A0A087Y9A9_POEFO Loading...

Heat shock protein b8

AlphaFold DB , UniProt , Accession A0A087Y9A9, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 221 aa.

Structure Viewer
Loading PAE data...
(Predicted Aligned Error values between residue pairs)
Error loading PAE data: please refresh the page.

Site Residue pLDDT pLDDT confidence pLDDT10 pLDDT10 confidence SASA SASA [Ų] SASA10 SASA10 [Ų] RSA RSA unformatted RSA10 RSA10 unformatted Surface Surface10 (not used) Disorder (not used) Disorder Sec. str. Secondary structure Isomer Phi (φ) Psi (ψ) Omega (ω) Chi 1 (χ1) Chi 2 (χ2) Chi 3 (χ3) Chi 4 (χ4) Chi 5 (χ5) Tau (τ) Contacts (colored by PAE) Contact details
1M38.2Very low43.8Very low250 Ų250156.2 Ų156.2100%1.23287%0.866SS**  0120.30-71.6177.1170.800106.6
2A48.4Very low44.1Very low102 Ų102160.7 Ų160.784%0.84386%0.86SS**  cis-151.7153.31.200000107.7
3E44.7Very low44.3Very low183 Ų183159.8 Ų159.886%0.85585%0.848SS**  trans-66.3150.7-170.7-73.1153.8134.400113.8
4G47.6Very low44.7Very low71 Ų71164.8 Ų164.873%0.73285%0.849SS**  trans-93.1123.6166.100000109.9
5D46.4Very low44.8Very low131 Ų131164.9 Ų164.970%0.70184%0.841SS**  trans-101.7103.2171.4-73.3-39.9000110.3Y7D5-Y7 HydrophobicContact CB-CE1 4.46Å
6F36.2Very low45.1Very low206 Ų206162.1 Ų162.190%0.90484%0.837SS**PPolyproline II helixtrans-66.5124.6158.7-92.3-105000109.2
7Y41.8Very low45.5Very low208 Ų208167.2 Ų167.282%0.81684%0.843SS**PPolyproline II helixtrans-93.7132.6158.1-22-72.8000109.2D5D5-Y7 HydrophobicContact CB-CE1 4.46Å
8T47.2Very low45.9Very low139 Ų139163.9 Ų163.985%0.85383%0.829SS**PPolyproline II helixtrans-68.5137.2-176.740.20000112.1G10T8-G10 PolarHBondContact O-N 3.1Å; T8-G10 VanDerWaalsContact O-N 3.1Å
9M43.6Very low46.4Very low194 Ų194161.2 Ų161.296%0.95682%0.823SS**  trans-61.2109.7168.3-68-165.2-147.600109.8N11M9-N11 PolarHBondContact O-N 3.48Å
10G41.2Very low46.9Very low78 Ų78162.8 Ų162.880%0.80482%0.824SS**  trans-75.8115.416600000110.6T8T8-G10 PolarHBondContact O-N 3.1Å; T8-G10 VanDerWaalsContact O-N 3.1Å
11N46.8Very low46.9Very low156 Ų156157.3 Ų157.383%0.83481%0.809SS**  trans-57.2133.8-176.6-16117.1000113M9M9-N11 PolarHBondContact O-N 3.48Å
12R47.5Very low47.6Very low210 Ų210154.7 Ų154.779%0.79279%0.793SS**  trans-59.4131.5171.6-84.7177.7170.6-176.9-2.1110.8
13Q46.4Very low47.7Very low150 Ų150154.6 Ų154.670%0.70179%0.787SS**  trans-137.689.1136.4-75.8-61.3-61.300108.1F15Q13-F15 HydrophobicContact CB-CE2 4.22Å; Q13-F15 HydrophobicContact CB-CZ 4.26Å; Q13-F15 PolarHBondContact O-N 2.78Å
14R49.4Very low48.2Very low229 Ų229151.4 Ų151.486%0.86478%0.782SS**  trans-77.898.7166.9-72.1-84.3-175.1-176.8-1.5105.9
15F47Very low48.4Very low166 Ų166157.2 Ų157.273%0.72879%0.787SS**  trans-65.7130.9168.6-62.7-78.6000108.7Q13 R17Q13-F15 HydrophobicContact CB-CE2 4.22Å; Q13-F15 HydrophobicContact CB-CZ 4.26Å; Q13-F15 PolarHBondContact O-N 2.78Å; F15-R17 PolarHBondContact O-N 2.81Å; F15-R17 VanDerWaalsContact O-N 3.16Å
16P49.9Very low48.8Very low121 Ų121161.7 Ų161.779%0.78679%0.794SS**  trans-61.2119.4167.125.1-29.5000107.5D18P16-D18 VanDerWaalsContact C-N 3.33Å; P16-D18 PolarHBondContact O-N 3.13Å
17R50.3Low49.7Very low249 Ų249159.3 Ų159.394%0.9479%0.791SS**  trans-70.197.3168.2-81.9-173173.9175.5-2.1106.9F15 P19F15-R17 PolarHBondContact O-N 2.81Å; F15-R17 VanDerWaalsContact O-N 3.16Å; R17-P19 WeakPolarHBondContact O-CD 3.45Å
18D52.7Low50.2Low108 Ų108158 Ų15858%0.57879%0.793SS**  trans-73.9121.3168.2-163.7-22.8000108.3P16 F20P16-D18 VanDerWaalsContact C-N 3.33Å; P16-D18 PolarHBondContact O-N 3.13Å; D18-F20 PolarHBondContact O-N 3.06Å; D18-F20 PolarHBondContact OD1-N 3.32Å; D18-F20 VanDerWaalsContact OD1-N 3.15Å
19P57.1Low50.3Low112 Ų112155.6 Ų155.673%0.72778%0.781SS**THydrogen-bonded Turntrans-72-0.517827.5-31.3000113.7R17R17-P19 WeakPolarHBondContact O-CD 3.45Å
20F55.6Low50.8Low192 Ų192152.6 Ų152.684%0.84278%0.776SS**THydrogen-bonded Turntrans-129.115.5178.3-68.1-80.5000114.7D18D18-F20 PolarHBondContact O-N 3.06Å; D18-F20 PolarHBondContact OD1-N 3.32Å; D18-F20 VanDerWaalsContact OD1-N 3.15Å
21G47.8Very low51.4Low48 Ų48157 Ų15750%0.49577%0.773SS.*  trans-105.1114.2-178.600000114.1
22E52.4Low51.9Low195 Ų195159.5 Ų159.591%0.91177%0.771SS**  trans-59.9144172-70.4170.3105.500112.4
23S49.9Very low52.1Low100 Ų100155.6 Ų155.670%0.69977%0.766SS**  trans-83.5127.9178.7-56.80000110.6F25S23-F25 PolarHBondContact O-N 3.26Å
24P54.3Low52.3Low117 Ų117155.7 Ų155.776%0.7677%0.766SS**THydrogen-bonded Turntrans-78.726.9-170.132-36.1000115
25F52.2Low52.4Low192 Ų192151.7 Ų151.784%0.84276%0.761SS**THydrogen-bonded Turntrans-131.220.6-172.8-88.4-77.2000115.1S23S23-F25 PolarHBondContact O-N 3.26Å
26R54.8Low52.5Low225 Ų225147.1 Ų147.185%0.84975%0.754SS**  trans-105.52.6-177.9-123.6-174.1-173.7-169.22.1117.1
27D55.7Low52.5Low156 Ų156144.8 Ų144.883%0.83474%0.741SS**  trans-104.848.3-175.4-62.5-53.5000114.4
28Q52.8Low52.6Low182 Ų182143.8 Ų143.885%0.8574%0.737SS**  trans-137.184.8165.9-67.2-172.650.400110.1
29S48.8Very low52.5Low88 Ų88147 Ų14762%0.61575%0.747SS**  trans-141.698.5165.1-70.90000108.6F31S29-F31 PolarHBondContact O-N 3.23Å
30P54.3Low52.4Low130 Ų130149.9 Ų149.984%0.84475%0.752SS**THydrogen-bonded Turntrans-7314.2-169.930-36.1000114.9
31F54.4Low52.1Low170 Ų170147 Ų14775%0.74674%0.742SS**THydrogen-bonded Turntrans-116.1-1.6-174.9-125.8-86.9000114.1S29S29-F31 PolarHBondContact O-N 3.23Å
32R55.6Low52.3Low210 Ų210151.7 Ų151.779%0.79276%0.755SS**SBendtrans-85.8-21.8-176.4-160.2173.6-177.7-171.9-1.7113.6Q34R32-Q34 VanDerWaalsContact C-N 3.33Å; R32-Q34 PolarHBondContact O-N 2.81Å
33D51.6Low52Low128 Ų128150.7 Ų150.768%0.68475%0.75SS**Hα-helixtrans-82-7.9-175.1-60-54.4000114.3
34Q50.8Low51.9Low151 Ų151154.7 Ų154.771%0.70676%0.755SS**Hα-helixtrans-93.8-9.8-176.6-131.5173.15.700114.7R32R32-Q34 VanDerWaalsContact C-N 3.33Å; R32-Q34 PolarHBondContact O-N 2.81Å
35L52.3Low51.7Low145 Ų145152.7 Ų152.776%0.75976%0.756SS**Hα-helixtrans-104-20.6176.7-69.8175.2000113.5
36A50.1Low51.6Low70 Ų70149.5 Ų149.558%0.57975%0.745SS**Hα-helixtrans-73.9-32.2178.900000112.3R38A36-R38 PolarHBondContact O-N 2.98Å
37S48.3Very low51.3Low73 Ų73143 Ų14351%0.5173%0.733SS.*THydrogen-bonded Turntrans-95.218.6-172.9-44.70000114.6E41S37-E41 VanDerWaalsContact O-OE1 3.05Å
38R52.9Low51.3Low228 Ų228141.3 Ų141.386%0.8673%0.73SS**THydrogen-bonded Turntrans-130.12.1168.6-74.1-164173-130-1.9113.9A36A36-R38 PolarHBondContact O-N 2.98Å
39F51.4Low50.8Low176 Ų176140.5 Ų140.577%0.77272%0.724SS**SBendtrans-96.1-8179.4-168-104.6000112.8
40M55.1Low50.9Low172 Ų172141.7 Ų141.785%0.84773%0.73SS**SBendtrans-136.112.7-175.4-77.7-174.1172.700115.1
41E47.9Very low50.8Low132 Ų132143.2 Ų143.262%0.61773%0.731SS**SBendtrans-123.9110.9172.861.1178.3108.300110.9S37S37-E41 VanDerWaalsContact O-OE1 3.05Å
42D52.6Low50.7Low146 Ų146141.9 Ų141.978%0.78173%0.731SS**SBendtrans70.4120155.6-82.2-80.2000122.1
43E47.1Very low50.6Low173 Ų173139 Ų13981%0.80873%0.731SS**  trans94.253.8135.1-129.8163.9128.500119.8
44F48.1Very low50.8Low184 Ų184135.6 Ų135.681%0.80773%0.726SS**  trans-128.481.3145.6-147.1-94000109.5M46F44-M46 VanDerWaalsContact C-N 3.3Å; F44-M46 HydrophobicContact CE1-CE 4.48Å; F44-M46 PolarHBondContact O-N 2.85Å
45G48.2Very low50.7Low75 Ų75134.8 Ų134.877%0.77372%0.723SS**  trans-6192.1171.700000109.9
46M51.5Low50.9Low125 Ų125135.5 Ų135.562%0.61673%0.728SS**PPolyproline II helixtrans-66.1122.7161.3-94.7-71.2-177.300106.8F44F44-M46 VanDerWaalsContact C-N 3.3Å; F44-M46 HydrophobicContact CE1-CE 4.48Å; F44-M46 PolarHBondContact O-N 2.85Å
47P48.9Very low51.2Low90 Ų90135.8 Ų135.858%0.58471%0.714SS**PPolyproline II helixtrans-57.8148169.427-32.8000108F49P47-F49 PolarHBondContact O-N 2.88Å; P47-F49 VanDerWaalsContact O-N 3.14Å
48P54.4Low52.1Low120 Ų120136.3 Ų136.378%0.77972%0.716SS**PPolyproline II helixtrans-51.6129.1169.524.6-33.1000107.7
