A0A077ZH89_TRITR Loading...

Nascent polypeptide associated complex protein

AlphaFold DB , UniProt , Accession A0A077ZH89, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 225 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
1M46.4Very low51.5Low238 Ų238161.3 Ų161.3100%1.17284%0.844SS**  085.20-87.6-82.7-174.600108.1
2T45.4Very low51.7Low133 Ų133161.1 Ų161.182%0.81683%0.831SS**  trans-155.9113.5169.940.90000109.4
3L42.9Very low52.2Low162 Ų162162.6 Ų162.685%0.84883%0.832SS**  trans41108147.2-85.959.5000117.6
4L43.8Very low52.5Low163 Ų163160.2 Ų160.285%0.85382%0.822SS**  35.8110.568.5-93.280.1000114
5E53.6Low51.8Low147 Ų147154.3 Ų154.369%0.68782%0.817SS**  179.9124.8114.8-92.7-170.4134.900113.9
6K54.2Low51.4Low163 Ų163153.9 Ų153.971%0.70982%0.815SS**  trans61.3105133.9-61.5169178.1164.80120.2
7T54.2Low51.6Low138 Ų138153.9 Ų153.985%0.84782%0.815SS**  trans-115.896155.155.20000109.3
8D55.9Low51.3Low154 Ų154150.8 Ų150.882%0.82480%0.803SS**  trans-112.2102.8165.9-88.7-64.5000107.6
9S59.7Low50.7Low118 Ų118146.8 Ų146.883%0.82580%0.802SS**  trans-117.795.4170.9-67.20000108.1L11S9-L11 PolarHBondContact O-N 3.43Å
10K56.3Low50.6Low199 Ų199149.5 Ų149.587%0.86581%0.806SS**  trans-8795.1178.4-171.9166.1-177.8172.50108.4K12K10-K12 PolarHBondContact O-N 3.21Å
11L53.7Low50.2Low159 Ų159150 Ų15083%0.83281%0.808SS**  trans-73.4114.3168.5-80.1158.3000108.6S9S9-L11 PolarHBondContact O-N 3.43Å
12K54.9Low51Low159 Ų159144.1 Ų144.169%0.69179%0.787SS**  trans-116.8100.6170.3-179.7177.1175.1170.40105.2K10 D14K10-K12 PolarHBondContact O-N 3.21Å; K12-D14 WeakPolarHBondContact CE-OD1 3.32Å
13E58.2Low50.9Low181 Ų181145.6 Ų145.685%0.84679%0.79SS**  trans-98.7110.2167-72.9-170.4160.600107.2
14D56.1Low51.4Low129 Ų129146.4 Ų146.469%0.6979%0.789SS**  trans-69.3141.9177.6-68.2-56.6000110.2K12K12-D14 WeakPolarHBondContact CE-OD1 3.32Å
15G42.1Very low51.2Low72 Ų72148 Ų14874%0.74279%0.79SS**  trans-81174.4179.500000114.7
16D45.1Very low50.4Low148 Ų148144.4 Ų144.479%0.79179%0.792SS**  trans71.498.5153.7-15539.1000117.3
17N54.2Low50Low154 Ų154144 Ų14482%0.82480%0.797SS**  trans-118.2106.5152.5-166.513.4000109.6
18T47.5Very low49.3Very low97 Ų97146.6 Ų146.660%0.59580%0.8SS**  trans-45.6142.7171.9480000114.9
19G39.2Very low48.6Very low76 Ų76142.7 Ų142.778%0.78480%0.796SS**  trans-63.6153.6168.200000113.7
20K49.2Very low47.7Very low200 Ų200144.3 Ų144.387%0.8780%0.795SS**  trans-158.699.5163-148.6173.7-171.4175.70109.1P22K20-P22 WeakPolarHBondContact O-CD 3.43Å
21D42.7Very low47.2Very low161 Ų161140.5 Ų140.586%0.86179%0.794SS**  trans-75.5133.4159.2-64.6-59.8000108.9
22P63Low46.7Very low113 Ų113136.3 Ų136.373%0.73478%0.782SS**  trans-125.2114.9148.830.7-15.9000109.9K20 H24K20-P22 WeakPolarHBondContact O-CD 3.43Å; P22-H24 PolarHBondContact O-N 2.94Å
23D42Very low46.3Very low165 Ų165135.6 Ų135.688%0.88279%0.786SS**  trans-51.2113.3158.2-64.5-69.3000110.3
24H53.8Low46Very low178 Ų178134.2 Ų134.282%0.82479%0.785SS**  trans-111.996.4159-154-33.2000109.5P22P22-H24 PolarHBondContact O-N 2.94Å
25K39.1Very low45.7Very low198 Ų198135.8 Ų135.886%0.86179%0.788SS**  trans-64.2137.5158-89.5-180172.7176.90110
26G36.4Very low46Very low71 Ų71137.3 Ų137.373%0.73279%0.787SS**  trans112.2101.4151.800000115.1
27N46.5Very low46.3Very low154 Ų154137.4 Ų137.482%0.82479%0.787SS**  -165.1118.9114.4-168.540.8000109.1G29N27-G29 PolarHBondContact O-N 3.32Å
28E39.3Very low46.1Very low192 Ų192137.8 Ų137.890%0.89778%0.784SS**  trans-70.6110.4170-67.4169.2154.500107.7
29G42.8Very low46.5Very low72 Ų72140.4 Ų140.474%0.74279%0.794SS**  trans-121.886.4174.100000108.7N27 S31N27-G29 PolarHBondContact O-N 3.32Å; G29-S31 PolarHBondContact O-N 2.95Å
30D39.9Very low47Very low152 Ų152141.6 Ų141.681%0.81379%0.791SS**  trans-66.5112.5170.7-175.620.9000109.9
31S45.5Very low47Very low119 Ų119139.4 Ų139.483%0.83278%0.784SS**  trans-157.9108.3153.7-83.30000108.5G29G29-S31 PolarHBondContact O-N 2.95Å
32A43.1Very low47.1Very low72 Ų72136.7 Ų136.760%0.59578%0.777SS**  trans-65.6166.3173.100000112.9
33D45.8Very low46.3Very low144 Ų144138.6 Ų138.677%0.7778%0.776SS**  trans77.586.4154.2-54.9-38.5000118
34D52.3Low46.3Very low152 Ų152134.3 Ų134.381%0.81376%0.759SS**  trans-143.5100.3130.3-163.623.4000109.8S36D34-S36 VanDerWaalsContact C-N 3.3Å; D34-S36 PolarHBondContact O-N 2.99Å
35E49.8Very low45.9Very low161 Ų161134.6 Ų134.675%0.75276%0.761SS**  trans-63.878.2174.5-69.6-86.6178.900110.1D37E35-D37 PolarHBondContact O-N 2.89Å
36S49.2Very low46.1Very low105 Ų105127.1 Ų127.173%0.73474%0.74SS**  trans-85.889.7167.172.90000109.4D34 H38D34-S36 VanDerWaalsContact C-N 3.3Å; D34-S36 PolarHBondContact O-N 2.99Å; S36-H38 PolarHBondContact O-N 2.88Å
37D50.6Low46.7Very low149 Ų149133 Ų13380%0.79775%0.749SS**  trans-11.492.8165.8-76.8-47.6000114.2E35 D39E35-D37 PolarHBondContact O-N 2.89Å; D37-D39 PolarHBondContact O-N 2.66Å
38H51.5Low47.2Very low162 Ų162133.9 Ų133.975%0.7575%0.748SS**  trans-75.483.9161.5-16416.3000106.8S36 S40S36-H38 PolarHBondContact O-N 2.88Å; H38-S40 VanDerWaalsContact C-N 3.29Å; H38-S40 PolarHBondContact O-N 3.05Å; H38-S40 PolarHBondContact O-OG 2.82Å
39D55.9Low48.1Very low152 Ų152133.1 Ų133.181%0.81374%0.744SS**  trans-53.698.8174.3-124.1-25000107.7D37 Q41D37-D39 PolarHBondContact O-N 2.66Å; D39-Q41 PolarHBondContact O-N 3.19Å
40S48.4Very low49.1Very low101 Ų101134.3 Ų134.371%0.70674%0.737SS**  trans-60.4131.3-167.9-70.10000108.3H38 S42H38-S40 VanDerWaalsContact C-N 3.29Å; H38-S40 PolarHBondContact O-N 3.05Å; H38-S40 PolarHBondContact O-OG 2.82Å; S40-S42 PolarHBondContact O-N 3.15Å
41Q48.8Very low50.7Low155 Ų155131 Ų13172%0.72472%0.723SS**  trans-54.494.1167.8-64.5-177.6-95.100107.5D39 E43D39-Q41 PolarHBondContact O-N 3.19Å; Q41-E43 VanDerWaalsContact CB-OE1 3.28Å; Q41-E43 WeakPolarHBondContact CB-OE1 3.48Å; Q41-E43 PolarHBondContact O-N 3.22Å
42S44.8Very low51.8Low104 Ų104133 Ų13373%0.72772%0.719SS**  trans-72.382.7163.8179.90000105.9S40 S44S40-S42 PolarHBondContact O-N 3.15Å; S42-S44 PolarHBondContact O-N 3.27Å
43E47.2Very low53.1Low152 Ų152136.5 Ų136.571%0.7172%0.722SS**  trans-61.164.3152.936.5-132.194.600109.6Q41 E45Q41-E43 VanDerWaalsContact CB-OE1 3.28Å; Q41-E43 WeakPolarHBondContact CB-OE1 3.48Å; Q41-E43 PolarHBondContact O-N 3.22Å; E43-E45 VanDerWaalsContact C-N 3.28Å; E43-E45 PolarHBondContact O-N 3.34Å; E43-E45 VanDerWaalsContact O-N 3.15Å
44S42.7Very low54Low76 Ų76135.1 Ų135.153%0.53171%0.712SS.*  trans-80.189.2158.9-171.90000106.9S42 G46S42-S44 PolarHBondContact O-N 3.27Å; S44-G46 PolarHBondContact O-N 2.72Å
45E45.3Very low54.7Low184 Ų184134.2 Ų134.286%0.8670%0.7SS**  trans-6660.9157.5-59.1-160.6135.100109.3E43E43-E45 VanDerWaalsContact C-N 3.28Å; E43-E45 PolarHBondContact O-N 3.34Å; E43-E45 VanDerWaalsContact O-N 3.15Å
46G42Very low55.8Low41 Ų41133 Ų13342%0.42369%0.694SS.*  trans-95.397166.700000107.4S44 Q48S44-G46 PolarHBondContact O-N 2.72Å; G46-Q48 PolarHBondContact O-N 2.75Å
47E49Very low56.8Low194 Ų194132.7 Ų132.791%0.90769%0.688SS**  trans-59.175.6158.8-62.9179.112500108.2Q49E47-Q49 PolarHBondContact O-N 3.32Å
48Q56.4Low57.2Low172 Ų172126.8 Ų126.880%0.80466%0.66SS**  trans-74.177.5172.2-71.8-176.78.600107G46 V50G46-Q48 PolarHBondContact O-N 2.75Å; Q48-V50 PolarHBondContact O-N 2.91Å; Q48-V50 VanDerWaalsContact O-N 3.09Å
49Q58.8Low57.7Low176 Ų176121.8 Ų121.882%0.82265%0.647SS**  trans-55.6113.5161.6-168.9174.149.100106.2E47 T51E47-Q49 PolarHBondContact O-N 3.32Å; Q49-T51 PolarHBondContact O-N 3.19Å
