsContact N-O 3.11Å; D161-E166 PolarHBondContact OD1-N 2.93Å
162A89.1Confident93.8Very high87 Ų8732.5 Ų32.572%0.71919%0.191SC*.THydrogen-bonded Turntrans-65-26-178.600000113.4
163A86.7Confident94Very high62 Ų6229.3 Ų29.351%0.51218%0.177SC..THydrogen-bonded Turntrans-86.4-8.2176.400000113D161 E165D161-A163 PolarHBondContact O-N 2.83Å; D161-A163 WeakPolarHBondContact OD2-CB 3.32Å; D161-A163 PolarHBondContact OD2-N 2.84Å; A163-E165 HydrophobicContact CB-CB 4.48Å; A163-E165 HydrophobicContact CB-CG 3.94Å; A163-E165 PolarHBondContact O-N 3.4Å
164S82.8Confident94Very high74 Ų7429.2 Ų29.252%0.51718%0.176SC..SBendtrans58.831.1-174.3-55.10000114.1T160 D161T160-S164 WeakPolarHBondContact OG1-CA 3.33Å; D161-S164 PolarHBondContact O-N 3Å; D161-S164 VanDerWaalsContact O-N 3.09Å; D161-S164 VanDerWaalsContact OD1-CA 3.3Å; D161-S164 WeakPolarHBondContact OD1-CA 3.37Å; D161-S164 PolarHBondContact OD1-N 3.33Å
165E85.3Confident93.9Very high130 Ų13033 Ų3361%0.60720%0.196SC*.SBendtrans-104.2-29.1-179.4-63.8-170.8165.400112.1Y76 D161 A163Y76-E165 WeakPolarHBondContact CB-O 3.34Å; Y76-E165 PolarHBondContact N-O 3.18Å; D161-E165 PolarHBondContact OD1-N 3.35Å; A163-E165 HydrophobicContact CB-CB 4.48Å; A163-E165 HydrophobicContact CB-CG 3.94Å; A163-E165 PolarHBondContact O-N 3.4Å
166E90.1Very high93.7Very high81 Ų8135.4 Ų35.438%0.37921%0.213SC..EExtended strand (participates in β ladder)trans-119.5143.4-178.9-64.8-171.4167.300111.1L74 T160 D161L74-E166 WeakPolarHBondContact O-CA 3.28Å; T160-E166 WeakPolarHBondContact CA-O 3.34Å; T160-E166 PolarHBondContact OG1-O 3.21Å; D161-E166 HydrophobicContact CB-CB 4.43Å; D161-E166 PolarHBondContact N-O 2.88Å; D161-E166 VanDerWaalsContact N-O 3.11Å; D161-E166 PolarHBondContact OD1-N 2.93Å
167C91.6Very high93.7Very high9 Ų939.7 Ų39.76%0.06124%0.236CC..EExtended strand (participates in β ladder)trans-117.7147.7173.9-72.70000110.9K73 L74 S79 T159K73-C167 PolarHBondContact N-O 3.24Å; L74-C167 HydrophobicContact CB-CB 4.5Å; L74-C167 VanDerWaalsContact CB-O 3.31Å; L74-C167 WeakPolarHBondContact CB-O 3.42Å; L74-C167 PolarHBondContact N-O 3.11Å; L74-C167 PolarHBondContact O-N 3.01Å; S79-C167 WeakPolarHBondContact CB-SG 3.48Å; T159-C167 CarbonylContact O-C 3.57Å; T159-C167 WeakPolarHBondContact O-CA 3.35Å
168S94.8Very high93.6Very high19 Ų1947 Ų4713%0.13327%0.27CS..EExtended strand (participates in β ladder)trans-127.6141.1172.1-58.50000109.7I71 K73 T159I71-S168 CarbonylContact O-C 3.53Å; I71-S168 WeakPolarHBondContact O-CA 3.37Å; K73-S168 PolarHBondContact N-OG 3.43Å; T159-S168 PolarHBondContact N-O 3.38Å; T159-S168 PolarHBondContact O-N 3.2Å