49F42.9Very low52.3Low164 Ų164128.9 Ų128.972%0.71971%0.71SS**PPolyproline II helixtrans-52.1129.1177.7-70.6-85.1000108.5P47 D51P47-F49 PolarHBondContact O-N 2.88Å; P47-F49 VanDerWaalsContact O-N 3.14Å; F49-D51 PolarHBondContact O-N 2.85Å
50P49.8Very low52.9Low114 Ų114130.4 Ų130.474%0.7471%0.711SS**PPolyproline II helixtrans-57.1124.8174.9-19.829.9000109.2D52P50-D52 PolarHBondContact O-N 2.84Å
51D52.2Low53Low162 Ų162124.4 Ų124.487%0.86669%0.688SS**SBendtrans-67.124.8178.5-89.6-67.5000114F49F49-D51 PolarHBondContact O-N 2.85Å
52D53.2Low53.8Low141 Ų141126.3 Ų126.375%0.75469%0.69SS**  trans-126.249.8-169.2-132.7-25.8000113.6P50P50-D52 PolarHBondContact O-N 2.84Å
53L52.8Low53.5Low151 Ų151125 Ų12579%0.79169%0.689SS**  trans-91.668.7146.5-75175.1000108M55L53-M55 HydrophobicContact CD2-SD 4.42Å; L53-M55 PolarHBondContact O-N 3.16Å
54G55.6Low53.4Low55 Ų55120.4 Ų120.457%0.56769%0.689SS**  trans-63.368.2158.100000110.3
55M50.4Low53.2Low134 Ų134121.4 Ų121.466%0.6669%0.687SS**  trans-80.9114.7145.2-94.579.7-179.200105.2L53 W57L53-M55 HydrophobicContact CD2-SD 4.42Å; L53-M55 PolarHBondContact O-N 3.16Å; M55-W57 PolarHBondContact O-N 3.31Å
56D54.8Low53.1Low160 Ų160126.4 Ų126.486%0.85670%0.695SS**  trans-65.160.916615.4-78.3000109.6
57W57.2Low52.4Low77 Ų77124.7 Ų124.729%0.29270%0.696SS.*  trans-65.5134.117662.8-89.9000107.1M55 G59 A61 R62M55-W57 PolarHBondContact O-N 3.31Å; W57-G59 VanDerWaalsContact CZ3-C 3.49Å; W57-G59 VanDerWaalsContact CZ3-CA 3.46Å; W57-A61 HydrophobicContact CD2-CB 4.08Å; W57-A61 HydrophobicContact CE3-CB 3.32Å; W57-A61 VanDerWaalsContact CE3-N 3.28Å; W57-A61 HydrophobicContact CZ3-CB 4.15Å; W57-R62 VanDerWaalsContact CE3-N 3.27Å; W57-R62 HydrophobicContact CH2-CB 3.85Å; W57-R62 HydrophobicContact CH2-CG 2.81Å; W57-R62 HydrophobicContact CZ2-CB 4.07Å; W57-R62 HydrophobicContact CZ2-CG 2.94Å; W57-R62 HydrophobicContact CZ3-CB 4.14Å; W57-R62 HydrophobicContact CZ3-CG 3.56Å
58P66Low51.7Low84 Ų84126.3 Ų126.355%0.54570%0.704SS.*  trans-68.4142.5-172.7-16.628.7000111.1W60 A61P58-W60 VanDerWaalsContact O-CD1 3.28Å; P58-W60 PolarHBondContact O-N 3.17Å; P58-A61 PolarHBondContact O-N 3.41Å
59G57.4Low51Low72 Ų72132.2 Ų132.274%0.74271%0.71SS**G310 helixtrans-38.2-15.6-166.700000120.5W57W57-G59 VanDerWaalsContact CZ3-C 3.49Å; W57-G59 VanDerWaalsContact CZ3-CA 3.46Å
60W64.6Low51.2Low208 Ų208133 Ų13379%0.78872%0.721SS**G310 helixtrans-81.5-14.6175.368.2-88.5000115.5P58P58-W60 VanDerWaalsContact O-CD1 3.28Å; P58-W60 PolarHBondContact O-N 3.17Å
61A57.7Low50.8Low45 Ų45130 Ų13037%0.37271%0.711SS.*G310 helixtrans-106.320.3178.800000115.7W57 P58 P63W57-A61 HydrophobicContact CD2-CB 4.08Å; W57-A61 HydrophobicContact CE3-CB 3.32Å; W57-A61 VanDerWaalsContact CE3-N 3.28Å; W57-A61 HydrophobicContact CZ3-CB 4.15Å; P58-A61 PolarHBondContact O-N 3.41Å; A61-P63 WeakPolarHBondContact O-CD 2.97Å
62R64.4Low50.3Low172 Ų172128.7 Ų128.765%0.64971%0.711SS**PPolyproline II helixtrans-72.3127.5167.2-71.8-163.1174.9-140.1-19.3107.3W57 G64W57-R62 VanDerWaalsContact CE3-N 3.27Å; W57-R62 HydrophobicContact CH2-CB 3.85Å; W57-R62 HydrophobicContact CH2-CG 2.81Å; W57-R62 HydrophobicContact CZ2-CB 4.07Å; W57-R62 HydrophobicContact CZ2-CG 2.94Å; W57-R62 HydrophobicContact CZ3-CB 4.14Å; W57-R62 HydrophobicContact CZ3-CG 3.56Å; R62-G64 PolarHBondContact O-N 2.88Å
63P45.9Very low49.6Very low118 Ų118127.3 Ų127.377%0.76671%0.713SS**PPolyproline II helixtrans-63.6124150.39.73.5000107.4A61 R65A61-P63 WeakPolarHBondContact O-CD 2.97Å; P63-R65 PolarHBondContact O-N 2.85Å
64G45.3Very low49.4Very low77 Ų77125.1 Ų125.179%0.79471%0.708SS**PPolyproline II helixtrans-49.6118-164.500000115.2R62R62-G64 PolarHBondContact O-N 2.88Å
65R43.5Very low49.2Very low205 Ų205131.9 Ų131.977%0.77472%0.722SS**  trans-88.498.4152.7-74.3-101.3-150-87.4-0.5107.2P63 S67P63-R65 PolarHBondContact O-N 2.85Å; R65-S67 PolarHBondContact O-N 3.39Å
66L46.5Very low48.9Very low181 Ų181129.5 Ų129.595%0.94873%0.731SS**  trans-62.888146-75.9161.9000106T68L66-T68 PolarHBondContact O-N 2.79Å
67S35.8Very low48.1Very low89 Ų89125.7 Ų125.762%0.62273%0.73SS**  trans-75.1107.8176.8-154.80000108.8R65 R69R65-S67 PolarHBondContact O-N 3.39Å; S67-R69 PolarHBondContact O-N 2.79Å
68T36.2Very low47.4Very low123 Ų123125.5 Ų125.576%0.75575%0.752SS**  trans14.992.3130.421.60000114.9L66L66-T68 PolarHBondContact O-N 2.79Å
69R38.3Very low46.7Very low244 Ų244130.2 Ų130.292%0.92177%0.772SS**  trans-100.5123.3137.3-74.1-168-175.2-107.52.1107.2S67 G71S67-R69 PolarHBondContact O-N 2.79Å; R69-G71 PolarHBondContact O-N 3.29Å
70L46.5Very low46Very low181 Ų181138.2 Ų138.295%0.94878%0.779SS**  trans-53119.8174.1-66.3160.9000109.9
71G41.9Very low45.1Very low51 Ų51135.3 Ų135.353%0.52679%0.785SS.*  trans-145.8138.5164.700000107.5R69 S73R69-G71 PolarHBondContact O-N 3.29Å; G71-S73 PolarHBondContact O-N 2.94Å
72P41.4Very low44.3Very low134 Ų134136.5 Ų136.587%0.8780%0.801SS**  trans-65.3110-172.625.8-32.3000110.3P74P72-P74 WeakPolarHBondContact O-CD 3.4Å
73S39.5Very low43.4Very low113 Ų113138.6 Ų138.679%0.7982%0.816SS**  trans-64.2124.5170.7-700000110.1G71 F75G71-S73 PolarHBondContact O-N 2.94Å; S73-F75 PolarHBondContact O-N 2.98Å
74P48.9Very low43.5Very low104 Ų104138.6 Ų138.668%0.67582%0.816SS**  trans-97.156.8175.238.9-32.3000110.1P72P72-P74 WeakPolarHBondContact O-CD 3.4Å
75F51.1Low43.5Very low198 Ų198140.4 Ų140.487%0.86881%0.812SS**  trans-144.369.4168.8-75.2-73.4000110.5S73S73-F75 PolarHBondContact O-N 2.98Å
76G43Very low43.5Very low83 Ų83141.8 Ų141.886%0.85682%0.817SS**  trans-87136.414700000109
77G39.6Very low43.4Very low80 Ų80141 Ų14183%0.82581%0.808SS**  trans151108.217400000108.5
78G41.3Very low44Very low74 Ų74141.6 Ų141.676%0.76381%0.812SS**  cis86.798.741.300000107.9R80G78-R80 PolarHBondContact O-N 2.9Å
79L51.3Low44.5Very low183 Ų183142.4 Ų142.496%0.95882%0.817SS**  trans-53.2116.5177.4-65.9163.7000110.6
80R43Very low44.5Very low239 Ų239134.8 Ų134.890%0.90281%0.814SS**  trans-139.7130.7156.7-68.7-164.8-177.2-83.3-1.6110.5G78G78-R80 PolarHBondContact O-N 2.9Å
81T44.9Very low44.6Very low148 Ų148129.5 Ų129.591%0.90880%0.804SS**  trans-59.9147.9170.746.50000111.6
82G42.3Very low45Very low69 Ų69133.6 Ų133.671%0.71182%0.821SS**  trans132.3114.3163.900000114.3
83F45.3Very low45.3Very low216 Ų216132 Ų13295%0.94782%0.819SS**  trans-54.4149.7171.4-65.3-93.3000112.8
84P48.7Very low45.6Very low119 Ų119134.4 Ų134.477%0.77382%0.823SS**  trans-130.3123.8141.531.6-18.1000114.6
85T43.8Very low45.5Very low115 Ų115139.8 Ų139.871%0.70683%0.831SS**  trans15.5115.4135-63.80000119.1H87T85-H87 PolarHBondContact O-ND1 3.16Å
86R45.1Very low45.3Very low234 Ų234135.6 Ų135.688%0.88382%0.822SS**  trans-46.1125154.2-170.3-175.8-144.8-113.33.2112.3
87H44.2Very low45.5Very low164 Ų164134.9 Ų134.976%0.75980%0.803SS**  trans-138123.3151.837.6-87.1000109.3T85T85-H87 PolarHBondContact O-ND1 3.16Å
88S47.9Very low45.7Very low101 Ų101141.6 Ų141.671%0.70680%0.804SS**  trans-96.4120.8178.3171.80000107.9
89T46.4Very low46.1Very low140 Ų140148.4 Ų148.486%0.85981%0.808SS**  trans-162.5125.1157.8-23.90000113.3
90G39.2Very low45.9Very low84 Ų84143 Ų14387%0.86680%0.796SS**  trans82.4124161.700000114.8
91G47.5Very low46.2Very low71 Ų71139.8 Ų139.873%0.73279%0.791SS**  cis155.1152.420.100000105.4
92P50Low46.5Very low136 Ų136138.2 Ų138.288%0.88378%0.784SS**PPolyproline II helixtrans-81.8156.7-163.133.2-34000113.9
93A48.2Very low46.9Very low101 Ų101140 Ų14084%0.83579%0.785SS**PPolyproline II helixtrans-55.3132.7-175.600000114Y95A93-Y95 PolarHBondContact O-N 2.77Å
94L46.2Very low47.4Very low164 Ų164134.8 Ų134.886%0.85977%0.773SS**PPolyproline II helixtrans-69.6122.7162.9-68.4172.2000109.2T96L94-T96 PolarHBondContact O-N 2.9Å
95Y47.4Very low47.8Very low216 Ų216140.2 Ų140.285%0.84778%0.778SS**  trans-66.790.3171.9-165.9-93.3000109.3A93A93-Y95 PolarHBondContact O-N 2.77Å
96T45.1Very low48.4Very low110 Ų110140.2 Ų140.268%0.67578%0.783SS**  trans-98.697.9160153.20000107.5L94 R98L94-T96 PolarHBondContact O-N 2.9Å; T96-R98 PolarHBondContact O-N 3.2Å