50V63.4Low58Low98 Ų98119 Ų11959%0.59464%0.644SS**  trans-52.7110.7178.7177.90000107.6Q48 Q54Q48-V50 PolarHBondContact O-N 2.91Å; Q48-V50 VanDerWaalsContact O-N 3.09Å; V50-Q54 HydrophobicContact CG1-CB 3.94Å
51T73.3Confident58.8Low83 Ų83117.2 Ų117.251%0.50964%0.636SS.*  trans-67.4149.2-173.1-10.90000109Q49 Q53 Q54 K55Q49-T51 PolarHBondContact O-N 3.19Å; T51-Q53 PolarHBondContact O-N 3.35Å; T51-Q54 WeakPolarHBondContact O-CB 3.49Å; T51-Q54 PolarHBondContact O-N 3.1Å; T51-K55 PolarHBondContact O-N 3.23Å
52Q70.6Confident59Low161 Ų161113 Ų11375%0.75263%0.634SS**Hα-helixtrans-52.3-32.7175.7-78.8-169.7-3.700112.4K55 Q56Q52-K55 WeakPolarHBondContact O-CB 3.33Å; Q52-K55 PolarHBondContact O-N 3.4Å; Q52-Q56 PolarHBondContact O-N 3.49Å
53Q69.4Low59.4Low144 Ų144112 Ų11267%0.67362%0.621SS**Hα-helixtrans-59.6-46.3173.4-102171.3-2000112.9T51 K55 Q56 V57T51-Q53 PolarHBondContact O-N 3.35Å; Q53-K55 PolarHBondContact O-N 3.14Å; Q53-Q56 PolarHBondContact O-N 3.4Å; Q53-Q56 VanDerWaalsContact O-N 3.17Å; Q53-V57 WeakPolarHBondContact O-CG2 3.34Å; Q53-V57 PolarHBondContact O-N 2.97Å
54Q65.4Low59.7Low116 Ų116111.8 Ų111.854%0.54262%0.619SS.*Hα-helixtrans-63.7-34.3177.2-121.8168.9-300111.5V50 T51 A58V50-Q54 HydrophobicContact CG1-CB 3.94Å; T51-Q54 WeakPolarHBondContact O-CB 3.49Å; T51-Q54 PolarHBondContact O-N 3.1Å; Q54-A58 VanDerWaalsContact O-CB 3.29Å; Q54-A58 WeakPolarHBondContact O-CB 3.26Å; Q54-A58 PolarHBondContact O-N 3.38Å
55K67.1Low60.3Low133 Ų133114.6 Ų114.658%0.57862%0.624SS**Hα-helixtrans-66.8-40.2174.7-146.6177.7-175.3-176.40111.9T51 Q52 Q53 A59 V67T51-K55 PolarHBondContact O-N 3.23Å; Q52-K55 WeakPolarHBondContact O-CB 3.33Å; Q52-K55 PolarHBondContact O-N 3.4Å; Q53-K55 PolarHBondContact O-N 3.14Å; K55-A59 WeakPolarHBondContact O-CB 3.43Å; K55-A59 PolarHBondContact O-N 3.47Å; K55-V67 HydrophobicContact CG-CG1 4.47Å
56Q71.9Confident60.5Low134 Ų134112.5 Ų112.563%0.62661%0.614SS**Hα-helixtrans-68.3-41.5174.8-80.4178.8-13.300112.6Q52 Q53 A59 A60Q52-Q56 PolarHBondContact O-N 3.49Å; Q53-Q56 PolarHBondContact O-N 3.4Å; Q53-Q56 VanDerWaalsContact O-N 3.17Å; Q56-A59 PolarHBondContact O-N 2.77Å; Q56-A60 WeakPolarHBondContact O-CB 3.37Å; Q56-A60 PolarHBondContact O-N 3.27Å
57V69.8Low60.9Low100 Ų100113 Ų11361%0.60661%0.609SS**Hα-helixtrans-66.2-39.5176.7-179.50000110.8Q53 A60 A61Q53-V57 WeakPolarHBondContact O-CG2 3.34Å; Q53-V57 PolarHBondContact O-N 2.97Å; V57-A60 PolarHBondContact O-N 2.95Å; V57-A61 WeakPolarHBondContact O-CB 3.34Å; V57-A61 PolarHBondContact O-N 2.76Å
58A59.3Low61.1Low25 Ų25106.5 Ų106.521%0.20759%0.589CS.*Hα-helixtrans-65.7-38.9175.400000112.7Q54 A61 L63 V67Q54-A58 VanDerWaalsContact O-CB 3.29Å; Q54-A58 WeakPolarHBondContact O-CB 3.26Å; Q54-A58 PolarHBondContact O-N 3.38Å; A58-A61 PolarHBondContact O-N 2.7Å; A58-L63 PolarHBondContact O-N 2.8Å; A58-L63 VanDerWaalsContact O-N 3.1Å; A58-V67 HydrophobicContact CB-CG2 3.74Å
59A61.6Low60.9Low57 Ų57103.7 Ų103.747%0.47157%0.574SS.*Hα-helixtrans-65.3-43.9173.700000111.8K55 Q56 A61 G62K55-A59 WeakPolarHBondContact O-CB 3.43Å; K55-A59 PolarHBondContact O-N 3.47Å; Q56-A59 PolarHBondContact O-N 2.77Å; A59-A61 VanDerWaalsContact C-N 3.3Å; A59-A61 PolarHBondContact O-N 2.63Å; A59-G62 PolarHBondContact O-N 3.16Å
60A63.8Low60.6Low92 Ų9298.4 Ų98.476%0.7656%0.561SS**Hα-helixtrans-66.4-30.1178.200000113.1Q56 V57 G62Q56-A60 WeakPolarHBondContact O-CB 3.37Å; Q56-A60 PolarHBondContact O-N 3.27Å; V57-A60 PolarHBondContact O-N 2.95Å; A60-G62 VanDerWaalsContact C-N 3.25Å; A60-G62 PolarHBondContact O-N 3.42Å
61A64Low60.4Low65 Ų6597.3 Ų97.354%0.53757%0.569SS.*THydrogen-bonded Turntrans-82.35.4177.400000114V57 A58 A59 L63V57-A61 WeakPolarHBondContact O-CB 3.34Å; V57-A61 PolarHBondContact O-N 2.76Å; A58-A61 PolarHBondContact O-N 2.7Å; A59-A61 VanDerWaalsContact C-N 3.3Å; A59-A61 PolarHBondContact O-N 2.63Å; A61-L63 PolarHBondContact O-N 2.84Å; A61-L63 VanDerWaalsContact O-N 3.14Å
62G53.9Low60.3Low66 Ų6699.5 Ų99.568%0.6857%0.571SS**THydrogen-bonded Turntrans64.415.7-177.400000113.7A59 A60 E64A59-G62 PolarHBondContact O-N 3.16Å; A60-G62 VanDerWaalsContact C-N 3.25Å; A60-G62 PolarHBondContact O-N 3.42Å; G62-E64 VanDerWaalsContact C-N 3.25Å; G62-E64 PolarHBondContact O-N 2.79Å
63L53.1Low60.9Low84 Ų8494.9 Ų94.944%0.4455%0.549SS..  trans-93.131.8-178.3-110.284.2000111.8A58 A61 E65 Q66A58-L63 PolarHBondContact O-N 2.8Å; A58-L63 VanDerWaalsContact O-N 3.1Å; A61-L63 PolarHBondContact O-N 2.84Å; A61-L63 VanDerWaalsContact O-N 3.14Å; L63-E65 PolarHBondContact O-N 3.36Å; L63-Q66 HydrophobicContact CD2-CB 4.45Å; L63-Q66 PolarHBondContact O-N 3.38Å
64E53.6Low61.8Low146 Ų14690.8 Ų90.868%0.68254%0.537SS*.Hα-helixtrans-59.9-30.1-179.1-130.8-179.317500112G62 Q66 V67 A68G62-E64 VanDerWaalsContact C-N 3.25Å; G62-E64 PolarHBondContact O-N 2.79Å; E64-Q66 PolarHBondContact O-N 3.28Å; E64-V67 PolarHBondContact O-N 3.3Å; E64-A68 PolarHBondContact O-N 2.89Å
65E54.2Low62.9Low136 Ų13693.9 Ų93.964%0.63654%0.544SS*.Hα-helixtrans-63.9-28.5177-158.1-169.6132.400112.8L63 K69L63-E65 PolarHBondContact O-N 3.36Å; E65-K69 PolarHBondContact O-N 3.09Å; E65-K69 IonicContact OE1-NZ 2.74Å; E65-K69 PolarHBondContact OE1-NZ 3.08Å
66Q50.1Low64Low140 Ų14091.6 Ų91.665%0.65454%0.544SS*.Hα-helixtrans-74.5-33.3176.5-108.2-171.119.900112.3L63 E64 K69 A70L63-Q66 HydrophobicContact CD2-CB 4.45Å; L63-Q66 PolarHBondContact O-N 3.38Å; E64-Q66 PolarHBondContact O-N 3.28Å; Q66-K69 PolarHBondContact O-N 2.83Å; Q66-A70 PolarHBondContact O-N 2.91Å
67V50.6Low64.8Low50 Ų5086.9 Ų86.930%0.30352%0.522SS..Hα-helixtrans-76.4-38.1-178.1-168.60000111.1K55 A58 E64 K69 A70 G71K55-V67 HydrophobicContact CG-CG1 4.47Å; A58-V67 HydrophobicContact CB-CG2 3.74Å; E64-V67 PolarHBondContact O-N 3.3Å; V67-K69 PolarHBondContact O-N 2.98Å; V67-A70 WeakPolarHBondContact O-CB 3.34Å; V67-A70 PolarHBondContact O-N 2.84Å; V67-A70 VanDerWaalsContact O-N 3.09Å; V67-G71 PolarHBondContact O-N 2.8Å
68A52.8Low65.8Low59 Ų5989.1 Ų89.149%0.48852%0.524SS..Hα-helixtrans-65.5-28.9175.300000112.7E64 K72E64-A68 PolarHBondContact O-N 2.89Å; A68-K72 WeakPolarHBondContact O-CD 3.44Å; A68-K72 WeakPolarHBondContact O-CE 3.25Å
69K52.8Low67.4Low112 Ų11294.3 Ų94.349%0.48754%0.542SS..Hα-helixtrans-78.6-29.6170.8-76.7173.1175.1162.80112.5E65 Q66 V67 G71 K72 Q73E65-K69 PolarHBondContact O-N 3.09Å; E65-K69 IonicContact OE1-NZ 2.74Å; E65-K69 PolarHBondContact OE1-NZ 3.08Å; Q66-K69 PolarHBondContact O-N 2.83Å; V67-K69 PolarHBondContact O-N 2.98Å; K69-G71 VanDerWaalsContact C-N 3.27Å; K69-G71 PolarHBondContact O-N 3.35Å; K69-K72 WeakPolarHBondContact O-CB 3.42Å; K69-K72 PolarHBondContact O-N 3Å; K69-Q73 PolarHBondContact O-N 2.9Å; K69-Q73 VanDerWaalsContact O-N 3.12Å
70A52.8Low68.9Low66 Ų6693.1 Ų93.155%0.54553%0.532SS..Hα-helixtrans-62-34.117500000112.5Q66 V67 K72Q66-A70 PolarHBondContact O-N 2.91Å; V67-A70 WeakPolarHBondContact O-CB 3.34Å; V67-A70 PolarHBondContact O-N 2.84Å; V67-A70 VanDerWaalsContact O-N 3.09Å; A70-K72 PolarHBondContact O-N 2.89Å
71G58.1Low70Confident74 Ų7491 Ų9176%0.76350%0.504SS*.THydrogen-bonded Turntrans-66.7-18.8172.600000114.5V67 K69V67-G71 PolarHBondContact O-N 2.8Å; K69-G71 VanDerWaalsContact C-N 3.27Å; K69-G71 PolarHBondContact O-N 3.35Å
72K71.4Confident71.3Confident130 Ų13094.6 Ų94.657%0.56551%0.507SS*.THydrogen-bonded Turntrans-99.6-21.9-175.3-61.1168.2-174.41780112.8A68 K69 A70A68-K72 WeakPolarHBondContact O-CD 3.44Å; A68-K72 WeakPolarHBondContact O-CE 3.25Å; K69-K72 WeakPolarHBondContact O-CB 3.42Å; K69-K72 PolarHBondContact O-N 3Å; A70-K72 PolarHBondContact O-N 2.89Å