169L96.3Very high93.7Very high1 Ų147.5 Ų47.51%0.00527%0.273CS..EExtended strand (participates in β ladder)trans-110.7132.1177.4-53.5-176000108.8A70 I71 L74 L82 L88 Y91 I92 L157 K158A70-L169 CarbonylContact C-O 3.54Å; A70-L169 WeakPolarHBondContact CA-O 3.32Å; A70-L169 WeakPolarHBondContact CB-O 3.41Å; I71-L169 HydrophobicContact CB-CB 4.39Å; I71-L169 PolarHBondContact N-O 3.5Å; I71-L169 PolarHBondContact O-N 2.84Å; L74-L169 HydrophobicContact CD1-CD1 3.92Å; L74-L169 HydrophobicContact CD1-CG 3.83Å; L82-L169 HydrophobicContact CD1-CD1 4.15Å; L82-L169 HydrophobicContact CD1-CD2 4.42Å; L88-L169 HydrophobicContact CD1-CD1 3.76Å; L88-L169 HydrophobicContact CD1-CD2 3.48Å; L88-L169 VanDerWaalsContact CD1-CD2 3.48Å; L88-L169 HydrophobicContact CD1-CG 4.19Å; Y91-L169 HydrophobicContact CD1-CD1 3.55Å; Y91-L169 HydrophobicContact CE1-CD1 3.87Å; I92-L169 HydrophobicContact CG1-CD1 4.46Å; L157-L169 CarbonylContact O-C 3.53Å; L157-L169 WeakPolarHBondContact O-CA 3.26Å; K158-L169 HydrophobicContact CB-CD2 3.94Å; K158-L169 HydrophobicContact CG-CD2 3.83Å
170W97.9Very high93.7Very high21 Ų2147 Ų478%0.0827%0.269CS..EExtended strand (participates in β ladder)trans-124.2129.9178.3-44.683.2000108.6A70 E72 H131 H133 L157 T159 Y172A70-W170 HydrophobicContact CB-CD2 4.04Å; A70-W170 HydrophobicContact CB-CE3 3.4Å; A70-W170 VanDerWaalsContact CB-CE3 3.4Å; A70-W170 HydrophobicContact CB-CH2 4.42Å; A70-W170 HydrophobicContact CB-CZ3 3.61Å; E72-W170 HydrophobicContact CG-CH2 3.93Å; E72-W170 HydrophobicContact CG-CZ2 4.3Å; E72-W170 HydrophobicContact CG-CZ3 4.48Å; H131-W170 AromaticContact CE1-CZ3 3.4Å; H131-W170 VanDerWaalsContact CE1-CZ3 3.4Å; H131-W170 WeakPolarHBondContact CE1-CZ3 3.27Å; H131-W170 AromaticContact ND1-CZ3 3.57Å; H131-W170 AromaticContact NE2-CZ3 3.9Å; H133-W170 AromaticContact CE1-CD1 3.79Å; H133-W170 AromaticContact CE1-CD2 3.38Å; H133-W170 AromaticContact CE1-CE2 3.37Å; H133-W170 AromaticContact CE1-CE3 3.86Å; H133-W170 AromaticContact CE1-CG 3.7Å; H133-W170 AromaticContact CE1-CZ2 3.87Å; H133-W170 AromaticContact CE1-NE1 3.57Å; H133-W170 AromaticContact ND1-NE1 3.9Å; H133-W170 AromaticContact NE2-CD2 3.91Å; H133-W170 AromaticContact NE2-CG 3.91Å; L157-W170 HydrophobicContact CB-CB 4.19Å; L157-W170 PolarHBondContact N-O 2.96Å; L157-W170 PolarHBondContact O-N 2.8Å; T159-W170 PolarHBondContact OG1-NE1 3.09Å; W170-Y172 HydrophobicContact CB-CE2 3.67Å
171V97.9Very high93.8Very high0 Ų051.1 Ų51.10%029%0.287CS..EExtended strand (participates in β ladder)trans-118.8125.6-176.6-171.70000109.9V68 G69 I92 L101 L155V68-V171 HydrophobicContact CB-CB 3.98Å; V68-V171 HydrophobicContact CB-CG1 3.89Å; V68-V171 WeakPolarHBondContact CB-O 3.37Å; V68-V171 HydrophobicContact CG1-CB 4.4Å; V68-V171 HydrophobicContact CG1-CG1 4.21Å; V68-V171 HydrophobicContact CG2-CG1 3.99Å; V68-V171 PolarHBondContact N-O 3.5Å; G69-V171 PolarHBondContact N-O 2.88Å; G69-V171 PolarHBondContact O-N 3.29Å; I92-V171 HydrophobicContact CD1-CG2 3.79Å; I92-V171 HydrophobicContact CG1-CG2 4.16Å; I92-V171 HydrophobicContact CG2-CG2 4.11Å; L101-V171 HydrophobicContact CD1-CG2 4.03Å; L155-V171 WeakPolarHBondContact O-CA 3.38Å