97S49Very low48.9Very low68 Ų68131.3 Ų131.348%0.47676%0.757SS.*  trans-60.586.4164.4-175.40000108.2Y99S97-Y99 PolarHBondContact O-N 2.99Å; S97-Y99 VanDerWaalsContact O-N 3.15Å
98R42.9Very low49.5Very low222 Ų222127 Ų12784%0.83874%0.744SS**  trans-70.4102.3155.1-74.6-162.5-101.1-145.5-2105.9T96 G100T96-R98 PolarHBondContact O-N 3.2Å; R98-G100 PolarHBondContact O-N 3.33Å
99Y48.7Very low49.8Very low217 Ų217128.8 Ų128.885%0.85175%0.75SS**  trans-5690.4153-76.1-90000106S97 E101S97-Y99 PolarHBondContact O-N 2.99Å; S97-Y99 VanDerWaalsContact O-N 3.15Å; Y99-E101 PolarHBondContact O-N 2.76Å
100G47.6Very low50.4Low68 Ų68123.7 Ų123.770%0.70172%0.719SS**  trans-69.490.316400000105.4R98 P102R98-G100 PolarHBondContact O-N 3.33Å; G100-P102 WeakPolarHBondContact O-CD 3.47Å
101E49Very low51.1Low172 Ų172124.7 Ų124.780%0.80471%0.708SS**  trans-49.7119.7161-172.8141.181.300106.6Y99 S103Y99-E101 PolarHBondContact O-N 2.76Å; E101-S103 PolarHBondContact O-N 2.81Å
102P52.4Low51.9Low115 Ų115125.2 Ų125.275%0.74771%0.714SS**  trans-63.1107.2175.625.1-30.6000105.9G100G100-P102 WeakPolarHBondContact O-CD 3.47Å
103S51.1Low53Low106 Ų106122.2 Ų122.274%0.74171%0.708SS**  trans-44.2122.6172.3-72.10000107.5E101 R105E101-S103 PolarHBondContact O-N 2.81Å; S103-R105 PolarHBondContact O-N 2.83Å
104P54.2Low54.6Low108 Ų108123.5 Ų123.570%0.70170%0.696SS**  trans-54.3125.1174.921.2-29.8000106S106P104-S106 PolarHBondContact O-N 2.83Å; P104-S106 PolarHBondContact O-OG 2.96Å
105R57.5Low56.6Low232 Ų232119 Ų11988%0.87568%0.677SS**  trans-59.391.8178.3-132.9-178.9-170.4-143.64.1105.8S103 S107S103-R105 PolarHBondContact O-N 2.83Å; R105-S107 PolarHBondContact O-N 2.8Å
106S56Low58.8Low115 Ų115108.7 Ų108.780%0.80464%0.637SS**  trans-58.2110.7-177.2-58.70000107.4P104P104-S106 PolarHBondContact O-N 2.83Å; P104-S106 PolarHBondContact O-OG 2.96Å
107S55.9Low61.2Low48 Ų48108.8 Ų108.834%0.33663%0.628SS.*  trans-57.5146168.739.40000108.3R105 T109R105-S107 PolarHBondContact O-N 2.8Å; S107-T109 PolarHBondContact O-N 2.9Å
108P58Low63.5Low74 Ų74106.6 Ų106.648%0.48161%0.612SS.*  trans-55.6115.5179.123.7-33000109.1T110 V118P108-T110 PolarHBondContact O-N 3.14Å; P108-V118 HydrophobicContact CG-CG2 4.48Å
109T53.6Low66.1Low138 Ų13898.9 Ų98.985%0.84759%0.591SS**  trans-75112.2172.3350000108S107 T111S107-T109 PolarHBondContact O-N 2.9Å; T109-T111 PolarHBondContact O-N 3.21Å
110T57.9Low68.4Low32 Ų3288.6 Ų88.620%0.19655%0.55CS.*PPolyproline II helixtrans-74.1118.2176.640.20000110P108 W116 Q190P108-T110 PolarHBondContact O-N 3.14Å; T110-W116 HydrophobicContact CG2-CB 4.19Å; T110-Q190 PolarHBondContact OG1-NE2 3.34Å
111T55.2Low70.8Confident105 Ų10590.2 Ų90.264%0.64454%0.543SS*.PPolyproline II helixtrans-59.4137.9165.829.10000109.7T109 G113 E114T109-T111 PolarHBondContact O-N 3.21Å; T111-G113 PolarHBondContact O-N 3.15Å; T111-G113 VanDerWaalsContact O-N 3.15Å; T111-E114 PolarHBondContact O-N 2.9Å
112G63.6Low73.1Confident82 Ų8282.2 Ų82.285%0.84551%0.506SS*.THydrogen-bonded Turntrans-52118.1-16600000113.6
113G73.3Confident75.2Confident74 Ų7482.6 Ų82.676%0.76350%0.498SS*.THydrogen-bonded Turntrans117.2-25174.300000115.2T111T111-G113 PolarHBondContact O-N 3.15Å; T111-G113 VanDerWaalsContact O-N 3.15Å
114E82.3Confident77.3Confident127 Ų12779.5 Ų79.559%0.59348%0.476SS*.SBendtrans-84.6139.3179.2-65.8-170.812500111.7T111 Q190T111-E114 PolarHBondContact O-N 2.9Å; E114-Q190 PolarHBondContact O-NE2 3.36Å
115P87.8Confident79.3Confident70 Ų7075.8 Ų75.846%0.45545%0.449SS..PPolyproline II helixtrans-62144.1174.527.4-33.5000110.1K117 A188P115-K117 PolarHBondContact O-N 2.99Å; P115-A188 CarbonylContact C-O 3.59Å; P115-A188 WeakPolarHBondContact CA-O 3.49Å; P115-A188 WeakPolarHBondContact CB-O 3.37Å
116W93.9Very high81.1Confident0 Ų070 Ų700%043%0.43CS..EExtended strand (participates in β ladder)trans-62.1129.4170.9173.877.1000109.2T110 V118 V139 I163 I165 V169 I186 E187 A188T110-W116 HydrophobicContact CG2-CB 4.19Å; W116-V118 HydrophobicContact CD2-CG2 4.48Å; W116-V118 HydrophobicContact CH2-CG2 4.22Å; W116-V118 HydrophobicContact CZ2-CG2 3.57Å; W116-V139 HydrophobicContact CH2-CG2 3.98Å; W116-V139 HydrophobicContact CZ3-CG2 4.23Å; W116-I163 HydrophobicContact CH2-CG2 4.05Å; W116-I163 HydrophobicContact CZ2-CG2 3.74Å; W116-I165 HydrophobicContact CH2-CG1 4.08Å; W116-V169 HydrophobicContact CB-CG1 4.11Å; W116-V169 HydrophobicContact CB-CG2 3.57Å; W116-V169 HydrophobicContact CD2-CG1 4.32Å; W116-V169 HydrophobicContact CE3-CG1 4.16Å; W116-V169 HydrophobicContact CG-CG1 4.36Å; W116-V169 HydrophobicContact CG-CG2 3.88Å; W116-I186 HydrophobicContact CH2-CG2 4.32Å; W116-I186 HydrophobicContact CZ3-CG2 3.86Å; W116-E187 CarbonylContact O-C 3.54Å; W116-E187 WeakPolarHBondContact O-CA 3.36Å; W116-A188 HydrophobicContact CE3-CB 3.69Å; W116-A188 HydrophobicContact CZ3-CB 4.28Å; W116-A188 PolarHBondContact N-O 2.8Å; W116-A188 PolarHBondContact O-N 3.32Å
117K95.6Very high83Confident111 Ų11169 Ų6948%0.48342%0.421SS..EExtended strand (participates in β ladder)trans-139.3134.2-174.6-169.5174-173.3169.50111.8P115 I185 I186P115-K117 PolarHBondContact O-N 2.99Å; K117-I185 HydrophobicContact CD-CG2 4.33Å; K117-I185 HydrophobicContact CG-CG2 4.19Å; K117-I186 CarbonylContact C-O 3.45Å; K117-I186 VanDerWaalsContact CA-O 3.3Å; K117-I186 WeakPolarHBondContact CA-O 3.3Å
118V96.4Very high84.9Confident23 Ų2374.7 Ų74.714%0.13944%0.442CS..EExtended strand (participates in β ladder)trans-135.8135.1176-178.50000110.2P108 W116 V120 I163 I186P108-V118 HydrophobicContact CG-CG2 4.48Å; W116-V118 HydrophobicContact CD2-CG2 4.48Å; W116-V118 HydrophobicContact CH2-CG2 4.22Å; W116-V118 HydrophobicContact CZ2-CG2 3.57Å; V118-V120 HydrophobicContact CG1-CG2 4.47Å; V118-I163 HydrophobicContact CG1-CD1 3.81Å; V118-I163 HydrophobicContact CG1-CG1 4.48Å; V118-I163 HydrophobicContact CG1-CG2 4.4Å; V118-I163 HydrophobicContact CG2-CG2 4.17Å; V118-I186 PolarHBondContact N-O 2.95Å; V118-I186 PolarHBondContact O-N 3.27Å
119C97.3Very high86.8Confident59 Ų5973.2 Ų73.240%0.39943%0.429SS..EExtended strand (participates in β ladder)trans-106.4137.8176.2-58.80000111V183 L184C119-V183 HydrophobicContact CB-CG1 3.94Å; C119-L184 CarbonylContact C-O 3.47Å; C119-L184 WeakPolarHBondContact CA-O 3.15Å
120V97.7Very high88.9Confident1 Ų168 Ų681%0.00640%0.396CS..EExtended strand (participates in β ladder)trans-130.8120.1178.9-173.50000109V118 V122 F159 K161 I163 L184 I186V118-V120 HydrophobicContact CG1-CG2 4.47Å; V120-V122 HydrophobicContact CG1-CG1 3.95Å; V120-V122 PolarHBondContact O-N 3.15Å; V120-F159 HydrophobicContact CG1-CE1 4.07Å; V120-F159 HydrophobicContact CG1-CZ 3.65Å; V120-K161 HydrophobicContact CB-CD 4.46Å; V120-K161 HydrophobicContact CG1-CD 3.62Å; V120-K161 HydrophobicContact CG2-CD 4.02Å; V120-I163 HydrophobicContact CG2-CD1 3.83Å; V120-L184 HydrophobicContact CB-CB 4.31Å; V120-L184 PolarHBondContact N-O 3.46Å; V120-L184 PolarHBondContact O-N 3.2Å; V120-I186 HydrophobicContact CG2-CD1 4.2Å
121N97.2Very high90.8Very high102 Ų10269.6 Ų69.655%0.54540%0.403SS..EExtended strand (participates in β ladder)trans-72.6123172.6-1733.5000110H123 G182N121-H123 PolarHBondContact OD1-CD2 3.42Å; N121-H123 VanDerWaalsContact OD1-CD2 3.27Å; N121-H123 PolarHBondContact OD1-N 3.38Å; N121-G182 PolarHBondContact OD1-O 3.21Å
122V97.6Very high92.8Very high5 Ų567 Ų673%0.0339%0.387CS..  trans-133.418.7-178.3-64.40000112.2V120 S124 F125 L130 F159 L178 G182 L184V120-V122 HydrophobicContact CG1-CG1 3.95Å; V120-V122 PolarHBondContact O-N 3.15Å; V122-S124 PolarHBondContact O-N 2.91Å; V122-F125 PolarHBondContact O-N 3.17Å; V122-L130 HydrophobicContact CB-CD1 4.04Å; V122-L130 HydrophobicContact CB-CD2 4.18Å; V122-L130 HydrophobicContact CG1-CD1 4.49Å; V122-L130 HydrophobicContact CG1-CD2 4.22Å; V122-L130 HydrophobicContact CG2-CD1 3.72Å; V122-F159 HydrophobicContact CG1-CE1 4.18Å; V122-L178 HydrophobicContact CG2-CD1 3.52Å; V122-G182 CarbonylContact C-O 3.59Å; V122-G182 WeakPolarHBondContact CA-O 3.4Å; V122-G182 VanDerWaalsContact CG2-O 3.27Å; V122-G182 WeakPolarHBondContact CG2-O 3.25Å; V122-G182 PolarHBondContact N-O 3.11Å; V122-L184 HydrophobicContact CG1-CB 4.28Å; V122-L184 HydrophobicContact CG2-CB 3.91Å