73Q83.1Confident73.1Confident63 Ų6396.8 Ų96.829%0.29450%0.503SS..  trans-106.7114.1-172.6-171175.523.500112K69 E77 K78K69-Q73 PolarHBondContact O-N 2.9Å; K69-Q73 VanDerWaalsContact O-N 3.12Å; Q73-E77 HydrophobicContact CG-CB 4.05Å; Q73-E77 HydrophobicContact CG-CG 4.14Å; Q73-K78 HydrophobicContact CG-CB 4.38Å; Q73-K78 VanDerWaalsContact NE2-CA 3.31Å
74S88.4Confident74.8Confident58 Ų5896 Ų9641%0.40650%0.496SS..  trans-71.6160.8175.267.80000113.1S76 E77 K78S74-S76 VanDerWaalsContact C-N 3.31Å; S74-S76 PolarHBondContact O-N 3.17Å; S74-S76 PolarHBondContact OG-OG 3.34Å; S74-S76 VanDerWaalsContact OG-OG 3.09Å; S74-E77 WeakPolarHBondContact O-CB 3.35Å; S74-E77 PolarHBondContact O-N 2.94Å; S74-E77 VanDerWaalsContact OG-CB 3.29Å; S74-E77 WeakPolarHBondContact OG-CB 3.32Å; S74-E77 PolarHBondContact OG-N 3.23Å; S74-K78 PolarHBondContact O-N 3.2Å
75R89Confident76.2Confident182 Ų18292.4 Ų92.469%0.68749%0.488SS*.Hα-helixtrans-59.6-39.2177.2-172.7-179.3-176.5-1702.4112.1K78 K79R75-K78 PolarHBondContact O-N 3.21Å; R75-K79 WeakPolarHBondContact O-CG 3.36Å; R75-K79 PolarHBondContact O-N 2.91Å
76S89.5Confident77.7Confident85 Ų8593.1 Ų93.159%0.59449%0.489SS*.Hα-helixtrans-65.5-42.4176.648.10000111.3S74 K78 K79 A80S74-S76 VanDerWaalsContact C-N 3.31Å; S74-S76 PolarHBondContact O-N 3.17Å; S74-S76 PolarHBondContact OG-OG 3.34Å; S74-S76 VanDerWaalsContact OG-OG 3.09Å; S76-K78 PolarHBondContact O-N 3.17Å; S76-K79 PolarHBondContact O-N 3.06Å; S76-A80 PolarHBondContact O-N 3.44Å
77E89.3Confident79.4Confident34 Ų3488.7 Ų88.716%0.15947%0.473CS..Hα-helixtrans-64.3-40.9176.6-167.1-168.7143.200112.2Q73 S74 K79 A80 R81 F127Q73-E77 HydrophobicContact CG-CB 4.05Å; Q73-E77 HydrophobicContact CG-CG 4.14Å; S74-E77 WeakPolarHBondContact O-CB 3.35Å; S74-E77 PolarHBondContact O-N 2.94Å; S74-E77 VanDerWaalsContact OG-CB 3.29Å; S74-E77 WeakPolarHBondContact OG-CB 3.32Å; S74-E77 PolarHBondContact OG-N 3.23Å; E77-K79 VanDerWaalsContact C-N 3.3Å; E77-K79 PolarHBondContact O-N 2.7Å; E77-A80 PolarHBondContact O-N 3.28Å; E77-R81 WeakPolarHBondContact O-CB 3.39Å; E77-R81 PolarHBondContact O-N 3.04Å; E77-R81 IonicContact OE1-CZ 3.8Å; E77-R81 IonicContact OE1-NH2 2.63Å; E77-R81 PolarHBondContact OE1-NH2 2.99Å; E77-F127 HydrophobicContact CG-CD1 3.59Å; E77-F127 HydrophobicContact CG-CE1 4.05Å
78K91.1Very high81.1Confident147 Ų14793.6 Ų93.664%0.63950%0.498SS*.Hα-helixtrans-60.7-39.8176-167.3173.8-177.5175.20112.3Q73 S74 R75 S76 K82Q73-K78 HydrophobicContact CG-CB 4.38Å; Q73-K78 VanDerWaalsContact NE2-CA 3.31Å; S74-K78 PolarHBondContact O-N 3.2Å; R75-K78 PolarHBondContact O-N 3.21Å; S76-K78 PolarHBondContact O-N 3.17Å; K78-K82 PolarHBondContact O-N 3.21Å; K78-K82 VanDerWaalsContact O-N 3.16Å
79K92.6Very high82.9Confident135 Ų13592.4 Ų92.459%0.58748%0.483SS*.Hα-helixtrans-65-47.7173.8-70.3-179.9179.6-174.10111.5R75 S76 E77 K82 L83R75-K79 WeakPolarHBondContact O-CG 3.36Å; R75-K79 PolarHBondContact O-N 2.91Å; S76-K79 PolarHBondContact O-N 3.06Å; E77-K79 VanDerWaalsContact C-N 3.3Å; E77-K79 PolarHBondContact O-N 2.7Å; K79-K82 PolarHBondContact O-N 3.09Å; K79-L83 PolarHBondContact O-N 2.92Å; K79-L83 VanDerWaalsContact O-N 3.08Å
80A92.2Very high84.7Confident31 Ų3194 Ų9426%0.25649%0.49SS..Hα-helixtrans-61.7-45.317900000112.1S76 E77 K82 L83 F84 F127S76-A80 PolarHBondContact O-N 3.44Å; E77-A80 PolarHBondContact O-N 3.28Å; A80-K82 VanDerWaalsContact C-N 3.32Å; A80-K82 PolarHBondContact O-N 3.49Å; A80-L83 WeakPolarHBondContact O-CB 3.08Å; A80-L83 PolarHBondContact O-N 3.42Å; A80-L83 VanDerWaalsContact O-N 3.09Å; A80-F84 HydrophobicContact CB-CD2 4.26Å; A80-F84 HydrophobicContact CB-CE2 4.21Å; A80-F84 WeakPolarHBondContact O-CD2 3.48Å; A80-F84 PolarHBondContact O-N 2.82Å; A80-F127 HydrophobicContact CB-CE1 3.96Å; A80-F127 HydrophobicContact CB-CZ 4.33Å
81R88.6Confident86.6Confident48 Ų4895.4 Ų95.418%0.18149%0.485CS..Hα-helixtrans-58.1-44.5176.3-166.4-178.6-60.4-77.93.3111.3E77 L83 F84 S85 D114 F127E77-R81 WeakPolarHBondContact O-CB 3.39Å; E77-R81 PolarHBondContact O-N 3.04Å; E77-R81 IonicContact OE1-CZ 3.8Å; E77-R81 IonicContact OE1-NH2 2.63Å; E77-R81 PolarHBondContact OE1-NH2 2.99Å; R81-L83 VanDerWaalsContact C-N 3.3Å; R81-L83 PolarHBondContact O-N 2.72Å; R81-F84 PolarHBondContact O-N 2.92Å; R81-S85 VanDerWaalsContact O-CB 3.32Å; R81-S85 WeakPolarHBondContact O-CB 3.38Å; R81-S85 PolarHBondContact O-N 3.25Å; R81-S85 PolarHBondContact O-OG 2.82Å; R81-D114 IonicContact CZ-OD2 3.89Å; R81-D114 VanDerWaalsContact NH1-CG 3.35Å; R81-D114 IonicContact NH1-OD2 2.84Å; R81-D114 PolarHBondContact NH1-OD2 3.27Å; R81-F127 HydrophobicContact CB-CE1 4.34Å; R81-F127 HydrophobicContact CB-CZ 4.06Å; R81-F127 HydrophobicContact CG-CE2 4.48Å
82K90.1Very high88.2Confident140 Ų14094.2 Ų94.261%0.60946%0.463SS*.Hα-helixtrans-61.6-36.7176.1-169.9176.3-1761800112.7K78 K79 A80 K86K78-K82 PolarHBondContact O-N 3.21Å; K78-K82 VanDerWaalsContact O-N 3.16Å; K79-K82 PolarHBondContact O-N 3.09Å; A80-K82 VanDerWaalsContact C-N 3.32Å; A80-K82 PolarHBondContact O-N 3.49Å; K82-K86 WeakPolarHBondContact O-CG 3.28Å
83L91.7Very high89.2Confident113 Ų11395.8 Ų95.859%0.59247%0.472SS*.Hα-helixtrans-69.1-46.8176.5-176.563.3000111.2K79 A80 R81 K86 S87K79-L83 PolarHBondContact O-N 2.92Å; K79-L83 VanDerWaalsContact O-N 3.08Å; A80-L83 WeakPolarHBondContact O-CB 3.08Å; A80-L83 PolarHBondContact O-N 3.42Å; A80-L83 VanDerWaalsContact O-N 3.09Å; R81-L83 VanDerWaalsContact C-N 3.3Å; R81-L83 PolarHBondContact O-N 2.72Å; L83-K86 WeakPolarHBondContact O-CB 3.49Å; L83-K86 PolarHBondContact O-N 3.4Å; L83-K86 VanDerWaalsContact O-N 3.15Å; L83-S87 PolarHBondContact O-N 2.97Å
84F88Confident89.8Confident66 Ų6696.5 Ų96.529%0.28950%0.496SS..Hα-helixtrans-78.8-21.2-175.8-68-56000114.6A80 R81 S87 L89 I125 F127A80-F84 HydrophobicContact CB-CD2 4.26Å; A80-F84 HydrophobicContact CB-CE2 4.21Å; A80-F84 WeakPolarHBondContact O-CD2 3.48Å; A80-F84 PolarHBondContact O-N 2.82Å; R81-F84 PolarHBondContact O-N 2.92Å; F84-S87 WeakPolarHBondContact CA-OG 3.45Å; F84-S87 PolarHBondContact O-OG 2.67Å; F84-L89 HydrophobicContact CB-CD1 3.93Å; F84-L89 HydrophobicContact CD1-CD1 3.65Å; F84-L89 HydrophobicContact CG-CD1 4.15Å; F84-I125 HydrophobicContact CB-CD1 4.1Å; F84-I125 HydrophobicContact CD1-CD1 3.21Å; F84-I125 HydrophobicContact CD2-CD1 3.77Å; F84-I125 HydrophobicContact CD2-CG2 4.25Å; F84-I125 HydrophobicContact CE1-CD1 3.39Å; F84-I125 HydrophobicContact CE2-CD1 3.93Å; F84-I125 HydrophobicContact CE2-CG2 4.46Å; F84-I125 HydrophobicContact CG-CD1 3.41Å; F84-I125 VanDerWaalsContact CG-CD1 3.41Å; F84-I125 HydrophobicContact CZ-CD1 3.74Å; F84-F127 AromaticContact CD2-CZ 3.88Å; F84-F127 HydrophobicContact CD2-CZ 3.88Å
85S84.6Confident90.1Very high72 Ų7296 Ų9650%0.50349%0.489SS..THydrogen-bonded Turntrans-72.5-19.2166.8-59.70000112.6R81R81-S85 VanDerWaalsContact O-CB 3.32Å; R81-S85 WeakPolarHBondContact O-CB 3.38Å; R81-S85 PolarHBondContact O-N 3.25Å; R81-S85 PolarHBondContact O-OG 2.82Å
86K85.6Confident90.4Very high151 Ų15192 Ų9266%0.65749%0.485SS*.THydrogen-bonded Turntrans-93.9-32.2177-72.1177.2178.5-173.50113K82 L83K82-K86 WeakPolarHBondContact O-CG 3.28Å; L83-K86 WeakPolarHBondContact O-CB 3.49Å; L83-K86 PolarHBondContact O-N 3.4Å; L83-K86 VanDerWaalsContact O-N 3.15Å