172Y98.1Very high94.1Very high3 Ų350.5 Ų50.51%0.01229%0.289CS..EExtended strand (participates in β ladder)trans-123.2147.7177.8-53.9-84000109.8V65 K66 Y67 M112 V121 H133 L154 L155 W170V65-Y172 HydrophobicContact CG2-CD1 4.31Å; K66-Y172 CarbonylContact O-C 3.58Å; K66-Y172 WeakPolarHBondContact O-CA 3.38Å; Y67-Y172 AromaticContact CD2-CD1 3.71Å; Y67-Y172 HydrophobicContact CD2-CD1 3.71Å; Y67-Y172 AromaticContact CD2-CE1 3.41Å; Y67-Y172 HydrophobicContact CD2-CE1 3.41Å; Y67-Y172 VanDerWaalsContact CD2-CE1 3.41Å; Y67-Y172 AromaticContact CE2-CE1 3.93Å; Y67-Y172 HydrophobicContact CE2-CE1 3.93Å; Y67-Y172 HydrophobicContact CG-CE1 4.38Å; M112-Y172 HydrophobicContact CE-CD1 3.79Å; M112-Y172 HydrophobicContact CE-CD2 3.47Å; M112-Y172 VanDerWaalsContact CE-CD2 3.47Å; M112-Y172 HydrophobicContact CE-CE1 4.07Å; M112-Y172 HydrophobicContact CE-CE2 3.74Å; M112-Y172 HydrophobicContact CE-CG 3.49Å; M112-Y172 VanDerWaalsContact CE-CG 3.49Å; V121-Y172 HydrophobicContact CG1-CE1 4.33Å; V121-Y172 HydrophobicContact CG2-CE1 4Å; H133-Y172 PolarHBondContact NE2-OH 3.44Å; L154-Y172 CarbonylContact C-O 3.51Å; L154-Y172 WeakPolarHBondContact CA-O 3.41Å; L155-Y172 PolarHBondContact N-O 3.23Å; L155-Y172 PolarHBondContact O-N 2.79Å; W170-Y172 HydrophobicContact CB-CE2 3.67Å
173Q97.9Very high94.4Very high17 Ų1746.4 Ų46.48%0.07926%0.255CS..EExtended strand (participates in β ladder)trans-107.7127.3172.7-174.8-172.8-74.900109.6K66 V68 P105 K152 L154K66-Q173 HydrophobicContact CB-CB 4.3Å; K66-Q173 PolarHBondContact N-O 3.19Å; K66-Q173 PolarHBondContact O-N 2.84Å; V68-Q173 HydrophobicContact CG2-CB 4.16Å; P105-Q173 HydrophobicContact CG-CB 3.96Å; P105-Q173 HydrophobicContact CG-CG 4.44Å; P105-Q173 VanDerWaalsContact CG-OE1 3.31Å; K152-Q173 HydrophobicContact CB-CG 4.24Å; L154-Q173 HydrophobicContact CD2-CB 3.73Å; L154-Q173 HydrophobicContact CD2-CG 3.93Å
174C97.4Very high94.9Very high0 Ų044.8 Ų44.80%024%0.239CC..EExtended strand (participates in β ladder)trans-88.1159174.3-65.90000111.4S153 L155 S176 A180S153-C174 PolarHBondContact O-N 3.28Å; L155-C174 WeakPolarHBondContact CD1-SG 3.43Å; C174-S176 VanDerWaalsContact C-N 3.33Å; C174-A180 HydrophobicContact CB-CB 3.92Å
175N94.3Very high95.5Very high82 Ų8248.6 Ų48.644%0.43925%0.246SC..SBendtrans-74-27176.1-69-20.2000112.2