123H96.8Very high94.4Very high123 Ų12368.6 Ų68.657%0.56937%0.371SS*.THydrogen-bonded Turntrans-54.6-19.3-173.98292.7000116.1N121 F125 G182N121-H123 PolarHBondContact OD1-CD2 3.42Å; N121-H123 VanDerWaalsContact OD1-CD2 3.27Å; N121-H123 PolarHBondContact OD1-N 3.38Å; H123-F125 VanDerWaalsContact C-N 3.28Å; H123-G182 PolarHBondContact N-O 3.23Å; H123-G182 VanDerWaalsContact N-O 3.14Å
124S94.9Very high95.5Very high41 Ų4168 Ų6829%0.28735%0.352SS..THydrogen-bonded Turntrans-83.2-0.3178.5-69.70000114V122V122-S124 PolarHBondContact O-N 2.91Å
125F96.9Very high96.1Very high30 Ų3070.8 Ų70.813%0.13236%0.357CS..SBendtrans-127145.3-174.5-63-90.9000110.5V122 H123 L130 H145 K157 F159V122-F125 PolarHBondContact O-N 3.17Å; H123-F125 VanDerWaalsContact C-N 3.28Å; F125-L130 HydrophobicContact CB-CD2 3.74Å; F125-L130 HydrophobicContact CB-CG 4.15Å; F125-L130 HydrophobicContact CG-CD2 4.12Å; F125-H145 HydrophobicContact CD1-CB 3.71Å; F125-H145 HydrophobicContact CE1-CB 3.84Å; F125-K157 HydrophobicContact CE1-CB 4.12Å; F125-K157 HydrophobicContact CZ-CB 3.98Å; F125-F159 HydrophobicContact CE1-CB 4.24Å; F125-F159 HydrophobicContact CE2-CB 3.64Å; F125-F159 HydrophobicContact CE2-CG 4.32Å; F125-F159 HydrophobicContact CZ-CB 3.45Å; F125-F159 VanDerWaalsContact CZ-CB 3.45Å
126K95.4Very high96.4Very high110 Ų11073 Ų7348%0.47837%0.365SS..  trans-76.1154.1171.3-64.1176.8-177.8171.60110.4E128 E129K126-E128 HydrophobicContact CB-CG 3.91Å; K126-E128 PolarHBondContact O-N 2.81Å; K126-E129 HydrophobicContact CB-CG 4.09Å; K126-E129 PolarHBondContact N-OE2 2.76Å; K126-E129 WeakPolarHBondContact O-CB 3.33Å; K126-E129 PolarHBondContact O-N 2.86Å
127P96Very high96.4Very high93 Ų9374.7 Ų74.760%0.60438%0.383SS*.G310 helixtrans-54.8-38178.7-21.729.6000113.2E129 L130 L178P127-E129 VanDerWaalsContact C-N 3.28Å; P127-E129 PolarHBondContact O-N 3.29Å; P127-L130 PolarHBondContact O-N 3.08Å; P127-L178 HydrophobicContact CB-CD2 3.72Å; P127-L178 HydrophobicContact CG-CD2 3.63Å
128E96.2Very high96.4Very high169 Ų16972.2 Ų72.279%0.7937%0.373SS*.G310 helixtrans-71.7-16.1179.447.6-166.4173.700114.4K126K126-E128 HydrophobicContact CB-CG 3.91Å; K126-E128 PolarHBondContact O-N 2.81Å
129E96.8Very high96.5Very high43 Ų4371.1 Ų71.120%0.20137%0.366CS..G310 helixtrans-91.1-9176.2-66.3169.8170.800112.6K126 P127 G143 K144 H145K126-E129 HydrophobicContact CB-CG 4.09Å; K126-E129 PolarHBondContact N-OE2 2.76Å; K126-E129 WeakPolarHBondContact O-CB 3.33Å; K126-E129 PolarHBondContact O-N 2.86Å; P127-E129 VanDerWaalsContact C-N 3.28Å; P127-E129 PolarHBondContact O-N 3.29Å; E129-G143 WeakPolarHBondContact O-CA 3.5Å; E129-K144 WeakPolarHBondContact CB-O 3.5Å; E129-K144 PolarHBondContact O-N 2.87Å; E129-H145 VanDerWaalsContact CD-ND1 3.26Å; E129-H145 IonicContact OE1-CE1 2.81Å; E129-H145 IonicContact OE1-CG 2.98Å; E129-H145 IonicContact OE1-ND1 3.76Å; E129-H145 PolarHBondContact OE1-ND1 2.85Å; E129-H145 WeakPolarHBondContact OE2-CB 3.29Å; E129-H145 IonicContact OE2-CG 3.52Å; E129-H145 IonicContact OE2-ND1 3.72Å; E129-H145 PolarHBondContact OE2-ND1 2.9Å
130L97.9Very high96.5Very high29 Ų2971.8 Ų71.815%0.15236%0.363CS..EExtended strand (participates in β ladder)trans-93.1144.1-176.7-64.5174.3000111.8V122 F125 P127 S142 L178V122-L130 HydrophobicContact CB-CD1 4.04Å; V122-L130 HydrophobicContact CB-CD2 4.18Å; V122-L130 HydrophobicContact CG1-CD1 4.49Å; V122-L130 HydrophobicContact CG1-CD2 4.22Å; V122-L130 HydrophobicContact CG2-CD1 3.72Å; F125-L130 HydrophobicContact CB-CD2 3.74Å; F125-L130 HydrophobicContact CB-CG 4.15Å; F125-L130 HydrophobicContact CG-CD2 4.12Å; P127-L130 PolarHBondContact O-N 3.08Å; L130-S142 CarbonylContact C-O 3.57Å; L130-S142 WeakPolarHBondContact CA-O 3.43Å; L130-L178 HydrophobicContact CD1-CD2 4.28Å
131N97.8Very high96.6Very high64 Ų6471.8 Ų71.834%0.34236%0.363SS..EExtended strand (participates in β ladder)trans-136.6126.4175.4-176.5-103.9000110.4K133 V141 S142N131-K133 VanDerWaalsContact OD1-CD 3.29Å; N131-K133 WeakPolarHBondContact OD1-CD 3.39Å; N131-K133 WeakPolarHBondContact OD1-CE 3.44Å; N131-K133 WeakPolarHBondContact OD1-CG 3.36Å; N131-K133 PolarHBondContact OD1-NZ 3.2Å; N131-V141 CarbonylContact O-C 3.57Å; N131-V141 WeakPolarHBondContact O-CA 3.4Å; N131-S142 PolarHBondContact N-O 2.78Å; N131-S142 PolarHBondContact O-N 2.91Å; N131-S142 PolarHBondContact O-OG 3.31Å
132V97.6Very high96.6Very high52 Ų5268.1 Ų68.132%0.31535%0.345SS..EExtended strand (participates in β ladder)trans-113.3129.2177.7-174.90000108.7V139 E140 V141 A176 L184V132-V139 HydrophobicContact CG1-CG1 3.66Å; V132-E140 CarbonylContact C-O 3.55Å; V132-E140 WeakPolarHBondContact CA-O 3.47Å; V132-V141 HydrophobicContact CG2-CG1 4.45Å; V132-V141 HydrophobicContact CG2-CG2 4.46Å; V132-A176 HydrophobicContact CG1-CB 4.47Å; V132-A176 HydrophobicContact CG2-CB 4.39Å; V132-L184 HydrophobicContact CG2-CD2 3.84Å
133K97.2Very high96.6Very high115 Ų11567.9 Ų67.950%0.534%0.344SS..EExtended strand (participates in β ladder)trans-133.4134.4179.8-75.6169.9175.7154.30110.4N131 V139 E140N131-K133 VanDerWaalsContact OD1-CD 3.29Å; N131-K133 WeakPolarHBondContact OD1-CD 3.39Å; N131-K133 WeakPolarHBondContact OD1-CE 3.44Å; N131-K133 WeakPolarHBondContact OD1-CG 3.36Å; N131-K133 PolarHBondContact OD1-NZ 3.2Å; K133-V139 CarbonylContact O-C 3.49Å; K133-V139 WeakPolarHBondContact O-CA 3.39Å; K133-E140 PolarHBondContact N-O 3.02Å; K133-E140 PolarHBondContact O-N 2.99Å
134T97.2Very high96.7Very high62 Ų6270.2 Ų70.238%0.3835%0.353SS..EExtended strand (participates in β ladder)trans-103.6118.9171.1-56.10000108.8F138 I165 P171 V174T134-F138 CarbonylContact C-O 3.57Å; T134-F138 WeakPolarHBondContact CA-O 3.48Å; T134-I165 HydrophobicContact CG2-CD1 3.66Å; T134-P171 HydrophobicContact CG2-CB 3.97Å; T134-V174 HydrophobicContact CG2-CG2 4.4Å
135R94.5Very high96.8Very high184 Ų18469.2 Ų69.269%0.69434%0.343SS*.EExtended strand (participates in β ladder)trans-155.5142.8-179.9-164.5-165.8159167.62.2111.1G137 F138R135-G137 PolarHBondContact O-N 3.13Å; R135-G137 VanDerWaalsContact O-N 3.16Å; R135-F138 PolarHBondContact N-O 3.2Å; R135-F138 PolarHBondContact O-N 3.25Å
136D93.3Very high96.7Very high116 Ų11673.4 Ų73.462%0.6236%0.364SS*.THydrogen-bonded Turntrans55.233.4171.7-51.6-36.2000113.9F138D136-F138 VanDerWaalsContact C-N 3.34Å; D136-F138 WeakPolarHBondContact O-CD2 3.19Å; D136-F138 WeakPolarHBondContact O-CE2 3.29Å
137G93.8Very high96.6Very high37 Ų3773 Ų7338%0.38136%0.364SS..THydrogen-bonded Turntrans76.817.4-176.400000114.5R135 I165R135-G137 PolarHBondContact O-N 3.13Å; R135-G137 VanDerWaalsContact O-N 3.16Å; G137-I165 WeakPolarHBondContact O-CB 3.34Å; G137-I165 PolarHBondContact O-N 2.78Å
138F96.8Very high96.6Very high59 Ų5976.3 Ų76.326%0.25937%0.368SS..EExtended strand (participates in β ladder)trans-128.1149.5175.6-61.4-96.4000112.1T134 R135 D136 K162 I163 Q164T134-F138 CarbonylContact C-O 3.57Å; T134-F138 WeakPolarHBondContact CA-O 3.48Å; R135-F138 PolarHBondContact N-O 3.2Å; R135-F138 PolarHBondContact O-N 3.25Å; D136-F138 VanDerWaalsContact C-N 3.34Å; D136-F138 WeakPolarHBondContact O-CD2 3.19Å; D136-F138 WeakPolarHBondContact O-CE2 3.29Å; F138-K162 HydrophobicContact CB-CD 4.25Å; F138-K162 VanDerWaalsContact CB-CE 3.44Å; F138-K162 HydrophobicContact CB-CG 3.76Å; F138-K162 HydrophobicContact CD1-CD 3.99Å; F138-K162 HydrophobicContact CD1-CG 3.58Å; F138-K162 HydrophobicContact CE1-CD 4.48Å; F138-K162 HydrophobicContact CE1-CG 4.39Å; F138-K162 HydrophobicContact CG-CD 4.05Å; F138-K162 HydrophobicContact CG-CG 3.84Å; F138-I163 CarbonylContact C-O 3.51Å; F138-I163 WeakPolarHBondContact CA-O 3.34Å; F138-I163 WeakPolarHBondContact CB-O 3.4Å; F138-Q164 VanDerWaalsContact CD1-CA 3.46Å; F138-Q164 HydrophobicContact CD1-CB 3.82Å; F138-Q164 HydrophobicContact CD1-CG 4.24Å; F138-Q164 HydrophobicContact CE1-CB 3.64Å; F138-Q164 HydrophobicContact CE1-CG 3.85Å; F138-Q164 HydrophobicContact CZ-CG 4.26Å