87S85.5Confident90.7Very high47 Ų4793.3 Ų93.333%0.32948%0.476SS..THydrogen-bonded Turntrans-66145.3166.159.80000107.8L83 F84 L89L83-S87 PolarHBondContact O-N 2.97Å; F84-S87 WeakPolarHBondContact CA-OG 3.45Å; F84-S87 PolarHBondContact O-OG 2.67Å; S87-L89 PolarHBondContact O-N 3.49Å; S87-L89 VanDerWaalsContact OG-CD1 3.26Å; S87-L89 WeakPolarHBondContact OG-CD1 3.4Å; S87-L89 WeakPolarHBondContact OG-CG 3.29Å
88N86Confident91Very high153 Ų15393.2 Ų93.282%0.81848%0.478SS*.THydrogen-bonded Turntrans-67.938.7-173.8-60.7-59.8000114.2P119N88-P119 WeakPolarHBondContact O-CD 3.4Å
89L89.7Confident91.2Very high34 Ų3489.1 Ų89.118%0.17847%0.467CS..PPolyproline II helixtrans-79.9141.5174.9-58.7177000109.5F84 S87 N118 I125F84-L89 HydrophobicContact CB-CD1 3.93Å; F84-L89 HydrophobicContact CD1-CD1 3.65Å; F84-L89 HydrophobicContact CG-CD1 4.15Å; S87-L89 PolarHBondContact O-N 3.49Å; S87-L89 VanDerWaalsContact OG-CD1 3.26Å; S87-L89 WeakPolarHBondContact OG-CD1 3.4Å; S87-L89 WeakPolarHBondContact OG-CG 3.29Å; L89-N118 HydrophobicContact CD2-CB 3.67Å; L89-I125 HydrophobicContact CD1-CD1 3.41Å; L89-I125 VanDerWaalsContact CD1-CD1 3.41Å; L89-I125 HydrophobicContact CD1-CG1 4.37Å
90K91.4Very high91.3Very high145 Ų14587.8 Ų87.863%0.6347%0.465SS*.EExtended strand (participates in β ladder)trans-95.9126.5178.1-70.1-177.2-179.1179.70109.5V92 Y116 K117 P119K90-V92 PolarHBondContact O-N 3.38Å; K90-Y116 CarbonylContact O-C 3.54Å; K90-Y116 WeakPolarHBondContact O-CA 3.38Å; K90-K117 PolarHBondContact N-O 2.79Å; K90-K117 PolarHBondContact O-N 3.44Å; K90-P119 HydrophobicContact CD-CG 3.87Å; K90-P119 HydrophobicContact CG-CG 3.86Å
91Q91.8Very high91.4Very high96 Ų9694.5 Ų94.545%0.44948%0.484SS..EExtended strand (participates in β ladder)trans-65.1129.6168.1-169.2-179.930.200109.3D114 Y116Q91-D114 WeakPolarHBondContact CG-OD1 3.37Å; Q91-D114 VanDerWaalsContact NE2-CG 3.31Å; Q91-D114 PolarHBondContact NE2-OD1 3.48Å; Q91-D114 PolarHBondContact NE2-OD2 3.21Å; Q91-Y116 HydrophobicContact CB-CD1 3.99Å; Q91-Y116 HydrophobicContact CB-CE1 3.8Å; Q91-Y116 HydrophobicContact CG-CD1 4.43Å; Q91-Y116 HydrophobicContact CG-CE1 4.03Å
92V92.7Very high91.6Very high49 Ų4999.9 Ų99.930%0.29751%0.509SS..EExtended strand (participates in β ladder)trans-99.9110.1175.5-1730000107.8K90 I95 V115 K117K90-V92 PolarHBondContact O-N 3.38Å; V92-I95 HydrophobicContact CB-CD1 3.77Å; V92-I95 HydrophobicContact CG1-CD1 3.47Å; V92-I95 VanDerWaalsContact CG1-CD1 3.47Å; V92-I95 HydrophobicContact CG1-CG1 4.13Å; V92-V115 HydrophobicContact CB-CB 4.49Å; V92-V115 PolarHBondContact N-O 2.87Å; V92-K117 HydrophobicContact CG2-CB 3.61Å
93Q93.2Very high91.9Very high163 Ų16395.6 Ų95.676%0.76250%0.497SS*.  trans-85.9163.9179.2-61-177.89.400111.3I95Q93-I95 VanDerWaalsContact C-N 3.32Å; Q93-I95 PolarHBondContact O-N 2.97Å
94G94.4Very high91.8Very high77 Ų7799 Ų9979%0.79451%0.506SS*.  trans81.44.8176.200000115.1T96G94-T96 PolarHBondContact O-N 3.28Å
95I94.8Very high91.9Very high49 Ų4997.2 Ų97.225%0.25150%0.503SS..  trans-83.1114.4176.7-63.4167.4000109.4V92 Q93 V98 P113 V115V92-I95 HydrophobicContact CB-CD1 3.77Å; V92-I95 HydrophobicContact CG1-CD1 3.47Å; V92-I95 VanDerWaalsContact CG1-CD1 3.47Å; V92-I95 HydrophobicContact CG1-CG1 4.13Å; Q93-I95 VanDerWaalsContact C-N 3.32Å; Q93-I95 PolarHBondContact O-N 2.97Å; I95-V98 HydrophobicContact CG2-CG2 3.7Å; I95-P113 HydrophobicContact CG2-CG 3.76Å; I95-V115 HydrophobicContact CB-CG2 4.26Å; I95-V115 HydrophobicContact CD1-CB 3.53Å; I95-V115 HydrophobicContact CD1-CG1 3.81Å; I95-V115 HydrophobicContact CD1-CG2 3.66Å; I95-V115 HydrophobicContact CG2-CG2 4.01Å
96T95.7Very high92.4Very high98 Ų9895.6 Ų95.660%0.60149%0.488SS*.  trans-96.1-26.2-178.653.80000112.8G94 N112G94-T96 PolarHBondContact O-N 3.28Å; T96-N112 WeakPolarHBondContact O-CA 3.48Å; T96-N112 PolarHBondContact O-N 3.22Å; T96-N112 PolarHBondContact O-OD1 3.09Å
97R94.9Very high92.9Very high112 Ų11290.2 Ų90.242%0.42347%0.466SS..EExtended strand (participates in β ladder)trans-154.7131.5-179-170.4175.9177.7-177.50.2110.5C99 V109 V110 E133R97-C99 PolarHBondContact NE-SG 3.15Å; R97-V109 HydrophobicContact CG-CG1 3.84Å; R97-V110 WeakPolarHBondContact CA-O 3.36Å; R97-E133 IonicContact CZ-OE2 2.7Å; R97-E133 IonicContact NH2-OE1 2.68Å; R97-E133 PolarHBondContact NH2-OE1 2.83Å; R97-E133 IonicContact NH2-OE2 3.42Å; R97-E133 PolarHBondContact NH2-OE2 2.85Å
98V95.9Very high93.4Very high31 Ų3191 Ų9119%0.18846%0.464CS..EExtended strand (participates in β ladder)trans-112.4128.7167.4171.30000108.1I95 V109 V110 P113 V115 V126I95-V98 HydrophobicContact CG2-CG2 3.7Å; V98-V109 WeakPolarHBondContact O-CA 3.28Å; V98-V110 HydrophobicContact CB-CB 4.48Å; V98-V110 PolarHBondContact N-O 3.37Å; V98-V110 PolarHBondContact O-N 3.35Å; V98-P113 HydrophobicContact CB-CG 4.07Å; V98-P113 HydrophobicContact CG2-CB 4.45Å; V98-P113 HydrophobicContact CG2-CG 3.55Å; V98-V115 HydrophobicContact CG2-CG2 4.05Å; V98-V126 HydrophobicContact CB-CG1 4.2Å; V98-V126 HydrophobicContact CG1-CG1 4.25Å; V98-V126 HydrophobicContact CG1-CG2 4.29Å; V98-V126 HydrophobicContact CG2-CG1 4.17Å; V98-V126 HydrophobicContact CG2-CG2 4.44Å
99C95.1Very high93.8Very high62 Ų6283.8 Ų83.842%0.41943%0.425SS..EExtended strand (participates in β ladder)trans-120.8124.8177.8-63.40000109.8R97 L107 F108R97-C99 PolarHBondContact NE-SG 3.15Å; C99-L107 HydrophobicContact CB-CD2 4.39Å; C99-F108 CarbonylContact C-O 3.53Å; C99-F108 WeakPolarHBondContact CA-O 3.29Å
100I94.8Very high94.1Very high106 Ų10682.6 Ų82.654%0.54442%0.419SS..EExtended strand (participates in β ladder)trans-105.5112171.8-55.1169.6000107.2F108I100-F108 HydrophobicContact CB-CB 4.23Å; I100-F108 PolarHBondContact N-O 2.78Å; I100-F108 PolarHBondContact O-N 3.31Å
101R94Very high94.3Very high172 Ų17279.9 Ų79.965%0.64941%0.412SS*.EExtended strand (participates in β ladder)trans-82.8120.2-179.1-170.9178.8-168.9172.69.7110.2S103 K104R101-S103 VanDerWaalsContact CG-O 3.23Å; R101-S103 WeakPolarHBondContact CG-O 3.49Å; R101-S103 PolarHBondContact NE-O 3.29Å; R101-S103 VanDerWaalsContact NE-O 3.09Å; R101-K104 PolarHBondContact NH2-O 3.36Å
102K94.5Very high94.4Very high161 Ų16181.5 Ų81.570%0.742%0.423SS*.  trans-96.3-38.3174.7179.8177.8169.1-176.70112.3I106 F108K102-I106 HydrophobicContact CB-CG2 4.36Å; K102-I106 PolarHBondContact N-O 3.12Å; K102-F108 HydrophobicContact CB-CD2 4.31Å; K102-F108 HydrophobicContact CB-CE2 3.87Å; K102-F108 HydrophobicContact CD-CE2 3.75Å; K102-F108 HydrophobicContact CD-CZ 4.24Å; K102-F108 HydrophobicContact CG-CE2 4.39Å
103S94.7Very high94.5Very high51 Ų5179.7 Ų79.736%0.35741%0.413SS..SBendtrans-145.1-173.1178.1750000111.3R101 S105 I106R101-S103 VanDerWaalsContact CG-O 3.23Å; R101-S103 WeakPolarHBondContact CG-O 3.49Å; R101-S103 PolarHBondContact NE-O 3.29Å; R101-S103 VanDerWaalsContact NE-O 3.09Å; S103-S105 PolarHBondContact O-N 3.09Å; S103-I106 PolarHBondContact N-O 2.98Å; S103-I106 WeakPolarHBondContact OG-CB 3.44Å; S103-I106 VanDerWaalsContact OG-CG1 3.28Å; S103-I106 WeakPolarHBondContact OG-CG1 3.4Å; S103-I106 PolarHBondContact OG-N 2.75Å; S103-I106 VanDerWaalsContact OG-N 3.13Å
104K90.6Very high94.5Very high183 Ų18373.7 Ų73.780%0.79639%0.385SS*.SBendtrans-57.4-39.1178.7-173173.7178.21780111.8R101R101-K104 PolarHBondContact NH2-O 3.36Å