176S95.7Very high96.1Very high52 Ų5243.8 Ų43.836%0.36423%0.226SC..  trans-153.4162.6176.870.30000112.2C174 E178 Q179 A180C174-S176 VanDerWaalsContact C-N 3.33Å; S176-E178 VanDerWaalsContact C-N 3.29Å; S176-E178 PolarHBondContact O-N 2.96Å; S176-Q179 PolarHBondContact O-N 2.97Å; S176-Q179 PolarHBondContact OG-N 2.97Å; S176-Q179 VanDerWaalsContact OG-N 3.14Å; S176-A180 PolarHBondContact O-N 2.98Å; S176-A180 VanDerWaalsContact O-N 3.13Å
177L96Very high96.3Very high92 Ų9240.2 Ų40.248%0.48221%0.21SC..Hα-helixtrans-60.9-39.4171.8178.461.2000112S153 Q179 A180 Q181S153-L177 VanDerWaalsContact OG-CA 3.22Å; S153-L177 WeakPolarHBondContact OG-CA 3.38Å; S153-L177 WeakPolarHBondContact OG-CB 3.43Å; S153-L177 PolarHBondContact OG-N 3.11Å; L177-Q179 VanDerWaalsContact C-N 3.31Å; L177-Q179 PolarHBondContact O-N 2.95Å; L177-A180 PolarHBondContact O-N 3.18Å; L177-Q181 HydrophobicContact CD1-CG 4.17Å; L177-Q181 HydrophobicContact CG-CG 4.37Å; L177-Q181 WeakPolarHBondContact O-CB 3.35Å; L177-Q181 VanDerWaalsContact O-CG 3.31Å; L177-Q181 WeakPolarHBondContact O-CG 3.34Å; L177-Q181 PolarHBondContact O-N 3.15Å
178E96.5Very high96.5Very high154 Ų15443 Ų4372%0.7223%0.229SC*.Hα-helixtrans-59.8-43.2177.4-176.7179.5-174.500111.3S176 Q181 A182S176-E178 VanDerWaalsContact C-N 3.29Å; S176-E178 PolarHBondContact O-N 2.96Å; E178-Q181 PolarHBondContact O-N 3.03Å; E178-A182 WeakPolarHBondContact O-CB 3.35Å; E178-A182 PolarHBondContact O-N 2.9Å
179Q96.9Very high96.4Very high29 Ų2945 Ų4514%0.13624%0.24CC..Hα-helixtrans-63-45.9175.9-172.8-171.537.600111.4F63 R64 S176 L177 Q181 A182 I183F63-Q179 HydrophobicContact CB-CG 4.48Å; F63-Q179 HydrophobicContact CD1-CG 3.84Å; R64-Q179 PolarHBondContact O-NE2 3.15Å; R64-Q179 PolarHBondContact O-OE1 3.17Å; S176-Q179 PolarHBondContact O-N 2.97Å; S176-Q179 PolarHBondContact OG-N 2.97Å; S176-Q179 VanDerWaalsContact OG-N 3.14Å; L177-Q179 VanDerWaalsContact C-N 3.31Å; L177-Q179 PolarHBondContact O-N 2.95Å; Q179-Q181 VanDerWaalsContact C-N 3.33Å; Q179-Q181 PolarHBondContact O-N 3.06Å; Q179-A182 WeakPolarHBondContact O-CB 3.35Å; Q179-A182 PolarHBondContact O-N 3.26Å; Q179-I183 HydrophobicContact CG-CD1 4.14Å; Q179-I183 WeakPolarHBondContact O-CG1 3.25Å; Q179-I183 PolarHBondContact O-N 3.3Å
180A97.2Very high96.3Very high0 Ų044.9 Ų44.90%024%0.24CC..Hα-helixtrans-62-41.9179.500000111.8C143 L155 C174 S176 L177 I183 C184C143-A180 HydrophobicContact CB-CB 4.48Å; C143-A180 WeakPolarHBondContact SG-CB 3.3Å; L155-A180 HydrophobicContact CD2-CB 4.11Å; L155-A180 HydrophobicContact CG-CB 4.37Å; C174-A180 HydrophobicContact CB-CB 3.92Å; S176-A180 PolarHBondContact O-N 2.98Å; S176-A180 VanDerWaalsContact O-N 3.13Å; L177-A180 PolarHBondContact O-N 3.18Å; A180-I183 PolarHBondContact O-N 2.7Å; A180-C184 PolarHBondContact O-N 2.99Å; A180-C184 PolarHBondContact O-SG 3.47Å