139V97.9Very high96.4Very high0 Ų072.9 Ų72.90%035%0.352CS..EExtended strand (participates in β ladder)trans-97.6119.5160.5-173.50000108.4W116 V132 K133 K162 I163 I165 V174 I186W116-V139 HydrophobicContact CH2-CG2 3.98Å; W116-V139 HydrophobicContact CZ3-CG2 4.23Å; V132-V139 HydrophobicContact CG1-CG1 3.66Å; K133-V139 CarbonylContact O-C 3.49Å; K133-V139 WeakPolarHBondContact O-CA 3.39Å; V139-K162 CarbonylContact O-C 3.56Å; V139-K162 WeakPolarHBondContact O-CA 3.43Å; V139-I163 PolarHBondContact N-O 2.79Å; V139-I163 PolarHBondContact O-N 3.4Å; V139-I165 HydrophobicContact CG2-CD1 3.68Å; V139-I165 HydrophobicContact CG2-CG1 3.79Å; V139-V174 HydrophobicContact CG2-CG1 3.96Å; V139-V174 HydrophobicContact CG2-CG2 4.27Å; V139-I186 HydrophobicContact CG1-CD1 3.96Å; V139-I186 HydrophobicContact CG1-CG2 4.29Å; V139-I186 HydrophobicContact CG2-CG2 4.33Å
140E97.9Very high96.1Very high73 Ų7380.6 Ų80.634%0.34139%0.388SS..EExtended strand (participates in β ladder)trans-103.3120174-172.3179.4133.700109.6V132 K133 T160 K161V132-E140 CarbonylContact C-O 3.55Å; V132-E140 WeakPolarHBondContact CA-O 3.47Å; K133-E140 PolarHBondContact N-O 3.02Å; K133-E140 PolarHBondContact O-N 2.99Å; E140-T160 HydrophobicContact CG-CG2 3.99Å; E140-K161 WeakPolarHBondContact CA-O 3.37Å
141V98.1Very high95.9Very high0 Ų088.2 Ų88.20%042%0.423CS..EExtended strand (participates in β ladder)trans-105.1122.6172.5-174.10000107.6N131 V132 F159 T160 K161 L184 I186N131-V141 CarbonylContact O-C 3.57Å; N131-V141 WeakPolarHBondContact O-CA 3.4Å; V132-V141 HydrophobicContact CG2-CG1 4.45Å; V132-V141 HydrophobicContact CG2-CG2 4.46Å; V141-F159 HydrophobicContact CB-CE1 4.13Å; V141-F159 HydrophobicContact CG1-CD1 4.42Å; V141-F159 HydrophobicContact CG1-CE1 3.83Å; V141-T160 CarbonylContact O-C 3.58Å; V141-T160 VanDerWaalsContact O-CA 3.29Å; V141-T160 WeakPolarHBondContact O-CA 3.4Å; V141-K161 PolarHBondContact N-O 2.87Å; V141-K161 PolarHBondContact O-N 2.8Å; V141-L184 HydrophobicContact CB-CD2 4.3Å; V141-L184 HydrophobicContact CG1-CD2 3.47Å; V141-L184 VanDerWaalsContact CG1-CD2 3.47Å; V141-L184 HydrophobicContact CG2-CD2 3.78Å; V141-I186 HydrophobicContact CG2-CD1 3.63Å
142S97.9Very high95.4Very high25 Ų2588.4 Ų88.418%0.17544%0.441CS..EExtended strand (participates in β ladder)trans-126.3152.5176.9610000111.2L130 N131 F159L130-S142 CarbonylContact C-O 3.57Å; L130-S142 WeakPolarHBondContact CA-O 3.43Å; N131-S142 PolarHBondContact N-O 2.78Å; N131-S142 PolarHBondContact O-N 2.91Å; N131-S142 PolarHBondContact O-OG 3.31Å; S142-F159 CarbonylContact C-O 3.55Å; S142-F159 WeakPolarHBondContact CA-O 3.09Å
143G97.9Very high95.1Very high1 Ų187.3 Ų87.31%0.0144%0.439CS..EExtended strand (participates in β ladder)trans-148.3139.9178.800000110.9E129 N158 F159E129-G143 WeakPolarHBondContact O-CA 3.5Å; G143-N158 CarbonylContact O-C 3.58Å; G143-N158 WeakPolarHBondContact O-CA 3.15Å; G143-F159 PolarHBondContact N-O 3.1Å; G143-F159 PolarHBondContact O-N 3.41Å
144K97.5Very high95Very high171 Ų17186.6 Ų86.674%0.74344%0.44SS*.EExtended strand (participates in β ladder)trans-135117.6175-67.6-175.9-178.5-178.50109.5E129 K157E129-K144 WeakPolarHBondContact CB-O 3.5Å; E129-K144 PolarHBondContact O-N 2.87Å; K144-K157 WeakPolarHBondContact CA-O 3.41Å
145H96.9Very high94.9Very high20 Ų2085.6 Ų85.69%0.09343%0.434CS..EExtended strand (participates in β ladder)trans-119.8135.9-178.3176.671.7000109.7F125 E129 E147 T156 K157F125-H145 HydrophobicContact CD1-CB 3.71Å; F125-H145 HydrophobicContact CE1-CB 3.84Å; E129-H145 VanDerWaalsContact CD-ND1 3.26Å; E129-H145 IonicContact OE1-CE1 2.81Å; E129-H145 IonicContact OE1-CG 2.98Å; E129-H145 IonicContact OE1-ND1 3.76Å; E129-H145 PolarHBondContact OE1-ND1 2.85Å; E129-H145 WeakPolarHBondContact OE2-CB 3.29Å; E129-H145 IonicContact OE2-CG 3.52Å; E129-H145 IonicContact OE2-ND1 3.72Å; E129-H145 PolarHBondContact OE2-ND1 2.9Å; H145-E147 IonicContact NE2-OE2 3.79Å; H145-T156 CarbonylContact O-C 3.51Å; H145-T156 VanDerWaalsContact O-CA 3.25Å; H145-T156 WeakPolarHBondContact O-CA 3.27Å; H145-K157 HydrophobicContact CB-CB 4.27Å; H145-K157 PolarHBondContact N-O 3.02Å; H145-K157 PolarHBondContact O-N 3.27Å
146E95.7Very high94.9Very high119 Ų11981.2 Ų81.256%0.55643%0.427SS*.EExtended strand (participates in β ladder)trans-130.3121.4172.3-173.5179.4105.300109.2I154 V155E146-I154 HydrophobicContact CG-CG2 3.47Å; E146-I154 VanDerWaalsContact CG-CG2 3.47Å; E146-V155 CarbonylContact C-O 3.56Å; E146-V155 WeakPolarHBondContact CA-O 3.44Å
147E93.9Very high95Very high102 Ų10279.6 Ų79.648%0.47742%0.415SS..EExtended strand (participates in β ladder)trans-119.9125.9178-177.6178.7-177.800109.7H145 I154 V155H145-E147 IonicContact NE2-OE2 3.79Å; E147-I154 CarbonylContact O-C 3.59Å; E147-I154 WeakPolarHBondContact O-CA 3.5Å; E147-V155 HydrophobicContact CB-CB 4.45Å; E147-V155 PolarHBondContact N-O 3.13Å; E147-V155 PolarHBondContact O-N 3.04Å
148K94.6Very high95.2Very high162 Ų16284.2 Ų84.270%0.70443%0.431SS*.EExtended strand (participates in β ladder)trans-86.1121.4172-65.4-177.3-179.8178.30108.6I154K148-I154 HydrophobicContact CG-CG1 4.49Å
149Q93.3Very high95.2Very high97 Ų9783.9 Ų83.945%0.45343%0.429SS..  trans-79.1152.3173.7-59.6-174.97.400110.4E151 G152 G153 V155Q149-E151 VanDerWaalsContact C-N 3.27Å; Q149-E151 PolarHBondContact O-N 2.87Å; Q149-G152 PolarHBondContact O-N 2.98Å; Q149-G153 PolarHBondContact N-O 2.89Å; Q149-V155 HydrophobicContact CG-CG2 4.02Å
150E90.3Very high95.1Very high205 Ų20588.4 Ų88.496%0.95846%0.457SS*.THydrogen-bonded Turntrans-60-35-179.7-172.3176.3-174.700112.9G152E150-G152 PolarHBondContact O-N 2.76Å; E150-G152 VanDerWaalsContact O-N 3.13Å
151E92.7Very high95.1Very high188 Ų18888.1 Ų88.188%0.87946%0.455SS*.THydrogen-bonded Turntrans-76.47.7178-153.4-179.8168.200113.4Q149Q149-E151 VanDerWaalsContact C-N 3.27Å; Q149-E151 PolarHBondContact O-N 2.87Å
152G87.9Confident95Very high69 Ų6993.5 Ų93.571%0.71148%0.478SS*.SBendtrans86.29.5179.700000114.8Q149 E150Q149-G152 PolarHBondContact O-N 2.98Å; E150-G152 PolarHBondContact O-N 2.76Å; E150-G152 VanDerWaalsContact O-N 3.13Å
153G92.3Very high95Very high28 Ų2893.3 Ų93.329%0.28948%0.475SS..  trans-78.5158.7171.100000113.1Q149Q149-G153 PolarHBondContact N-O 2.89Å
154I94.5Very high95Very high100 Ų10099.1 Ų99.151%0.51350%0.502SS..EExtended strand (participates in β ladder)trans-123.5128.8172.5-56.8175.2000108.6E146 E147 K148E146-I154 HydrophobicContact CG-CG2 3.47Å; E146-I154 VanDerWaalsContact CG-CG2 3.47Å; E147-I154 CarbonylContact O-C 3.59Å; E147-I154 WeakPolarHBondContact O-CA 3.5Å; K148-I154 HydrophobicContact CG-CG1 4.49Å
155V94.1Very high94.9Very high41 Ų4191.5 Ų91.525%0.24847%0.469CS..EExtended strand (participates in β ladder)trans-104.8119.5170.8-1760000108.5E146 E147 Q149 K157E146-V155 CarbonylContact C-O 3.56Å; E146-V155 WeakPolarHBondContact CA-O 3.44Å; E147-V155 HydrophobicContact CB-CB 4.45Å; E147-V155 PolarHBondContact N-O 3.13Å; E147-V155 PolarHBondContact O-N 3.04Å; Q149-V155 HydrophobicContact CG-CG2 4.02Å; V155-K157 HydrophobicContact CG1-CG 4.35Å
156T95.6Very high94.7Very high92 Ų9291.3 Ų91.356%0.56447%0.47SS*.EExtended strand (participates in β ladder)trans-111.9126.7172.4-48.20000109.7H145H145-T156 CarbonylContact O-C 3.51Å; H145-T156 VanDerWaalsContact O-CA 3.25Å; H145-T156 WeakPolarHBondContact O-CA 3.27Å