105S90.9Very high94.5Very high30 Ų3070.1 Ų70.121%0.2135%0.349CS..SBendtrans-108.8-20-177.271.90000115S103 L107 D134 L135S103-S105 PolarHBondContact O-N 3.09Å; S105-L107 WeakPolarHBondContact O-CD1 3.48Å; S105-D134 WeakPolarHBondContact CB-OD1 3.34Å; S105-D134 CarbonylContact O-C 3.59Å; S105-D134 WeakPolarHBondContact O-CA 3.28Å; S105-D134 PolarHBondContact OG-OD1 2.82Å; S105-D134 VanDerWaalsContact OG-OD1 3.05Å; S105-L135 PolarHBondContact O-N 3.3Å
106I95Very high94.5Very high38 Ų3868.6 Ų68.620%0.19534%0.34CS..EExtended strand (participates in β ladder)trans-97.5122-174.2-53.4-65.8000111.6K102 S103 I132 D134K102-I106 HydrophobicContact CB-CG2 4.36Å; K102-I106 PolarHBondContact N-O 3.12Å; S103-I106 PolarHBondContact N-O 2.98Å; S103-I106 WeakPolarHBondContact OG-CB 3.44Å; S103-I106 VanDerWaalsContact OG-CG1 3.28Å; S103-I106 WeakPolarHBondContact OG-CG1 3.4Å; S103-I106 PolarHBondContact OG-N 2.75Å; S103-I106 VanDerWaalsContact OG-N 3.13Å; I106-I132 HydrophobicContact CG2-CG2 4.19Å; I106-D134 HydrophobicContact CD1-CB 3.64Å; I106-D134 WeakPolarHBondContact CD1-OD2 3.43Å
107L94.9Very high94.4Very high37 Ų3767.9 Ų67.919%0.19433%0.328CS..EExtended strand (participates in β ladder)trans-123.6136.8176.5-64.879.1000110.2C99 S105 V109 E133C99-L107 HydrophobicContact CB-CD2 4.39Å; S105-L107 WeakPolarHBondContact O-CD1 3.48Å; L107-V109 HydrophobicContact CB-CG2 3.87Å; L107-E133 HydrophobicContact CB-CB 4.43Å; L107-E133 PolarHBondContact N-O 3.42Å; L107-E133 PolarHBondContact O-N 3.11Å
108F95.5Very high94.3Very high64 Ų6464.8 Ų64.828%0.28132%0.32SS..EExtended strand (participates in β ladder)trans-94.6116.6162.8-63.1-92.1000108.4C99 I100 K102 K131 I132C99-F108 CarbonylContact C-O 3.53Å; C99-F108 WeakPolarHBondContact CA-O 3.29Å; I100-F108 HydrophobicContact CB-CB 4.23Å; I100-F108 PolarHBondContact N-O 2.78Å; I100-F108 PolarHBondContact O-N 3.31Å; K102-F108 HydrophobicContact CB-CD2 4.31Å; K102-F108 HydrophobicContact CB-CE2 3.87Å; K102-F108 HydrophobicContact CD-CE2 3.75Å; K102-F108 HydrophobicContact CD-CZ 4.24Å; K102-F108 HydrophobicContact CG-CE2 4.39Å; F108-K131 CarbonylContact C-O 3.53Å; F108-K131 WeakPolarHBondContact CA-O 3.34Å; F108-I132 HydrophobicContact CD1-CG1 3.86Å; F108-I132 HydrophobicContact CE1-CD1 3.99Å; F108-I132 HydrophobicContact CE1-CG1 3.68Å
109V95.6Very high94Very high1 Ų166.6 Ų66.61%0.00633%0.333CS..EExtended strand (participates in β ladder)trans-116.1124.6-170.2177.40000109.4R97 V98 L107 N111 K131 E133R97-V109 HydrophobicContact CG-CG1 3.84Å; V98-V109 WeakPolarHBondContact O-CA 3.28Å; L107-V109 HydrophobicContact CB-CG2 3.87Å; V109-N111 WeakPolarHBondContact CG1-OD1 3.48Å; V109-K131 PolarHBondContact N-O 2.91Å; V109-K131 PolarHBondContact O-N 3.49Å; V109-E133 HydrophobicContact CG2-CB 4Å; V109-E133 WeakPolarHBondContact CG2-OE2 3.46Å
110V95.6Very high93.9Very high9 Ų969 Ų696%0.05535%0.35CS..EExtended strand (participates in β ladder)trans-111.2115.2171.2-167.10000107.6R97 V98 P113 V126 A130R97-V110 WeakPolarHBondContact CA-O 3.36Å; V98-V110 HydrophobicContact CB-CB 4.48Å; V98-V110 PolarHBondContact N-O 3.37Å; V98-V110 PolarHBondContact O-N 3.35Å; V110-P113 HydrophobicContact CB-CB 4.25Å; V110-P113 HydrophobicContact CG1-CB 3.7Å; V110-P113 HydrophobicContact CG1-CG 4.41Å; V110-V126 HydrophobicContact CB-CG1 4.42Å; V110-V126 HydrophobicContact CG1-CG1 4.46Å; V110-V126 HydrophobicContact CG2-CG1 4.34Å; V110-A130 HydrophobicContact CG2-CB 4.15Å
111N94.9Very high93.8Very high89 Ų8966.2 Ų66.248%0.47634%0.34SS..EExtended strand (participates in β ladder)trans-90.4138.6178.5-68.3-30.3000110.4V109 P113V109-N111 WeakPolarHBondContact CG1-OD1 3.48Å; N111-P113 VanDerWaalsContact C-CD 3.49Å; N111-P113 VanDerWaalsContact C-N 3.34Å
112N94.1Very high93.7Very high130 Ų13066.5 Ų66.570%0.69535%0.349SS*.SBendtrans40.955.1-173.5-61.9-42.4000113T96T96-N112 WeakPolarHBondContact O-CA 3.48Å; T96-N112 PolarHBondContact O-N 3.22Å; T96-N112 PolarHBondContact O-OD1 3.09Å
113P94.8Very high93.6Very high11 Ų1162.6 Ų62.67%0.07134%0.338CS..  trans-71.1156.3179.828-29000111.5I95 V98 V110 N111 V115 V126 F127I95-P113 HydrophobicContact CG2-CG 3.76Å; V98-P113 HydrophobicContact CB-CG 4.07Å; V98-P113 HydrophobicContact CG2-CB 4.45Å; V98-P113 HydrophobicContact CG2-CG 3.55Å; V110-P113 HydrophobicContact CB-CB 4.25Å; V110-P113 HydrophobicContact CG1-CB 3.7Å; V110-P113 HydrophobicContact CG1-CG 4.41Å; N111-P113 VanDerWaalsContact C-CD 3.49Å; N111-P113 VanDerWaalsContact C-N 3.34Å; P113-V115 HydrophobicContact CB-CG2 4.02Å; P113-V115 HydrophobicContact CG-CG2 3.94Å; P113-V126 HydrophobicContact CB-CG1 3.66Å; P113-V126 HydrophobicContact CG-CG1 4.34Å; P113-F127 CarbonylContact C-O 3.54Å; P113-F127 VanDerWaalsContact CA-O 3.3Å; P113-F127 WeakPolarHBondContact CA-O 3.3Å; P113-F127 WeakPolarHBondContact CB-O 3.06Å
114D93.1Very high93.6Very high36 Ų3665.3 Ų65.319%0.19334%0.344CS..EExtended strand (participates in β ladder)trans-95117.3162.4-172.27.3000109.1R81 Q91 Y116 F127R81-D114 IonicContact CZ-OD2 3.89Å; R81-D114 VanDerWaalsContact NH1-CG 3.35Å; R81-D114 IonicContact NH1-OD2 2.84Å; R81-D114 PolarHBondContact NH1-OD2 3.27Å; Q91-D114 WeakPolarHBondContact CG-OD1 3.37Å; Q91-D114 VanDerWaalsContact NE2-CG 3.31Å; Q91-D114 PolarHBondContact NE2-OD1 3.48Å; Q91-D114 PolarHBondContact NE2-OD2 3.21Å; D114-Y116 HydrophobicContact CB-CE2 4.4Å; D114-Y116 VanDerWaalsContact CG-CE2 3.43Å; D114-Y116 WeakPolarHBondContact OD1-CE2 3.37Å; D114-Y116 VanDerWaalsContact OD2-CE2 3.25Å; D114-Y116 WeakPolarHBondContact OD2-CE2 3.4Å; D114-Y116 PolarHBondContact OD2-OH 2.75Å; D114-F127 HydrophobicContact CB-CB 4.31Å; D114-F127 PolarHBondContact N-O 3.28Å; D114-F127 PolarHBondContact O-N 3.39Å
115V94.7Very high93.8Very high3 Ų358.2 Ų58.22%0.01831%0.314CS..EExtended strand (participates in β ladder)trans-114.5130.3-172.4-177.60000110.1V92 I95 V98 P113 F124 I125 V126V92-V115 HydrophobicContact CB-CB 4.49Å; V92-V115 PolarHBondContact N-O 2.87Å; I95-V115 HydrophobicContact CB-CG2 4.26Å; I95-V115 HydrophobicContact CD1-CB 3.53Å; I95-V115 HydrophobicContact CD1-CG1 3.81Å; I95-V115 HydrophobicContact CD1-CG2 3.66Å; I95-V115 HydrophobicContact CG2-CG2 4.01Å; V98-V115 HydrophobicContact CG2-CG2 4.05Å; P113-V115 HydrophobicContact CB-CG2 4.02Å; P113-V115 HydrophobicContact CG-CG2 3.94Å; V115-F124 HydrophobicContact CG1-CB 4.47Å; V115-F124 HydrophobicContact CG1-CD1 4.05Å; V115-I125 CarbonylContact C-O 3.6Å; V115-I125 VanDerWaalsContact CA-O 3.28Å; V115-I125 WeakPolarHBondContact CA-O 3.44Å; V115-V126 HydrophobicContact CG1-CG2 4.32Å; V115-V126 HydrophobicContact CG2-CG1 4.28Å; V115-V126 HydrophobicContact CG2-CG2 4.19Å
116Y94.9Very high94Very high17 Ų1759.4 Ų59.47%0.06732%0.32CS..EExtended strand (participates in β ladder)trans-113.3141.5171.7-60.3-101.7000108.9K90 Q91 D114 F124 I125 F127K90-Y116 CarbonylContact O-C 3.54Å; K90-Y116 WeakPolarHBondContact O-CA 3.38Å; Q91-Y116 HydrophobicContact CB-CD1 3.99Å; Q91-Y116 HydrophobicContact CB-CE1 3.8Å; Q91-Y116 HydrophobicContact CG-CD1 4.43Å; Q91-Y116 HydrophobicContact CG-CE1 4.03Å; D114-Y116 HydrophobicContact CB-CE2 4.4Å; D114-Y116 VanDerWaalsContact CG-CE2 3.43Å; D114-Y116 WeakPolarHBondContact OD1-CE2 3.37Å; D114-Y116 VanDerWaalsContact OD2-CE2 3.25Å; D114-Y116 WeakPolarHBondContact OD2-CE2 3.4Å; D114-Y116 PolarHBondContact OD2-OH 2.75Å; Y116-F124 CarbonylContact O-C 3.53Å; Y116-F124 VanDerWaalsContact O-CA 3.32Å; Y116-F124 WeakPolarHBondContact O-CA 3.41Å; Y116-I125 PolarHBondContact N-O 2.82Å; Y116-I125 PolarHBondContact O-N 2.81Å; Y116-F127 AromaticContact CD2-CD2 3.68Å; Y116-F127 HydrophobicContact CD2-CD2 3.68Å; Y116-F127 AromaticContact CD2-CE2 3.57Å; Y116-F127 HydrophobicContact CD2-CE2 3.57Å; Y116-F127 AromaticContact CE2-CD2 3.59Å; Y116-F127 HydrophobicContact CE2-CD2 3.59Å; Y116-F127 AromaticContact CE2-CE2 3.6Å; Y116-F127 HydrophobicContact CE2-CE2 3.6Å