181Q96.3Very high96.1Very high112 Ų11247.2 Ų47.252%0.52325%0.251SS..Hα-helixtrans-64.9-39.3174.2-72175.4-21.400112.4L177 E178 Q179 C184 K185L177-Q181 HydrophobicContact CD1-CG 4.17Å; L177-Q181 HydrophobicContact CG-CG 4.37Å; L177-Q181 WeakPolarHBondContact O-CB 3.35Å; L177-Q181 VanDerWaalsContact O-CG 3.31Å; L177-Q181 WeakPolarHBondContact O-CG 3.34Å; L177-Q181 PolarHBondContact O-N 3.15Å; E178-Q181 PolarHBondContact O-N 3.03Å; Q179-Q181 VanDerWaalsContact C-N 3.33Å; Q179-Q181 PolarHBondContact O-N 3.06Å; Q181-C184 PolarHBondContact O-N 2.96Å; Q181-K185 WeakPolarHBondContact O-CB 3.43Å; Q181-K185 PolarHBondContact O-N 3.18Å
182A96.5Very high95.8Very high36 Ų3652 Ų5230%0.29828%0.276SS..Hα-helixtrans-62.3-43.8175.400000111.4F63 E178 Q179 K185 V186F63-A182 HydrophobicContact CE1-CB 3.96Å; F63-A182 HydrophobicContact CZ-CB 4.25Å; E178-A182 WeakPolarHBondContact O-CB 3.35Å; E178-A182 PolarHBondContact O-N 2.9Å; Q179-A182 WeakPolarHBondContact O-CB 3.35Å; Q179-A182 PolarHBondContact O-N 3.26Å; A182-K185 PolarHBondContact O-N 3.24Å; A182-V186 WeakPolarHBondContact O-CG2 3.4Å; A182-V186 PolarHBondContact O-N 2.83Å
183I97.2Very high95.3Very high0 Ų054.7 Ų54.70%030%0.296CS..Hα-helixtrans-58.5-49.4175-69.2163.8000110.6F63 V65 M112 V114 M141 L155 Q179 A180 K185 V186 L187F63-I183 HydrophobicContact CB-CD1 3.87Å; F63-I183 HydrophobicContact CB-CG1 4.1Å; F63-I183 HydrophobicContact CD1-CD1 4.26Å; F63-I183 HydrophobicContact CD1-CG1 3.81Å; F63-I183 HydrophobicContact CD2-CD1 4.15Å; F63-I183 HydrophobicContact CD2-CG1 3.43Å; F63-I183 VanDerWaalsContact CD2-CG1 3.43Å; F63-I183 HydrophobicContact CE1-CG1 4.01Å; F63-I183 HydrophobicContact CE2-CB 4.5Å; F63-I183 HydrophobicContact CE2-CG1 3.64Å; F63-I183 HydrophobicContact CG-CD1 3.84Å; F63-I183 HydrophobicContact CG-CG1 3.49Å; F63-I183 VanDerWaalsContact CG-CG1 3.49Å; F63-I183 HydrophobicContact CZ-CG1 3.93Å; V65-I183 HydrophobicContact CG1-CD1 4.11Å; M112-I183 HydrophobicContact SD-CD1 4.26Å; M112-I183 HydrophobicContact SD-CG2 4.1Å; V114-I183 HydrophobicContact CG2-CG2 4.09Å; M141-I183 HydrophobicContact CE-CG2 3.71Å; M141-I183 HydrophobicContact SD-CG2 4.2Å; L155-I183 HydrophobicContact CD1-CB 4.1Å; L155-I183 HydrophobicContact CD1-CD1 3.65Å; L155-I183 HydrophobicContact CD1-CG1 4.47Å; L155-I183 HydrophobicContact CD1-CG2 3.7Å; Q179-I183 HydrophobicContact CG-CD1 4.14Å; Q179-I183 WeakPolarHBondContact O-CG1 3.25Å; Q179-I183 PolarHBondContact O-N 3.3Å; A180-I183 PolarHBondContact O-N 2.7Å; I183-K185 VanDerWaalsContact C-N 3.33Å; I183-K185 PolarHBondContact O-N 3.31Å; I183-V186 PolarHBondContact O-N 2.81Å; I183-L187 PolarHBondContact O-N 3.27Å