157K95.9Very high94.5Very high82 Ų8292.7 Ų92.736%0.35749%0.487SS..EExtended strand (participates in β ladder)trans-114.6136.2171.3-60.3176.4-176.7167.30109.4F125 K144 H145 V155F125-K157 HydrophobicContact CE1-CB 4.12Å; F125-K157 HydrophobicContact CZ-CB 3.98Å; K144-K157 WeakPolarHBondContact CA-O 3.41Å; H145-K157 HydrophobicContact CB-CB 4.27Å; H145-K157 PolarHBondContact N-O 3.02Å; H145-K157 PolarHBondContact O-N 3.27Å; V155-K157 HydrophobicContact CG1-CG 4.35Å
158N96.6Very high94.4Very high135 Ų13591.2 Ų91.272%0.72248%0.482SS*.EExtended strand (participates in β ladder)trans-123.314317256.658.4000109.8G143G143-N158 CarbonylContact O-C 3.58Å; G143-N158 WeakPolarHBondContact O-CA 3.15Å
159F96.6Very high94.3Very high51 Ų5183.7 Ų83.722%0.22445%0.449CS..EExtended strand (participates in β ladder)trans-136.2138178.4173.5-105.4000109.2V120 V122 F125 V141 S142 G143 K161V120-F159 HydrophobicContact CG1-CE1 4.07Å; V120-F159 HydrophobicContact CG1-CZ 3.65Å; V122-F159 HydrophobicContact CG1-CE1 4.18Å; F125-F159 HydrophobicContact CE1-CB 4.24Å; F125-F159 HydrophobicContact CE2-CB 3.64Å; F125-F159 HydrophobicContact CE2-CG 4.32Å; F125-F159 HydrophobicContact CZ-CB 3.45Å; F125-F159 VanDerWaalsContact CZ-CB 3.45Å; V141-F159 HydrophobicContact CB-CE1 4.13Å; V141-F159 HydrophobicContact CG1-CD1 4.42Å; V141-F159 HydrophobicContact CG1-CE1 3.83Å; S142-F159 CarbonylContact C-O 3.55Å; S142-F159 WeakPolarHBondContact CA-O 3.09Å; G143-F159 PolarHBondContact N-O 3.1Å; G143-F159 PolarHBondContact O-N 3.41Å; F159-K161 HydrophobicContact CE1-CB 3.81Å; F159-K161 HydrophobicContact CE2-CB 3.96Å; F159-K161 HydrophobicContact CZ-CB 3.32Å; F159-K161 HydrophobicContact CZ-CD 3.9Å; F159-K161 HydrophobicContact CZ-CG 4.24Å
160T97.1Very high94.2Very high96 Ų9681.2 Ų81.259%0.58944%0.44SS*.EExtended strand (participates in β ladder)trans-147.8122.8169.2-54.60000108.5E140 V141E140-T160 HydrophobicContact CG-CG2 3.99Å; V141-T160 CarbonylContact O-C 3.58Å; V141-T160 VanDerWaalsContact O-CA 3.29Å; V141-T160 WeakPolarHBondContact O-CA 3.4Å
161K97Very high94.3Very high67 Ų6774.2 Ų74.229%0.29141%0.412SS..EExtended strand (participates in β ladder)trans-131.3120.4178-175.5177.8-176.3-177.80109.3V120 E140 V141 F159 I163V120-K161 HydrophobicContact CB-CD 4.46Å; V120-K161 HydrophobicContact CG1-CD 3.62Å; V120-K161 HydrophobicContact CG2-CD 4.02Å; E140-K161 WeakPolarHBondContact CA-O 3.37Å; V141-K161 PolarHBondContact N-O 2.87Å; V141-K161 PolarHBondContact O-N 2.8Å; F159-K161 HydrophobicContact CE1-CB 3.81Å; F159-K161 HydrophobicContact CE2-CB 3.96Å; F159-K161 HydrophobicContact CZ-CB 3.32Å; F159-K161 HydrophobicContact CZ-CD 3.9Å; F159-K161 HydrophobicContact CZ-CG 4.24Å; K161-I163 HydrophobicContact CG-CG1 4.35Å
162K97.5Very high94.3Very high113 Ų11372.7 Ų72.749%0.49141%0.409SS..EExtended strand (participates in β ladder)trans-103128.4177.9-170.1170.9176.6171.90109.6F138 V139F138-K162 HydrophobicContact CB-CD 4.25Å; F138-K162 VanDerWaalsContact CB-CE 3.44Å; F138-K162 HydrophobicContact CB-CG 3.76Å; F138-K162 HydrophobicContact CD1-CD 3.99Å; F138-K162 HydrophobicContact CD1-CG 3.58Å; F138-K162 HydrophobicContact CE1-CD 4.48Å; F138-K162 HydrophobicContact CE1-CG 4.39Å; F138-K162 HydrophobicContact CG-CD 4.05Å; F138-K162 HydrophobicContact CG-CG 3.84Å; V139-K162 CarbonylContact O-C 3.56Å; V139-K162 WeakPolarHBondContact O-CA 3.43Å
163I97.3Very high94.6Very high20 Ų2071.5 Ų71.510%0.10339%0.388CS..EExtended strand (participates in β ladder)trans-121.9124.6-176.4-61.6158.7000107.3W116 V118 V120 F138 V139 K161 I186W116-I163 HydrophobicContact CH2-CG2 4.05Å; W116-I163 HydrophobicContact CZ2-CG2 3.74Å; V118-I163 HydrophobicContact CG1-CD1 3.81Å; V118-I163 HydrophobicContact CG1-CG1 4.48Å; V118-I163 HydrophobicContact CG1-CG2 4.4Å; V118-I163 HydrophobicContact CG2-CG2 4.17Å; V120-I163 HydrophobicContact CG2-CD1 3.83Å; F138-I163 CarbonylContact C-O 3.51Å; F138-I163 WeakPolarHBondContact CA-O 3.34Å; F138-I163 WeakPolarHBondContact CB-O 3.4Å; V139-I163 PolarHBondContact N-O 2.79Å; V139-I163 PolarHBondContact O-N 3.4Å; K161-I163 HydrophobicContact CG-CG1 4.35Å; I163-I186 HydrophobicContact CD1-CD1 3.78Å
164Q96.8Very high94.8Very high124 Ų12471.6 Ų71.658%0.57938%0.383SS*.EExtended strand (participates in β ladder)trans-75.4131.8176.8-169.8173.2-27.800110.1F138F138-Q164 VanDerWaalsContact CD1-CA 3.46Å; F138-Q164 HydrophobicContact CD1-CB 3.82Å; F138-Q164 HydrophobicContact CD1-CG 4.24Å; F138-Q164 HydrophobicContact CE1-CB 3.64Å; F138-Q164 HydrophobicContact CE1-CG 3.85Å; F138-Q164 HydrophobicContact CZ-CG 4.26Å
165I95.6Very high94.9Very high11 Ų1172.6 Ų72.66%0.05638%0.383CS..PPolyproline II helixtrans-83.9126.6173.2-56.9173.5000107.1W116 T134 G137 V139 V169 P171 V174W116-I165 HydrophobicContact CH2-CG1 4.08Å; T134-I165 HydrophobicContact CG2-CD1 3.66Å; G137-I165 WeakPolarHBondContact O-CB 3.34Å; G137-I165 PolarHBondContact O-N 2.78Å; V139-I165 HydrophobicContact CG2-CD1 3.68Å; V139-I165 HydrophobicContact CG2-CG1 3.79Å; I165-V169 HydrophobicContact CG2-CB 3.71Å; I165-V169 HydrophobicContact CG2-CG1 3.68Å; I165-P171 HydrophobicContact CD1-CB 4.01Å; I165-V174 HydrophobicContact CD1-CG2 4.13Å
166P94.4Very high95Very high15 Ų1572.3 Ų72.310%0.09739%0.385CS..PPolyproline II helixtrans-58.2151.3171.8-24.235.4000112.1D168 V169P166-D168 WeakPolarHBondContact CB-OD1 3.29Å; P166-D168 PolarHBondContact O-N 3.49Å; P166-V169 HydrophobicContact CB-CG2 4Å; P166-V169 HydrophobicContact CG-CG2 4.12Å; P166-V169 PolarHBondContact O-N 3.31Å; P166-V169 VanDerWaalsContact O-N 3.13Å
167T91Very high95.1Very high149 Ų14970 Ų7091%0.91437%0.373SS*.THydrogen-bonded Turntrans-65.9-22.5-177.939.20000114.2V169T167-V169 VanDerWaalsContact C-N 3.3Å
168D90.5Very high95.2Very high70 Ų7069.1 Ų69.137%0.37437%0.372SS..THydrogen-bonded Turntrans-85.91.6177.655.9-46.6000113.2P166 Q190 T191P166-D168 WeakPolarHBondContact CB-OD1 3.29Å; P166-D168 PolarHBondContact O-N 3.49Å; D168-Q190 CarbonylContact O-C 3.47Å; D168-Q190 VanDerWaalsContact O-CA 3.22Å; D168-Q190 WeakPolarHBondContact O-CA 3.37Å; D168-T191 PolarHBondContact O-N 3.43Å
169V92.5Very high95.2Very high4 Ų464.1 Ų64.12%0.02435%0.347CS..BIsolated β-bridgetrans-109134.2179.9174.60000110.2W116 I165 P166 T167 P171 A188W116-V169 HydrophobicContact CB-CG1 4.11Å; W116-V169 HydrophobicContact CB-CG2 3.57Å; W116-V169 HydrophobicContact CD2-CG1 4.32Å; W116-V169 HydrophobicContact CE3-CG1 4.16Å; W116-V169 HydrophobicContact CG-CG1 4.36Å; W116-V169 HydrophobicContact CG-CG2 3.88Å; I165-V169 HydrophobicContact CG2-CB 3.71Å; I165-V169 HydrophobicContact CG2-CG1 3.68Å; P166-V169 HydrophobicContact CB-CG2 4Å; P166-V169 HydrophobicContact CG-CG2 4.12Å; P166-V169 PolarHBondContact O-N 3.31Å; P166-V169 VanDerWaalsContact O-N 3.13Å; T167-V169 VanDerWaalsContact C-N 3.3Å; V169-P171 VanDerWaalsContact O-CD 3.28Å; V169-P171 WeakPolarHBondContact O-CD 3.41Å; V169-A188 HydrophobicContact CG1-CB 3.45Å; V169-A188 VanDerWaalsContact CG1-CB 3.45Å
170D91.6Very high95.2Very high46 Ų4668.1 Ų68.125%0.24638%0.379CS..  trans-79.4112.7178.1-177.6-2.5000110.2L172 T173 R189 T191D170-L172 PolarHBondContact O-N 2.8Å; D170-L172 WeakPolarHBondContact OD1-CB 3.49Å; D170-L172 PolarHBondContact OD1-N 2.96Å; D170-T173 HydrophobicContact CB-CG2 3.91Å; D170-T173 PolarHBondContact O-N 2.86Å; D170-T173 VanDerWaalsContact O-N 3.08Å; D170-T173 PolarHBondContact O-OG1 2.84Å; D170-T173 WeakPolarHBondContact OD2-CG2 3.29Å; D170-R189 PolarHBondContact N-O 3.2Å; D170-T191 PolarHBondContact N-OG1 3.36Å
171P93.1Very high95.1Very high57 Ų5771.1 Ų71.137%0.3739%0.386SS..G310 helixtrans-63.7-20.9-179.728.3-36.4000113.4T134 I165 V169 T173 V174T134-P171 HydrophobicContact CG2-CB 3.97Å; I165-P171 HydrophobicContact CD1-CB 4.01Å; V169-P171 VanDerWaalsContact O-CD 3.28Å; V169-P171 WeakPolarHBondContact O-CD 3.41Å; P171-T173 VanDerWaalsContact C-N 3.28Å; P171-V174 VanDerWaalsContact O-CG2 3.29Å; P171-V174 WeakPolarHBondContact O-CG2 3.28Å