117K94.1Very high93.9Very high82 Ų8258.4 Ų58.436%0.35732%0.315SS..EExtended strand (participates in β ladder)trans-121.8138.3178.7-174.8-173.9-179.7178.80110K90 V92 P119 F124K90-K117 PolarHBondContact N-O 2.79Å; K90-K117 PolarHBondContact O-N 3.44Å; V92-K117 HydrophobicContact CG2-CB 3.61Å; K117-P119 WeakPolarHBondContact O-CD 3.23Å; K117-F124 HydrophobicContact CB-CD1 3.89Å; K117-F124 HydrophobicContact CB-CE1 3.92Å; K117-F124 HydrophobicContact CD-CD1 4.34Å; K117-F124 HydrophobicContact CD-CE1 3.53Å; K117-F124 HydrophobicContact CD-CZ 3.8Å; K117-F124 HydrophobicContact CG-CD1 3.88Å; K117-F124 HydrophobicContact CG-CE1 3.57Å; K117-F124 HydrophobicContact CG-CZ 4.04Å
118N93.1Very high93.8Very high47 Ų4758.7 Ų58.725%0.25133%0.326SS..  trans-73.1124.3166.1-170.40.7000110.2L89 S120 S121 T123L89-N118 HydrophobicContact CD2-CB 3.67Å; N118-S120 PolarHBondContact O-N 2.63Å; N118-S120 PolarHBondContact OD1-N 3.05Å; N118-S121 WeakPolarHBondContact CB-OG 3.4Å; N118-S121 PolarHBondContact ND2-OG 3.41Å; N118-T123 PolarHBondContact N-O 3.09Å
119P90.1Very high93.6Very high70 Ų7060.5 Ų60.546%0.45534%0.335SS..THydrogen-bonded Turntrans-61.9-27.2175.6-24.636.1000113.8N88 K90 K117N88-P119 WeakPolarHBondContact O-CD 3.4Å; K90-P119 HydrophobicContact CD-CG 3.87Å; K90-P119 HydrophobicContact CG-CG 3.86Å; K117-P119 WeakPolarHBondContact O-CD 3.23Å
120S92.4Very high93.4Very high113 Ų11363.7 Ų63.779%0.7936%0.362SS*.THydrogen-bonded Turntrans-93.8-12.4-172.8-52.30000114.3N118N118-S120 PolarHBondContact O-N 2.63Å; N118-S120 PolarHBondContact OD1-N 3.05Å
121S92.6Very high93.3Very high46 Ų4668.8 Ų68.832%0.32238%0.383SS..SBendtrans-145.5163.8-178.167.30000111.6N118 T123N118-S121 WeakPolarHBondContact CB-OG 3.4Å; N118-S121 PolarHBondContact ND2-OG 3.41Å; S121-T123 PolarHBondContact O-N 3.2Å; S121-T123 WeakPolarHBondContact OG-CB 3.37Å; S121-T123 PolarHBondContact OG-OG1 2.82Å
122E91.4Very high93.3Very high179 Ų17970.2 Ų70.284%0.83639%0.39SS*.SBendtrans-8048.5173.2-61.6-174.2167.600111.7
123T93.9Very high93.2Very high78 Ų7867.5 Ų67.548%0.47937%0.373SS..  trans-109125-179.3-50.60000110N118 S121N118-T123 PolarHBondContact N-O 3.09Å; S121-T123 PolarHBondContact O-N 3.2Å; S121-T123 WeakPolarHBondContact OG-CB 3.37Å; S121-T123 PolarHBondContact OG-OG1 2.82Å
124F94.2Very high93.1Very high108 Ų10868.2 Ų68.247%0.47438%0.376SS..EExtended strand (participates in β ladder)trans-118.9141.7-179.9-61.3-94.3000110.5V115 Y116 K117V115-F124 HydrophobicContact CG1-CB 4.47Å; V115-F124 HydrophobicContact CG1-CD1 4.05Å; Y116-F124 CarbonylContact O-C 3.53Å; Y116-F124 VanDerWaalsContact O-CA 3.32Å; Y116-F124 WeakPolarHBondContact O-CA 3.41Å; K117-F124 HydrophobicContact CB-CD1 3.89Å; K117-F124 HydrophobicContact CB-CE1 3.92Å; K117-F124 HydrophobicContact CD-CD1 4.34Å; K117-F124 HydrophobicContact CD-CE1 3.53Å; K117-F124 HydrophobicContact CD-CZ 3.8Å; K117-F124 HydrophobicContact CG-CD1 3.88Å; K117-F124 HydrophobicContact CG-CE1 3.57Å; K117-F124 HydrophobicContact CG-CZ 4.04Å
125I93.7Very high92.9Very high34 Ų3471.2 Ų71.217%0.17439%0.392CS..EExtended strand (participates in β ladder)trans-114.3120.3172.1-54.7-174.6000106.5F84 L89 V115 Y116 F127F84-I125 HydrophobicContact CB-CD1 4.1Å; F84-I125 HydrophobicContact CD1-CD1 3.21Å; F84-I125 HydrophobicContact CD2-CD1 3.77Å; F84-I125 HydrophobicContact CD2-CG2 4.25Å; F84-I125 HydrophobicContact CE1-CD1 3.39Å; F84-I125 HydrophobicContact CE2-CD1 3.93Å; F84-I125 HydrophobicContact CE2-CG2 4.46Å; F84-I125 HydrophobicContact CG-CD1 3.41Å; F84-I125 VanDerWaalsContact CG-CD1 3.41Å; F84-I125 HydrophobicContact CZ-CD1 3.74Å; L89-I125 HydrophobicContact CD1-CD1 3.41Å; L89-I125 VanDerWaalsContact CD1-CD1 3.41Å; L89-I125 HydrophobicContact CD1-CG1 4.37Å; V115-I125 CarbonylContact C-O 3.6Å; V115-I125 VanDerWaalsContact CA-O 3.28Å; V115-I125 WeakPolarHBondContact CA-O 3.44Å; Y116-I125 PolarHBondContact N-O 2.82Å; Y116-I125 PolarHBondContact O-N 2.81Å; I125-F127 HydrophobicContact CG2-CD2 4.13Å; I125-F127 HydrophobicContact CG2-CE2 3.64Å; I125-F127 HydrophobicContact CG2-CZ 3.88Å
126V94.9Very high92.7Very high55 Ų5573.4 Ų73.433%0.33341%0.407SS..EExtended strand (participates in β ladder)trans-113.8115.1-176.6-1780000107.9V98 V110 P113 V115V98-V126 HydrophobicContact CB-CG1 4.2Å; V98-V126 HydrophobicContact CG1-CG1 4.25Å; V98-V126 HydrophobicContact CG1-CG2 4.29Å; V98-V126 HydrophobicContact CG2-CG1 4.17Å; V98-V126 HydrophobicContact CG2-CG2 4.44Å; V110-V126 HydrophobicContact CB-CG1 4.42Å; V110-V126 HydrophobicContact CG1-CG1 4.46Å; V110-V126 HydrophobicContact CG2-CG1 4.34Å; P113-V126 HydrophobicContact CB-CG1 3.66Å; P113-V126 HydrophobicContact CG-CG1 4.34Å; V115-V126 HydrophobicContact CG1-CG2 4.32Å; V115-V126 HydrophobicContact CG2-CG1 4.28Å; V115-V126 HydrophobicContact CG2-CG2 4.19Å
127F93.6Very high92.5Very high18 Ų1877.6 Ų77.68%0.07943%0.427CS..EExtended strand (participates in β ladder)trans-100.1127.8172.5-65.1-79.6000110.6E77 A80 R81 F84 P113 D114 Y116 I125E77-F127 HydrophobicContact CG-CD1 3.59Å; E77-F127 HydrophobicContact CG-CE1 4.05Å; A80-F127 HydrophobicContact CB-CE1 3.96Å; A80-F127 HydrophobicContact CB-CZ 4.33Å; R81-F127 HydrophobicContact CB-CE1 4.34Å; R81-F127 HydrophobicContact CB-CZ 4.06Å; R81-F127 HydrophobicContact CG-CE2 4.48Å; F84-F127 AromaticContact CD2-CZ 3.88Å; F84-F127 HydrophobicContact CD2-CZ 3.88Å; P113-F127 CarbonylContact C-O 3.54Å; P113-F127 VanDerWaalsContact CA-O 3.3Å; P113-F127 WeakPolarHBondContact CA-O 3.3Å; P113-F127 WeakPolarHBondContact CB-O 3.06Å; D114-F127 HydrophobicContact CB-CB 4.31Å; D114-F127 PolarHBondContact N-O 3.28Å; D114-F127 PolarHBondContact O-N 3.39Å; Y116-F127 AromaticContact CD2-CD2 3.68Å; Y116-F127 HydrophobicContact CD2-CD2 3.68Å; Y116-F127 AromaticContact CD2-CE2 3.57Å; Y116-F127 HydrophobicContact CD2-CE2 3.57Å; Y116-F127 AromaticContact CE2-CD2 3.59Å; Y116-F127 HydrophobicContact CE2-CD2 3.59Å; Y116-F127 AromaticContact CE2-CE2 3.6Å; Y116-F127 HydrophobicContact CE2-CE2 3.6Å; I125-F127 HydrophobicContact CG2-CD2 4.13Å; I125-F127 HydrophobicContact CG2-CE2 3.64Å; I125-F127 HydrophobicContact CG2-CZ 3.88Å
128G92.5Very high92.2Very high42 Ų4279.1 Ų79.143%0.43344%0.436SS..SBendtrans159.7-179.4172.800000111.3A130G128-A130 PolarHBondContact O-N 3.3Å
129E90.7Very high92.1Very high102 Ų10279.5 Ų79.548%0.47745%0.445SS..  trans-83.7114.6178.9-65.4171.4-165.600110.2K131E129-K131 PolarHBondContact O-N 3Å
130A92.3Very high92.1Very high69 Ų6982.7 Ų82.757%0.5745%0.454SS*.EExtended strand (participates in β ladder)trans-77.8116.517300000110.7V110 G128V110-A130 HydrophobicContact CG2-CB 4.15Å; G128-A130 PolarHBondContact O-N 3.3Å
131K93.4Very high91.9Very high115 Ų11582.9 Ų82.950%0.544%0.443SS..EExtended strand (participates in β ladder)trans-103.8140.2174.8-61.6-173.7178.9-173.60109.7F108 V109 E129F108-K131 CarbonylContact C-O 3.53Å; F108-K131 WeakPolarHBondContact CA-O 3.34Å; V109-K131 PolarHBondContact N-O 2.91Å; V109-K131 PolarHBondContact O-N 3.49Å; E129-K131 PolarHBondContact O-N 3Å