184C96.5Very high94.9Very high28 Ų2857.5 Ų57.519%0.18931%0.314CS..Hα-helixtrans-57.4-44175.1-70.90000112.3M141 A180 Q181 L187 S188M141-C184 HydrophobicContact CE-CB 4.17Å; A180-C184 PolarHBondContact O-N 2.99Å; A180-C184 PolarHBondContact O-SG 3.47Å; Q181-C184 PolarHBondContact O-N 2.96Å; C184-L187 PolarHBondContact O-N 2.95Å; C184-S188 PolarHBondContact O-N 3.48Å; C184-S188 PolarHBondContact O-OG 3.38Å
185K96.1Very high94.3Very high154 Ų15463.6 Ų63.667%0.6735%0.346SS*.Hα-helixtrans-64.6-41.8-179.7-175.8179.7179.8-179.20112.7Q181 A182 I183 S188 T189Q181-K185 WeakPolarHBondContact O-CB 3.43Å; Q181-K185 PolarHBondContact O-N 3.18Å; A182-K185 PolarHBondContact O-N 3.24Å; I183-K185 VanDerWaalsContact C-N 3.33Å; I183-K185 PolarHBondContact O-N 3.31Å; K185-S188 PolarHBondContact O-N 3.48Å; K185-T189 PolarHBondContact O-N 2.9Å; K185-T189 PolarHBondContact O-OG1 2.7Å
186V96.1Very high93.5Very high29 Ų2965.9 Ų65.918%0.17636%0.355CS..Hα-helixtrans-65.8-42.7176.6176.50000109.9A61 F63 V114 A182 I183 T189 A190A61-V186 HydrophobicContact CB-CG1 4.2Å; A61-V186 HydrophobicContact CB-CG2 4.01Å; F63-V186 HydrophobicContact CZ-CG2 4.3Å; V114-V186 HydrophobicContact CB-CB 4.49Å; V114-V186 HydrophobicContact CB-CG1 3.9Å; V114-V186 HydrophobicContact CG1-CB 4.26Å; V114-V186 HydrophobicContact CG1-CG1 3.76Å; A182-V186 WeakPolarHBondContact O-CG2 3.4Å; A182-V186 PolarHBondContact O-N 2.83Å; I183-V186 PolarHBondContact O-N 2.81Å; V186-T189 PolarHBondContact O-N 3.01Å; V186-A190 WeakPolarHBondContact O-CB 3.48Å; V186-A190 PolarHBondContact O-N 3.43Å
187L95.9Very high91.8Very high7 Ų767.9 Ų67.94%0.03737%0.369CS..Hα-helixtrans-63.8-42.5176.9-174.166000112.2V114 I119 L135 I138 M141 I183 C184 A190 F191V114-L187 HydrophobicContact CG1-CB 4.09Å; V114-L187 HydrophobicContact CG1-CD1 4.2Å; I119-L187 HydrophobicContact CD1-CD1 4.36Å; I119-L187 HydrophobicContact CD1-CD2 4.25Å; I119-L187 HydrophobicContact CG1-CD1 4.28Å; L135-L187 HydrophobicContact CD1-CD1 3.62Å; I138-L187 HydrophobicContact CD1-CD1 4.22Å; I138-L187 HydrophobicContact CG2-CD2 4.47Å; M141-L187 HydrophobicContact CB-CD2 3.84Å; M141-L187 HydrophobicContact CE-CB 3.92Å; M141-L187 HydrophobicContact CE-CD2 3.4Å; M141-L187 VanDerWaalsContact CE-CD2 3.4Å; M141-L187 HydrophobicContact CE-CG 4.31Å; M141-L187 HydrophobicContact CG-CD2 4.47Å; M141-L187 HydrophobicContact SD-CD2 3.79Å; I183-L187 PolarHBondContact O-N 3.27Å; C184-L187 PolarHBondContact O-N 2.95Å; L187-A190 WeakPolarHBondContact O-CB 3.37Å; L187-A190 PolarHBondContact O-N 3.37Å; L187-F191 HydrophobicContact CD1-CD2 4.41Å; L187-F191 HydrophobicContact CD1-CE2 3.95Å; L187-F191 HydrophobicContact CD2-CE2 4.03Å; L187-F191 HydrophobicContact CG-CD2 4.04Å; L187-F191 HydrophobicContact CG-CE2 3.68Å; L187-F191 VanDerWaalsContact O-CD2 3.25Å; L187-F191 WeakPolarHBondContact O-CD2 3.45Å; L187-F191 PolarHBondContact O-N 2.98Å