172L92.8Very high95.1Very high157 Ų15768.4 Ų68.482%0.82238%0.377SS*.G310 helixtrans-75.7-20.6178-59178.5000112.4D170 V174D170-L172 PolarHBondContact O-N 2.8Å; D170-L172 WeakPolarHBondContact OD1-CB 3.49Å; D170-L172 PolarHBondContact OD1-N 2.96Å; L172-V174 VanDerWaalsContact C-N 3.32Å
173T94Very high95.1Very high44 Ų4465.1 Ų65.127%0.2737%0.366SS..G310 helixtrans-91.45.4179.267.50000113.3D170 P171 F175 R189D170-T173 HydrophobicContact CB-CG2 3.91Å; D170-T173 PolarHBondContact O-N 2.86Å; D170-T173 VanDerWaalsContact O-N 3.08Å; D170-T173 PolarHBondContact O-OG1 2.84Å; D170-T173 WeakPolarHBondContact OD2-CG2 3.29Å; P171-T173 VanDerWaalsContact C-N 3.28Å; T173-F175 PolarHBondContact O-N 2.9Å; T173-R189 HydrophobicContact CG2-CB 4.21Å; T173-R189 PolarHBondContact OG1-N 2.98Å; T173-R189 PolarHBondContact OG1-O 3.47Å
174V96.3Very high95.2Very high30 Ų3064.6 Ų64.618%0.18236%0.364CS..  trans-64.9123178.3174.90000110T134 V139 I165 P171 L172 I186 E187 A188T134-V174 HydrophobicContact CG2-CG2 4.4Å; V139-V174 HydrophobicContact CG2-CG1 3.96Å; V139-V174 HydrophobicContact CG2-CG2 4.27Å; I165-V174 HydrophobicContact CD1-CG2 4.13Å; P171-V174 VanDerWaalsContact O-CG2 3.29Å; P171-V174 WeakPolarHBondContact O-CG2 3.28Å; L172-V174 VanDerWaalsContact C-N 3.32Å; V174-I186 HydrophobicContact CG1-CG2 3.94Å; V174-E187 CarbonylContact C-O 3.54Å; V174-E187 WeakPolarHBondContact CA-O 3.44Å; V174-A188 HydrophobicContact CB-CB 4.49Å; V174-A188 HydrophobicContact CG2-CB 3.84Å
175F96.4Very high95.2Very high120 Ų12060.4 Ų60.453%0.52635%0.345SS..EExtended strand (participates in β ladder)trans-126.3150.6173.7179.1-101.8000110T173 I186 E187T173-F175 PolarHBondContact O-N 2.9Å; F175-I186 WeakPolarHBondContact O-CA 3.4Å; F175-E187 HydrophobicContact CB-CG 4.22Å; F175-E187 HydrophobicContact CD1-CG 4.19Å; F175-E187 WeakPolarHBondContact CD1-OE1 2.98Å; F175-E187 PolarHBondContact N-O 2.73Å; F175-E187 PolarHBondContact O-N 2.93Å
176A96.8Very high95.3Very high35 Ų3559.9 Ų59.929%0.28934%0.343SS..EExtended strand (participates in β ladder)trans-131.6136.4178.700000110.9V132 L184 I185 I186V132-A176 HydrophobicContact CG1-CB 4.47Å; V132-A176 HydrophobicContact CG2-CB 4.39Å; A176-L184 HydrophobicContact CB-CD1 4.24Å; A176-I185 CarbonylContact C-O 3.46Å; A176-I185 VanDerWaalsContact CA-O 3.29Å; A176-I185 WeakPolarHBondContact CA-O 3.22Å; A176-I186 HydrophobicContact CB-CG1 4.33Å
177S97.3Very high95.4Very high44 Ų4462.5 Ų62.531%0.30835%0.353SS..EExtended strand (participates in β ladder)trans-130.3147.3174.557.10000110.2L184 I185S177-L184 CarbonylContact O-C 3.55Å; S177-L184 WeakPolarHBondContact O-CA 3.46Å; S177-I185 PolarHBondContact N-O 3.38Å; S177-I185 PolarHBondContact O-N 2.98Å
178L97.8Very high95.6Very high64 Ų6455.6 Ų55.634%0.33531%0.311SS..EExtended strand (participates in β ladder)trans-111.5124.5179.618062.5000109.5V122 P127 L130 L184V122-L178 HydrophobicContact CG2-CD1 3.52Å; P127-L178 HydrophobicContact CB-CD2 3.72Å; P127-L178 HydrophobicContact CG-CD2 3.63Å; L130-L178 HydrophobicContact CD1-CD2 4.28Å; L178-L184 HydrophobicContact CB-CD1 4.37Å; L178-L184 HydrophobicContact CD1-CB 4.32Å
179S97.4Very high95.7Very high29 Ų2960.8 Ų60.820%0.20333%0.326CS..  trans-76.6155.4173.577.80000111.5E181 G182 V183S179-E181 PolarHBondContact O-N 3.17Å; S179-G182 PolarHBondContact O-N 3.12Å; S179-V183 PolarHBondContact N-O 3.34Å; S179-V183 WeakPolarHBondContact OG-CB 3.45Å; S179-V183 PolarHBondContact OG-N 3.47Å; S179-V183 PolarHBondContact OG-O 3.19Å
180P95.9Very high95.6Very high136 Ų13663.4 Ų63.488%0.88334%0.338SS*.THydrogen-bonded Turntrans-57.3-29.5173.7-25.135000113.7G182P180-G182 PolarHBondContact O-N 3.3Å
181E95.8Very high95.2Very high158 Ų15864.7 Ų64.774%0.73835%0.347SS*.THydrogen-bonded Turntrans-76.14.8177.3-55.2-54.4146.600113.5S179S179-E181 PolarHBondContact O-N 3.17Å
182G96.8Very high94.4Very high11 Ų1164.7 Ų64.711%0.11335%0.348CS..SBendtrans76.930178.800000113.7N121 V122 H123 S179 P180N121-G182 PolarHBondContact OD1-O 3.21Å; V122-G182 CarbonylContact C-O 3.59Å; V122-G182 WeakPolarHBondContact CA-O 3.4Å; V122-G182 VanDerWaalsContact CG2-O 3.27Å; V122-G182 WeakPolarHBondContact CG2-O 3.25Å; V122-G182 PolarHBondContact N-O 3.11Å; H123-G182 PolarHBondContact N-O 3.23Å; H123-G182 VanDerWaalsContact N-O 3.14Å; S179-G182 PolarHBondContact O-N 3.12Å; P180-G182 PolarHBondContact O-N 3.3Å
183V97.9Very high93.4Very high43 Ų4361.2 Ų61.226%0.26133%0.334SS..EExtended strand (participates in β ladder)trans-105.8114.3173.8-174.60000109.4C119 S179 I185C119-V183 HydrophobicContact CB-CG1 3.94Å; S179-V183 PolarHBondContact N-O 3.34Å; S179-V183 WeakPolarHBondContact OG-CB 3.45Å; S179-V183 PolarHBondContact OG-N 3.47Å; S179-V183 PolarHBondContact OG-O 3.19Å; V183-I185 HydrophobicContact CG1-CG1 4.43Å
184L98.3Very high92.1Very high10 Ų1067.9 Ų67.95%0.05236%0.356CS..EExtended strand (participates in β ladder)trans-79.4120.9171.6-174.874.9000109.3C119 V120 V122 V132 V141 A176 S177 L178 I186C119-L184 CarbonylContact C-O 3.47Å; C119-L184 WeakPolarHBondContact CA-O 3.15Å; V120-L184 HydrophobicContact CB-CB 4.31Å; V120-L184 PolarHBondContact N-O 3.46Å; V120-L184 PolarHBondContact O-N 3.2Å; V122-L184 HydrophobicContact CG1-CB 4.28Å; V122-L184 HydrophobicContact CG2-CB 3.91Å; V132-L184 HydrophobicContact CG2-CD2 3.84Å; V141-L184 HydrophobicContact CB-CD2 4.3Å; V141-L184 HydrophobicContact CG1-CD2 3.47Å; V141-L184 VanDerWaalsContact CG1-CD2 3.47Å; V141-L184 HydrophobicContact CG2-CD2 3.78Å; A176-L184 HydrophobicContact CB-CD1 4.24Å; S177-L184 CarbonylContact O-C 3.55Å; S177-L184 WeakPolarHBondContact O-CA 3.46Å; L178-L184 HydrophobicContact CB-CD1 4.37Å; L178-L184 HydrophobicContact CD1-CB 4.32Å; L184-I186 HydrophobicContact CD2-CD1 4.28Å; L184-I186 HydrophobicContact CD2-CG1 4.34Å; L184-I186 HydrophobicContact CG-CG1 4.36Å
185I97.9Very high90.6Very high36 Ų3676 Ų7619%0.18538%0.384CS..EExtended strand (participates in β ladder)trans-106120.6179.7-61.2163.9000107.4K117 A176 S177 V183K117-I185 HydrophobicContact CD-CG2 4.33Å; K117-I185 HydrophobicContact CG-CG2 4.19Å; A176-I185 CarbonylContact C-O 3.46Å; A176-I185 VanDerWaalsContact CA-O 3.29Å; A176-I185 WeakPolarHBondContact CA-O 3.22Å; S177-I185 PolarHBondContact N-O 3.38Å; S177-I185 PolarHBondContact O-N 2.98Å; V183-I185 HydrophobicContact CG1-CG1 4.43Å
186I97.7Very high89.1Confident0 Ų076.2 Ų76.20%039%0.39CS..EExtended strand (participates in β ladder)trans-110.9127.4178-60.2161.3000107.3W116 K117 V118 V120 V139 V141 I163 V174 F175 A176 L184W116-I186 HydrophobicContact CH2-CG2 4.32Å; W116-I186 HydrophobicContact CZ3-CG2 3.86Å; K117-I186 CarbonylContact C-O 3.45Å; K117-I186 VanDerWaalsContact CA-O 3.3Å; K117-I186 WeakPolarHBondContact CA-O 3.3Å; V118-I186 PolarHBondContact N-O 2.95Å; V118-I186 PolarHBondContact O-N 3.27Å; V120-I186 HydrophobicContact CG2-CD1 4.2Å; V139-I186 HydrophobicContact CG1-CD1 3.96Å; V139-I186 HydrophobicContact CG1-CG2 4.29Å; V139-I186 HydrophobicContact CG2-CG2 4.33Å; V141-I186 HydrophobicContact CG2-CD1 3.63Å; I163-I186 HydrophobicContact CD1-CD1 3.78Å; V174-I186 HydrophobicContact CG1-CG2 3.94Å; F175-I186 WeakPolarHBondContact O-CA 3.4Å; A176-I186 HydrophobicContact CB-CG1 4.33Å; L184-I186 HydrophobicContact CD2-CD1 4.28Å; L184-I186 HydrophobicContact CD2-CG1 4.34Å; L184-I186 HydrophobicContact CG-CG1 4.36Å
187E96.6Very high87.4Confident69 Ų6981.7 Ų81.732%0.32241%0.408SS..EExtended strand (participates in β ladder)trans-132.6149.1-179.364.4-170.9177.900112.1W116 V174 F175W116-E187 CarbonylContact O-C 3.54Å; W116-E187 WeakPolarHBondContact O-CA 3.36Å; V174-E187 CarbonylContact C-O 3.54Å; V174-E187 WeakPolarHBondContact CA-O 3.44Å; F175-E187 HydrophobicContact CB-CG 4.22Å; F175-E187 HydrophobicContact CD1-CG 4.19Å; F175-E187 WeakPolarHBondContact CD1-OE1 2.98Å; F175-E187 PolarHBondContact N-O 2.73Å; F175-E187 PolarHBondContact O-N 2.93Å