132I94Very high91.8Very high120 Ų12082.2 Ų82.262%0.61544%0.439SS*.EExtended strand (participates in β ladder)trans-86.6125.7174.3-57.9174.3000107.7I106 F108I106-I132 HydrophobicContact CG2-CG2 4.19Å; F108-I132 HydrophobicContact CD1-CG1 3.86Å; F108-I132 HydrophobicContact CE1-CD1 3.99Å; F108-I132 HydrophobicContact CE1-CG1 3.68Å
133E93.3Very high91.8Very high72 Ų7276 Ų7634%0.33642%0.419SS..EExtended strand (participates in β ladder)trans-117.8118.1174.7-170.9172.8149.700108R97 L107 V109R97-E133 IonicContact CZ-OE2 2.7Å; R97-E133 IonicContact NH2-OE1 2.68Å; R97-E133 PolarHBondContact NH2-OE1 2.83Å; R97-E133 IonicContact NH2-OE2 3.42Å; R97-E133 PolarHBondContact NH2-OE2 2.85Å; L107-E133 HydrophobicContact CB-CB 4.43Å; L107-E133 PolarHBondContact N-O 3.42Å; L107-E133 PolarHBondContact O-N 3.11Å; V109-E133 HydrophobicContact CG2-CB 4Å; V109-E133 WeakPolarHBondContact CG2-OE2 3.46Å
134D93.4Very high91.5Very high27 Ų2775.2 Ų75.214%0.14442%0.42CS..EExtended strand (participates in β ladder)trans-107.2107175.3-173.9-5.4000109.4S105 I106 S136 Q137 H138S105-D134 WeakPolarHBondContact CB-OD1 3.34Å; S105-D134 CarbonylContact O-C 3.59Å; S105-D134 WeakPolarHBondContact O-CA 3.28Å; S105-D134 PolarHBondContact OG-OD1 2.82Å; S105-D134 VanDerWaalsContact OG-OD1 3.05Å; I106-D134 HydrophobicContact CD1-CB 3.64Å; I106-D134 WeakPolarHBondContact CD1-OD2 3.43Å; D134-S136 PolarHBondContact O-N 3.44Å; D134-S136 WeakPolarHBondContact OD1-CB 3.34Å; D134-S136 PolarHBondContact OD1-N 3.08Å; D134-S136 PolarHBondContact OD1-OG 3.36Å; D134-S136 PolarHBondContact OD2-OG 3.31Å; D134-Q137 HydrophobicContact CB-CB 4.21Å; D134-Q137 HydrophobicContact CB-CG 4.22Å; D134-Q137 PolarHBondContact O-N 3.13Å; D134-Q137 WeakPolarHBondContact OD2-CG 3.27Å; D134-Q137 PolarHBondContact OD2-NE2 3.46Å; D134-H138 PolarHBondContact O-N 2.98Å
135L87.8Confident91.2Very high99 Ų9976.4 Ų76.452%0.51843%0.427SS..Hα-helixtrans-60.4-27.7179.3-173.661.1000112.2S105 A139S105-L135 PolarHBondContact O-N 3.3Å; L135-A139 VanDerWaalsContact O-CB 3.32Å; L135-A139 WeakPolarHBondContact O-CB 3.45Å; L135-A139 PolarHBondContact O-N 3.35Å
136S90.1Very high90.7Very high49 Ų4982.2 Ų82.234%0.34345%0.451SS..Hα-helixtrans-72.6-43.6179.870.10000111.9D134 A139 Q140D134-S136 PolarHBondContact O-N 3.44Å; D134-S136 WeakPolarHBondContact OD1-CB 3.34Å; D134-S136 PolarHBondContact OD1-N 3.08Å; D134-S136 PolarHBondContact OD1-OG 3.36Å; D134-S136 PolarHBondContact OD2-OG 3.31Å; S136-A139 PolarHBondContact O-N 2.94Å; S136-Q140 WeakPolarHBondContact O-CG 3.2Å; S136-Q140 PolarHBondContact O-N 2.94Å
137Q90.1Very high89.8Confident105 Ų10587.7 Ų87.749%0.49147%0.471SS..Hα-helixtrans-65-41.1173.8-70.5178.350.700111.3D134 A139 Q140 Q141D134-Q137 HydrophobicContact CB-CB 4.21Å; D134-Q137 HydrophobicContact CB-CG 4.22Å; D134-Q137 PolarHBondContact O-N 3.13Å; D134-Q137 WeakPolarHBondContact OD2-CG 3.27Å; D134-Q137 PolarHBondContact OD2-NE2 3.46Å; Q137-A139 VanDerWaalsContact C-N 3.34Å; Q137-A139 PolarHBondContact O-N 3.48Å; Q137-Q140 PolarHBondContact O-N 3.32Å; Q137-Q141 WeakPolarHBondContact O-CB 3.35Å; Q137-Q141 VanDerWaalsContact O-CG 3.27Å; Q137-Q141 WeakPolarHBondContact O-CG 3.33Å; Q137-Q141 PolarHBondContact O-N 2.96Å
138H88.9Confident88.8Confident114 Ų11495.5 Ų95.553%0.52851%0.505SS..Hα-helixtrans-62.1-41.2175.4-172.1-71.4000111.9D134 A142D134-H138 PolarHBondContact O-N 2.98Å; H138-A142 WeakPolarHBondContact O-CB 3.32Å; H138-A142 PolarHBondContact O-N 2.96Å
139A90.3Very high87.5Confident55 Ų55100.4 Ų100.446%0.45552%0.52SS..Hα-helixtrans-66.8-40.7177.300000112.5L135 S136 Q137 A142 A143L135-A139 VanDerWaalsContact O-CB 3.32Å; L135-A139 WeakPolarHBondContact O-CB 3.45Å; L135-A139 PolarHBondContact O-N 3.35Å; S136-A139 PolarHBondContact O-N 2.94Å; Q137-A139 VanDerWaalsContact C-N 3.34Å; Q137-A139 PolarHBondContact O-N 3.48Å; A139-A142 PolarHBondContact O-N 3.06Å; A139-A143 WeakPolarHBondContact O-CB 3.36Å; A139-A143 PolarHBondContact O-N 3.29Å
140Q90.5Very high86.1Confident136 Ų136100.9 Ų100.964%0.63653%0.529SS*.Hα-helixtrans-65.1-42.1176.4-73.4175.6-1300112S136 Q137 A143 A144S136-Q140 WeakPolarHBondContact O-CG 3.2Å; S136-Q140 PolarHBondContact O-N 2.94Å; Q137-Q140 PolarHBondContact O-N 3.32Å; Q140-A143 PolarHBondContact O-N 2.89Å; Q140-A144 WeakPolarHBondContact O-CB 3.48Å; Q140-A144 PolarHBondContact O-N 3.19Å
141Q88.7Confident84.2Confident118 Ų118105.9 Ų105.955%0.55154%0.541SS*.Hα-helixtrans-63.3-47.2175.5-72170.2-2.500111.2Q137 A143 A144 E145Q137-Q141 WeakPolarHBondContact O-CB 3.35Å; Q137-Q141 VanDerWaalsContact O-CG 3.27Å; Q137-Q141 WeakPolarHBondContact O-CG 3.33Å; Q137-Q141 PolarHBondContact O-N 2.96Å; Q141-A143 VanDerWaalsContact C-N 3.32Å; Q141-A143 PolarHBondContact O-N 3.21Å; Q141-A144 PolarHBondContact O-N 2.94Å; Q141-E145 WeakPolarHBondContact O-CG 3.3Å; Q141-E145 PolarHBondContact O-N 2.87Å
142A90.3Very high82.1Confident31 Ų31105.1 Ų105.126%0.25655%0.548SS..Hα-helixtrans-64.9-32.6177.700000113.3H138 A139 K146H138-A142 WeakPolarHBondContact O-CB 3.32Å; H138-A142 PolarHBondContact O-N 2.96Å; A139-A142 PolarHBondContact O-N 3.06Å; A142-K146 WeakPolarHBondContact O-CG 3.47Å; A142-K146 PolarHBondContact O-N 3.39Å
143A91.1Very high79.8Confident48 Ų48103.7 Ų103.740%0.39755%0.554SS.*Hα-helixtrans-70.9-41173.600000111.8A139 Q140 Q141 K146 F147A139-A143 WeakPolarHBondContact O-CB 3.36Å; A139-A143 PolarHBondContact O-N 3.29Å; Q140-A143 PolarHBondContact O-N 2.89Å; Q141-A143 VanDerWaalsContact C-N 3.32Å; Q141-A143 PolarHBondContact O-N 3.21Å; A143-K146 PolarHBondContact O-N 2.9Å; A143-F147 PolarHBondContact O-N 3.17Å
144A88.3Confident77.7Confident62 Ų62106.6 Ų106.651%0.51258%0.577SS.*Hα-helixtrans-64.9-37.817700000112.5Q140 Q141 K146 F147 K148Q140-A144 WeakPolarHBondContact O-CB 3.48Å; Q140-A144 PolarHBondContact O-N 3.19Å; Q141-A144 PolarHBondContact O-N 2.94Å; A144-K146 VanDerWaalsContact C-N 3.28Å; A144-K146 PolarHBondContact O-N 2.88Å; A144-F147 PolarHBondContact O-N 2.62Å; A144-K148 PolarHBondContact O-N 3.05Å
145E87.6Confident75.4Confident133 Ų133112.2 Ų112.262%0.62161%0.606SS**Hα-helixtrans-60.8-37.2174.4-73.8176.7168.300112.2Q141 I149Q141-E145 WeakPolarHBondContact O-CG 3.3Å; Q141-E145 PolarHBondContact O-N 2.87Å; E145-I149 WeakPolarHBondContact O-CD1 3.21Å; E145-I149 WeakPolarHBondContact O-CG1 3.29Å
146K82Confident73Confident156 Ų156113.3 Ų113.368%0.67862%0.617SS**Hα-helixtrans-70.1-35.2175.7-67.1175.4-175.5-171.30112.9A142 A143 A144 T150A142-K146 WeakPolarHBondContact O-CG 3.47Å; A142-K146 PolarHBondContact O-N 3.39Å; A143-K146 PolarHBondContact O-N 2.9Å; A144-K146 VanDerWaalsContact C-N 3.28Å; A144-K146 PolarHBondContact O-N 2.88Å; K146-T150 PolarHBondContact O-OG1 3.27Å
147F77.3Confident70.7Confident171 Ų171117.7 Ų117.775%0.7564%0.641SS**Hα-helixtrans-70.7-35.4176.1-96.1-93.7000112.5A143 A144 I149 T150A143-F147 PolarHBondContact O-N 3.17Å; A144-F147 PolarHBondContact O-N 2.62Å; F147-I149 PolarHBondContact O-N 3.37Å; F147-T150 PolarHBondContact O-N 3Å; F147-T150 VanDerWaalsContact O-N 3.16Å
148K72.2Confident68.1Low181 Ų181119.3 Ų119.379%0.78766%0.659SS**Hα-helixtrans-69.9-19.9-177.9-155.8166.9-175.4-178.10113.8A144A144-K148 PolarHBondContact O-N 3.05Å
149I64.8Low65.6Low146 Ų146120.6 Ų120.675%0.74967%0.67SS**THydrogen-bonded Turntrans-84-14.7177-61.3164000111.4E145 F147E145-I149 WeakPolarHBondContact O-CD1 3.21Å; E145-I149 WeakPolarHBondContact O-CG1 3.29Å; F147-I149 PolarHBondContact O-N 3.37Å