188S94.9Very high89.7Confident66 Ų6672.2 Ų72.246%0.46239%0.387SS..Hα-helixtrans-59.5-46.8173.7-67.10000111.7C184 K185 A190 F191 D192C184-S188 PolarHBondContact O-N 3.48Å; C184-S188 PolarHBondContact O-OG 3.38Å; K185-S188 PolarHBondContact O-N 3.48Å; S188-A190 PolarHBondContact O-N 3.48Å; S188-F191 PolarHBondContact O-N 2.75Å; S188-D192 PolarHBondContact O-N 3.11Å
189T93.8Very high87.5Confident61 Ų6173.9 Ų73.937%0.37439%0.392SS..Hα-helixtrans-59.2-37.5175.4-52.10000111.8K185 V186 D192 S193K185-T189 PolarHBondContact O-N 2.9Å; K185-T189 PolarHBondContact O-OG1 2.7Å; V186-T189 PolarHBondContact O-N 3.01Å; T189-D192 PolarHBondContact O-N 3.3Å; T189-S193 VanDerWaalsContact O-CB 3.29Å; T189-S193 WeakPolarHBondContact O-CB 3.35Å; T189-S193 PolarHBondContact O-N 2.91Å
190A92.8Very high84.7Confident0 Ų081 Ų810%045%0.445CS..Hα-helixtrans-64.8-43.817700000111.9L135 V186 L187 S188 S193 V194L135-A190 HydrophobicContact CD1-CB 4.42Å; L135-A190 HydrophobicContact CD2-CB 4.45Å; V186-A190 WeakPolarHBondContact O-CB 3.48Å; V186-A190 PolarHBondContact O-N 3.43Å; L187-A190 WeakPolarHBondContact O-CB 3.37Å; L187-A190 PolarHBondContact O-N 3.37Å; S188-A190 PolarHBondContact O-N 3.48Å; A190-S193 PolarHBondContact O-N 3.31Å; A190-V194 WeakPolarHBondContact O-CG2 3.29Å; A190-V194 PolarHBondContact O-N 2.82Å
191F93.5Very high84.1Confident70 Ų7085.1 Ų85.131%0.30747%0.468SS..Hα-helixtrans-61.6-48.3173.5-77.4-63.4000111.9L135 I138 L187 S188 S193 V194 L195L135-F191 HydrophobicContact CD1-CD1 3.87Å; L135-F191 HydrophobicContact CD1-CD2 4.29Å; L135-F191 HydrophobicContact CD1-CE1 3.58Å; L135-F191 HydrophobicContact CD1-CE2 4.04Å; L135-F191 HydrophobicContact CD1-CG 4.22Å; L135-F191 HydrophobicContact CD1-CZ 3.68Å; L135-F191 HydrophobicContact CD2-CD1 4.15Å; L135-F191 HydrophobicContact CD2-CE1 4.42Å; L135-F191 HydrophobicContact CG-CD1 3.86Å; L135-F191 HydrophobicContact CG-CE1 3.64Å; L135-F191 HydrophobicContact CG-CZ 4.23Å; I138-F191 HydrophobicContact CB-CZ 4.03Å; I138-F191 HydrophobicContact CG2-CE2 4.41Å; I138-F191 HydrophobicContact CG2-CZ 3.94Å; L187-F191 HydrophobicContact CD1-CD2 4.41Å; L187-F191 HydrophobicContact CD1-CE2 3.95Å; L187-F191 HydrophobicContact CD2-CE2 4.03Å; L187-F191 HydrophobicContact CG-CD2 4.04Å; L187-F191 HydrophobicContact CG-CE2 3.68Å; L187-F191 VanDerWaalsContact O-CD2 3.25Å; L187-F191 WeakPolarHBondContact O-CD2 3.45Å; L187-F191 PolarHBondContact O-N 2.98Å; S188-F191 PolarHBondContact O-N 2.75Å; F191-S193 VanDerWaalsContact C-N 3.31Å; F191-S193 PolarHBondContact O-N 3.42Å; F191-V194 PolarHBondContact O-N 2.74Å; F191-L195 WeakPolarHBondContact O-CG 3.42Å; F191-L195 PolarHBondContact O-N 3.44Å; F191-L195 VanDerWaalsContact O-N 3.11Å