188A95.1Very high85.6Confident4 Ų482.9 Ų82.93%0.03342%0.416CS..EExtended strand (participates in β ladder)trans-152.7156.8174.600000111.2P115 W116 V169 V174P115-A188 CarbonylContact C-O 3.59Å; P115-A188 WeakPolarHBondContact CA-O 3.49Å; P115-A188 WeakPolarHBondContact CB-O 3.37Å; W116-A188 HydrophobicContact CE3-CB 3.69Å; W116-A188 HydrophobicContact CZ3-CB 4.28Å; W116-A188 PolarHBondContact N-O 2.8Å; W116-A188 PolarHBondContact O-N 3.32Å; V169-A188 HydrophobicContact CG1-CB 3.45Å; V169-A188 VanDerWaalsContact CG1-CB 3.45Å; V174-A188 HydrophobicContact CB-CB 4.49Å; V174-A188 HydrophobicContact CG2-CB 3.84Å
189R92.1Very high83.6Confident180 Ų18084.6 Ų84.668%0.67943%0.434SS*.PPolyproline II helixtrans-85.5146.6178.3-60.7-176.767.9178.7-0110.4D170 T173D170-R189 PolarHBondContact N-O 3.2Å; T173-R189 HydrophobicContact CG2-CB 4.21Å; T173-R189 PolarHBondContact OG1-N 2.98Å; T173-R189 PolarHBondContact OG1-O 3.47Å
190Q89.5Confident81.6Confident58 Ų5892.2 Ų92.227%0.27147%0.466SS..BIsolated β-bridgetrans-71137.7168.4-64.9179.243.700109.6T110 E114 D168T110-Q190 PolarHBondContact OG1-NE2 3.34Å; E114-Q190 PolarHBondContact O-NE2 3.36Å; D168-Q190 CarbonylContact O-C 3.47Å; D168-Q190 VanDerWaalsContact O-CA 3.22Å; D168-Q190 WeakPolarHBondContact O-CA 3.37Å
191T84.1Confident79.3Confident73 Ų7394.6 Ų94.645%0.44847%0.465SS..PPolyproline II helixtrans-67.6121.7172.3-53.70000108.1D168 D170D168-T191 PolarHBondContact O-N 3.43Å; D170-T191 PolarHBondContact N-OG1 3.36Å
192P75.4Confident76.8Confident58 Ų5892.1 Ų92.138%0.37747%0.466SS..PPolyproline II helixtrans-64.5145.8-179.6-15.829000110.3Y194 L196 F197P192-Y194 PolarHBondContact O-N 3.44Å; P192-L196 HydrophobicContact CB-CD1 4.45Å; P192-F197 HydrophobicContact CB-CD2 4.39Å; P192-F197 HydrophobicContact CB-CE2 3.56Å; P192-F197 HydrophobicContact CB-CZ 4.16Å; P192-F197 HydrophobicContact CG-CE2 3.53Å; P192-F197 HydrophobicContact CG-CZ 3.78Å
193P71.9Confident74.4Confident83 Ų8397.6 Ų97.654%0.53950%0.499SS..PPolyproline II helixtrans-59.3131.4172.923.5-32.9000110.2Y195 L196P193-Y195 PolarHBondContact O-N 3.07Å; P193-L196 HydrophobicContact CG-CD1 3.68Å; P193-L196 HydrophobicContact CG-CG 4.23Å; P193-L196 WeakPolarHBondContact O-CB 3.44Å; P193-L196 PolarHBondContact O-N 3.15Å
194Y66.4Low71.9Confident185 Ų18599.1 Ų99.173%0.72552%0.524SS*.G310 helixtrans-50.3-30.1-173.5-173.2-95.6000114.8P192 L196 F197 S198P192-Y194 PolarHBondContact O-N 3.44Å; Y194-L196 PolarHBondContact O-N 2.65Å; Y194-F197 PolarHBondContact O-N 3.3Å; Y194-S198 PolarHBondContact O-OG 3.47Å
195Y66.4Low69.1Low199 Ų199102.4 Ų102.478%0.7856%0.56SS**G310 helixtrans-64.2-23.1177.6-57.5-73.1000114.3P193 F197 S198P193-Y195 PolarHBondContact O-N 3.07Å; Y195-F197 VanDerWaalsContact C-N 3.28Å; Y195-F197 PolarHBondContact O-N 3.22Å; Y195-S198 PolarHBondContact O-N 2.94Å
196L64.6Low66.4Low125 Ų125108.1 Ų108.165%0.65459%0.586SS**G310 helixtrans-71-24.2176.7-78.1167.6000112.9P192 P193 Y194P192-L196 HydrophobicContact CB-CD1 4.45Å; P193-L196 HydrophobicContact CG-CD1 3.68Å; P193-L196 HydrophobicContact CG-CG 4.23Å; P193-L196 WeakPolarHBondContact O-CB 3.44Å; P193-L196 PolarHBondContact O-N 3.15Å; Y194-L196 PolarHBondContact O-N 2.65Å
197F61.2Low63.9Low151 Ų151116 Ų11666%0.66263%0.626SS**G310 helixtrans-97-3.1178.7-66.6-70.2000113.5P192 Y194 Y195 S199P192-F197 HydrophobicContact CB-CD2 4.39Å; P192-F197 HydrophobicContact CB-CE2 3.56Å; P192-F197 HydrophobicContact CB-CZ 4.16Å; P192-F197 HydrophobicContact CG-CE2 3.53Å; P192-F197 HydrophobicContact CG-CZ 3.78Å; Y194-F197 PolarHBondContact O-N 3.3Å; Y195-F197 VanDerWaalsContact C-N 3.28Å; Y195-F197 PolarHBondContact O-N 3.22Å; F197-S199 PolarHBondContact O-N 2.72Å
198S58.4Low61.3Low69 Ų69119.9 Ų119.948%0.48364%0.644SS.*  trans-83.68-177-60.60000114Y194 Y195Y194-S198 PolarHBondContact O-OG 3.47Å; Y195-S198 PolarHBondContact O-N 2.94Å
199S56.7Low58.9Low100 Ų100128.7 Ų128.770%0.69969%0.685SS**  trans-111.741.3-173.5-56.40000113.7F197F197-S199 PolarHBondContact O-N 2.72Å
200E55.2Low56.9Low189 Ų189126.4 Ų126.488%0.88369%0.69SS**  trans-143.968.1157.9-74.1-157.2113.600109.9S202E200-S202 VanDerWaalsContact C-N 3.34Å; E200-S202 PolarHBondContact O-N 3.2Å; E200-S202 VanDerWaalsContact O-N 3.11Å
201E47.9Very low55Low186 Ų186132 Ų13287%0.86972%0.717SS**  trans-62.6101.2148.9-179169.976.400106.9P203E201-P203 WeakPolarHBondContact O-CD 3.44Å
202S42.6Very low53.4Low106 Ų106132.6 Ų132.674%0.74173%0.729SS**  trans-56.2120163.9-93.10000108.6E200 G204E200-S202 VanDerWaalsContact C-N 3.34Å; E200-S202 PolarHBondContact O-N 3.2Å; E200-S202 VanDerWaalsContact O-N 3.11Å; S202-G204 PolarHBondContact O-N 3.2Å
203P47.1Very low52.2Low125 Ų125135.9 Ų135.981%0.81275%0.75SS**  trans-70.8118.8173.128.3-29.7000108.9E201E201-P203 WeakPolarHBondContact O-CD 3.44Å
204G43.8Very low51.2Low76 Ų76141 Ų14178%0.78476%0.764SS**  trans11.6105.9161.600000118.7S202 E206S202-G204 PolarHBondContact O-N 3.2Å; G204-E206 PolarHBondContact O-N 3.39Å
205G39.5Very low50.5Low78 Ų78138 Ų13880%0.80477%0.767SS**  trans-76.397.5149.100000109.3I207G205-I207 PolarHBondContact O-N 3.21Å; G205-I207 VanDerWaalsContact O-N 3.12Å
206E41.4Very low49.7Very low156 Ų156137.9 Ų137.973%0.72977%0.773SS**  trans-59.1106.1167.6-174.5179.2103.100109.2G204 Q208G204-E206 PolarHBondContact O-N 3.39Å; E206-Q208 PolarHBondContact O-N 2.79Å
207I46.7Very low49.2Very low165 Ų165141 Ų14185%0.84679%0.785SS**  trans-72.8100.4162.135.4170000107.3G205 E209G205-I207 PolarHBondContact O-N 3.21Å; G205-I207 VanDerWaalsContact O-N 3.12Å; I207-E209 PolarHBondContact O-N 2.86Å; I207-E209 VanDerWaalsContact O-N 3.1Å
208Q40.6Very low49.2Very low152 Ų152138.1 Ų138.171%0.7179%0.788SS**  trans-61.1109.7162.3-81.9174.416.300108.2E206 V210E206-Q208 PolarHBondContact O-N 2.79Å; Q208-V210 PolarHBondContact O-N 3.14Å
209E46.3Very low49.2Very low189 Ų189140.8 Ų140.888%0.88380%0.804SS**  trans-6299166.5-169.6176.3109.900107.7I207 E211I207-E209 PolarHBondContact O-N 2.86Å; I207-E209 VanDerWaalsContact O-N 3.1Å; E209-E211 PolarHBondContact O-N 2.83Å; E209-E211 VanDerWaalsContact O-N 3.13Å
210V49.2Very low48.7Very low132 Ų132140.8 Ų140.880%0.881%0.81SS**  trans-76.5101.3171.4-170.20000107Q208 A212Q208-V210 PolarHBondContact O-N 3.14Å; V210-A212 PolarHBondContact O-N 3.29Å
211E49.3Very low48.3Very low176 Ų176142.1 Ų142.182%0.82283%0.831SS**PPolyproline II helixtrans-46.2116.6171-172.4179.5132.500110.8E209E209-E211 PolarHBondContact O-N 2.83Å; E209-E211 VanDerWaalsContact O-N 3.13Å
212A51.5Low48.3Very low85 Ų85140 Ų14070%0.70283%0.829SS**PPolyproline II helixtrans-76.1131176.100000110.5V210 K214V210-A212 PolarHBondContact O-N 3.29Å; A212-K214 PolarHBondContact O-N 3.02Å
213P49.6Very low48.7Very low126 Ų126141.7 Ų141.782%0.81883%0.834SS**PPolyproline II helixtrans-71.8127177.827.6-32.4000111.4
214K50.5Low48.7Very low192 Ų192142.7 Ų142.784%0.83584%0.835SS**PPolyproline II helixtrans-59.8132.4176.5-169.8176.8-173.71770111.6A212 Q216A212-K214 PolarHBondContact O-N 3.02Å; K214-Q216 PolarHBondContact O-N 3.19Å
215P51.9Low49Very low122 Ų122146.6 Ų146.679%0.79284%0.838SS**PPolyproline II helixtrans-70.9121.7170.526.3-29.8000110.1
216Q49.4Very low49.6Very low195 Ų195150.9 Ų150.991%0.91184%0.84SS**PPolyproline II helixtrans-75.3119.5167.7-80.9179.5-19.700109.2K214K214-Q216 PolarHBondContact O-N 3.19Å
217E54.5Low50.2Low192 Ų192150.5 Ų150.590%0.89785%0.847SS**PPolyproline II helixtrans-75.3122.4168.4-171.1175.1118.400108.9
218A61Low50.4Low89 Ų89149.5 Ų149.574%0.73685%0.848SS**PPolyproline II helixtrans-88.8133.8174.600000109.9
219P58.1Low51.2Low126 Ų126149.3 Ų149.382%0.81886%0.858SS**PPolyproline II helixtrans-78.6135.1172.830.3-31.4000111
220A46.3Very low51.6Low99 Ų99146 Ų14682%0.81886%0.856SS**PPolyproline II helixtrans-65.8138.8173.300000112.1
221V47.8Very low51.8Low218 Ų218147.3 Ų147.3100%1.32186%0.861SS**  trans-138.80152.9178.80000107.8

Retrieved 221 of 221 residues in 232.3 ms (Link to these results)