192D91.9Very high83.5Confident99 Ų9983.7 Ų83.753%0.52947%0.465SS..Hα-helixtrans-60.8-41179.5-68.2-24.5000111.5S188 T189 V194 L195 M196S188-D192 PolarHBondContact O-N 3.11Å; T189-D192 PolarHBondContact O-N 3.3Å; D192-V194 PolarHBondContact O-N 2.84Å; D192-L195 PolarHBondContact O-N 2.94Å; D192-M196 WeakPolarHBondContact O-CB 3.37Å; D192-M196 WeakPolarHBondContact O-CG 3.18Å; D192-M196 PolarHBondContact O-N 2.75Å
193S89.2Confident82.7Confident61 Ų6186.3 Ų86.343%0.42747%0.474SS..Hα-helixtrans-63.1-39.1179.3-177.60000112.8T189 A190 F191 S197T189-S193 VanDerWaalsContact O-CB 3.29Å; T189-S193 WeakPolarHBondContact O-CB 3.35Å; T189-S193 PolarHBondContact O-N 2.91Å; A190-S193 PolarHBondContact O-N 3.31Å; F191-S193 VanDerWaalsContact C-N 3.31Å; F191-S193 PolarHBondContact O-N 3.42Å; S193-S197 PolarHBondContact O-N 3.49Å
194V88Confident81.9Confident76 Ų7691.4 Ų91.446%0.46150%0.502SS..Hα-helixtrans-72.8-38.4179.5174.70000110.6L135 A190 F191 D192 S197L135-V194 HydrophobicContact CD2-CB 4.49Å; L135-V194 HydrophobicContact CD2-CG2 3.84Å; A190-V194 WeakPolarHBondContact O-CG2 3.29Å; A190-V194 PolarHBondContact O-N 2.82Å; F191-V194 PolarHBondContact O-N 2.74Å; D192-V194 PolarHBondContact O-N 2.84Å; V194-S197 PolarHBondContact O-N 2.96Å
195L85.4Confident81Confident128 Ų12895.4 Ų95.467%0.6752%0.521SS*.Hα-helixtrans-68.8-34.4177.4-68.7171.1000113.2F191 D192F191-L195 WeakPolarHBondContact O-CG 3.42Å; F191-L195 PolarHBondContact O-N 3.44Å; F191-L195 VanDerWaalsContact O-N 3.11Å; D192-L195 PolarHBondContact O-N 2.94Å
196M78Confident80Confident129 Ų12991.5 Ų91.564%0.63551%0.511SS*.Hα-helixtrans-82.9-13.3-179.4-66.4-64.4-67.700113.4D192 E198 K199D192-M196 WeakPolarHBondContact O-CB 3.37Å; D192-M196 WeakPolarHBondContact O-CG 3.18Å; D192-M196 PolarHBondContact O-N 2.75Å; M196-E198 PolarHBondContact O-N 2.82Å; M196-K199 PolarHBondContact O-N 3.39Å
197S59.5Low78.8Confident94 Ų9495.9 Ų95.966%0.65754%0.535SS*.G310 helixtrans-69.6-16-178.6-1710000113.9S193 V194 K199S193-S197 PolarHBondContact O-N 3.49Å; V194-S197 PolarHBondContact O-N 2.96Å; S197-K199 VanDerWaalsContact C-N 3.27Å; S197-K199 PolarHBondContact O-N 2.86Å
198E52.7Low77.5Confident184 Ų184102.8 Ų102.886%0.8657%0.574SS**G310 helixtrans-81.90.8179.5-67-169.415200114M196M196-E198 PolarHBondContact O-N 2.82Å
199K48.8Very low76Confident188 Ų188105.8 Ų105.882%0.81758%0.583SS**G310 helixtrans-104.315.7-173.1-119.3178-173.8174.50115.5M196 S197M196-K199 PolarHBondContact O-N 3.39Å; S197-K199 VanDerWaalsContact C-N 3.27Å; S197-K199 PolarHBondContact O-N 2.86Å
200S39.1Very low74.4Confident180 Ų180109.9 Ų109.9100%1.25960%0.602SS**  trans-118.60179.5-171.30000113.8

Retrieved 200 of 200 residues in 107.2 ms (Link to these results)