150T61.2Low63.3Low111 Ų111123.5 Ų123.568%0.68168%0.681SS**SBendtrans-94.311.4-175.9-48.10000113.7K146 F147 P152K146-T150 PolarHBondContact O-OG1 3.27Å; F147-T150 PolarHBondContact O-N 3Å; F147-T150 VanDerWaalsContact O-N 3.16Å; T150-P152 VanDerWaalsContact C-CD 3.48Å; T150-P152 WeakPolarHBondContact O-CD 3.45Å
151E52.1Low60.9Low174 Ų174122.6 Ų122.681%0.81369%0.686SS**  trans-101.989.1171.9-126.9179.3175.500110.3A153E151-A153 PolarHBondContact O-N 2.89Å
152P49Very low58.5Low99 Ų99122 Ų12264%0.64370%0.701SS**  trans-67121.4156.429.8-28.2000106.3T150 V154T150-P152 VanDerWaalsContact C-CD 3.48Å; T150-P152 WeakPolarHBondContact O-CD 3.45Å; P152-V154 VanDerWaalsContact C-N 3.29Å; P152-V154 PolarHBondContact O-N 3.5Å
153A46Very low56.2Low90 Ų90125.6 Ų125.674%0.74472%0.72SS**  trans-53.491.7169.200000110.3E151 L155E151-A153 PolarHBondContact O-N 2.89Å; A153-L155 VanDerWaalsContact C-N 3.29Å
154V49.5Very low53.8Low134 Ų134130.9 Ų130.981%0.81274%0.741SS**  trans-101.963.6159.2-670000107.5P152 T156P152-V154 VanDerWaalsContact C-N 3.29Å; P152-V154 PolarHBondContact O-N 3.5Å; V154-T156 PolarHBondContact O-N 3.48Å
155L45.3Very low51.4Low144 Ų144134.3 Ų134.375%0.75475%0.751SS**  trans-58122.4155.6-76.4166.9000107.4A153A153-L155 VanDerWaalsContact C-N 3.29Å
156T38.7Very low49.2Very low122 Ų122136.3 Ų136.375%0.74876%0.76SS**  trans58.488.6149.460.50000117V154V154-T156 PolarHBondContact O-N 3.48Å
157T40.2Very low47Very low141 Ų141137.8 Ų137.887%0.86577%0.769SS**  -154.995.6128.725.30000108.6D159T157-D159 PolarHBondContact O-N 2.84Å
158T36.4Very low45.5Very low140 Ų140135 Ų13586%0.85977%0.769SS**  trans-53.4103.1146.143.50000108.7
159D36.8Very low44.1Very low140 Ų140134.4 Ų134.475%0.74977%0.769SS**  trans-177.6113.7133.5-125.7-23.6000109.6T157T157-D159 PolarHBondContact O-N 2.84Å
160V40.5Very low43.3Very low116 Ų116131.2 Ų131.270%0.70376%0.764SS**  trans33.3108.5131.7-168.30000116.1
161T39.8Very low42.6Very low118 Ų118133.1 Ų133.172%0.72477%0.765SS**  -177.1118.6112.226.30000109.5T163T161-T163 PolarHBondContact O-N 3.41Å; T161-T163 VanDerWaalsContact O-N 3.12Å
162A39.3Very low42.1Very low105 Ų105129.6 Ų129.687%0.86876%0.76SS**  trans-65.5102.5165.600000109.1
163T42.6Very low42.2Very low107 Ų107132 Ų13266%0.65676%0.763SS**  trans-116.884.7160.154.30000104.5T161 D165T161-T163 PolarHBondContact O-N 3.41Å; T161-T163 VanDerWaalsContact O-N 3.12Å; T163-D165 VanDerWaalsContact C-N 3.29Å; T163-D165 PolarHBondContact O-N 3.45Å
164N39.8Very low42.2Very low158 Ų158134.4 Ų134.485%0.84576%0.763SS**  36.961.785.3-153.842.6000112.2
165D38.4Very low42.5Very low135 Ų135134.7 Ų134.772%0.72276%0.755SS**  trans-141.9121.5160.8-90.4-45.5000109.9T163T163-D165 VanDerWaalsContact C-N 3.29Å; T163-D165 PolarHBondContact O-N 3.45Å
166E40.9Very low43.2Very low174 Ų174136.7 Ų136.781%0.81376%0.761SS**  trans72.985.1150.3-53.9-166.1120.800117P168E166-P168 WeakPolarHBondContact O-CD 3.29Å
167Q35.7Very low44.6Very low187 Ų187134.2 Ų134.287%0.87474%0.741SS**  trans-37.6117.8147.8-69.9172.2-60.900111.5
168P46.9Very low46.3Very low113 Ų113130.9 Ų130.973%0.73472%0.718SS**  trans-76115.9131.59.510.8000105.5E166 A170E166-P168 WeakPolarHBondContact O-CD 3.29Å; P168-A170 PolarHBondContact O-N 3.4Å
169Q42.4Very low48.4Very low168 Ų168126.3 Ų126.379%0.78569%0.689SS**  trans-58.876.1164.4-171.8-178.8-21.300108.7
170A47Very low50.6Low79 Ų79124.7 Ų124.765%0.65369%0.685SS**  trans-96.6104.2158.400000103.6P168 S172P168-A170 PolarHBondContact O-N 3.4Å; A170-S172 PolarHBondContact O-N 3.25Å
171E46.6Very low52.8Low151 Ų151122.4 Ų122.471%0.70668%0.684SS**  trans-32.692.1159.7-102.173.2-172.900109.6E173E171-E173 PolarHBondContact O-N 2.98Å
172S42.8Very low55.3Low100 Ų100117.4 Ų117.470%0.69965%0.653SS**  trans-74.475163.11710000104.1A170 D174A170-S172 PolarHBondContact O-N 3.25Å; S172-D174 PolarHBondContact O-N 2.95Å
173E50Low57.8Low151 Ų151117.1 Ų117.171%0.70663%0.634SS**  trans-69.670.6163.4-156158.5-14300105.9E171 E175E171-E173 PolarHBondContact O-N 2.98Å; E173-E175 HydrophobicContact CG-CG 3.9Å; E173-E175 PolarHBondContact O-N 3.38Å
174D46.4Very low60.2Low139 Ų139118.1 Ų118.174%0.74363%0.631SS**  trans-71.948.4168-168.327.8000107.7S172 E176S172-D174 PolarHBondContact O-N 2.95Å; D174-E176 PolarHBondContact O-N 3.21Å; D174-E176 VanDerWaalsContact O-N 3.07Å
175E55.9Low62.8Low140 Ų140117.1 Ų117.165%0.65462%0.619SS**  trans-67.5109167.5-80.6-170.8161.800105.5E173 E177E173-E175 HydrophobicContact CG-CG 3.9Å; E173-E175 PolarHBondContact O-N 3.38Å; E175-E177 VanDerWaalsContact C-N 3.27Å; E175-E177 VanDerWaalsContact O-CG 3.27Å; E175-E177 WeakPolarHBondContact O-CG 3.26Å; E175-E177 PolarHBondContact O-N 3.4Å
176E59.1Low65.4Low186 Ų186111.9 Ų111.987%0.86959%0.591SS**  trans-34.489.5172.2-64.517116500110.7D174 D178D174-E176 PolarHBondContact O-N 3.21Å; D174-E176 VanDerWaalsContact O-N 3.07Å; E176-D178 PolarHBondContact O-N 3.47Å
177E69.2Low68Low71 Ų71103.8 Ų103.833%0.33255%0.553SS.*  trans-7687.3-176.7-74.6-154.1-177.100107.4E175 T179 R198 A199 I202E175-E177 VanDerWaalsContact C-N 3.27Å; E175-E177 VanDerWaalsContact O-CG 3.27Å; E175-E177 WeakPolarHBondContact O-CG 3.26Å; E175-E177 PolarHBondContact O-N 3.4Å; E177-T179 PolarHBondContact O-N 2.97Å; E177-R198 VanDerWaalsContact OE2-CB 3.23Å; E177-R198 WeakPolarHBondContact OE2-CB 3.36Å; E177-R198 VanDerWaalsContact OE2-CD 3.24Å; E177-R198 WeakPolarHBondContact OE2-CD 3.28Å; E177-R198 WeakPolarHBondContact OE2-CG 3.19Å; E177-R198 IonicContact OE2-CZ 3.7Å; E177-R198 IonicContact OE2-NE 2.67Å; E177-R198 IonicContact OE2-NH1 3.48Å; E177-R198 PolarHBondContact OE2-NH1 2.91Å; E177-A199 WeakPolarHBondContact OE1-CA 3.47Å; E177-A199 VanDerWaalsContact OE1-CB 3.29Å; E177-A199 WeakPolarHBondContact OE1-CB 3.5Å; E177-A199 PolarHBondContact OE1-N 2.98Å; E177-A199 PolarHBondContact OE2-N 3.43Å; E177-A199 VanDerWaalsContact OE2-N 3.15Å; E177-I202 HydrophobicContact CB-CD1 3.85Å; E177-I202 VanDerWaalsContact OE2-CD1 3.3Å; E177-I202 WeakPolarHBondContact OE2-CD1 3.38Å
178D75.8Confident70.8Confident71 Ų71101.1 Ų101.138%0.3854%0.541SS..  trans-59.7101.2-174.6177.517.6000111.1E176 T180 R206E176-D178 PolarHBondContact O-N 3.47Å; D178-T180 VanDerWaalsContact C-N 3.27Å; D178-T180 WeakPolarHBondContact OD1-CB 3.25Å; D178-T180 PolarHBondContact OD1-N 2.99Å; D178-T180 PolarHBondContact OD1-OG1 3.43Å; D178-R206 VanDerWaalsContact O-CZ 3.24Å; D178-R206 PolarHBondContact O-NH2 2.92Å; D178-R206 IonicContact OD1-NH2 3.05Å; D178-R206 PolarHBondContact OD1-NH2 3.3Å; D178-R206 IonicContact OD2-CZ 3.76Å; D178-R206 IonicContact OD2-NH1 3.76Å; D178-R206 PolarHBondContact OD2-NH1 3.06Å; D178-R206 IonicContact OD2-NH2 2.63Å; D178-R206 PolarHBondContact OD2-NH2 3.05Å
179T80.8Confident73.2Confident43 Ų4398.9 Ų98.926%0.26452%0.522SS..  trans-85.34.7176.550.30000112.9E177 G181 I182 I187 I202E177-T179 PolarHBondContact O-N 2.97Å; T179-G181 PolarHBondContact O-N 2.86Å; T179-G181 VanDerWaalsContact O-N 3.1Å; T179-I182 PolarHBondContact O-N 3.48Å; T179-I187 HydrophobicContact CG2-CD1 3.86Å; T179-I202 HydrophobicContact CG2-CD1 4.2Å
180T82.6Confident75.6Confident107 Ų10790.9 Ų90.966%0.65649%0.485SS*.THydrogen-bonded Turntrans-58.7120.5-176-53.50000110.7D178D178-T180 VanDerWaalsContact C-N 3.27Å; D178-T180 WeakPolarHBondContact OD1-CB 3.25Å; D178-T180 PolarHBondContact OD1-N 2.99Å; D178-T180 PolarHBondContact OD1-OG1 3.43Å
181G87.5Confident77.9Confident67 Ų6790.1 Ų90.169%0.69147%0.469SS*.THydrogen-bonded Turntrans80.57.217900000115.4T179 N210T179-G181 PolarHBondContact O-N 2.86Å; T179-G181 VanDerWaalsContact O-N 3.1Å; G181-N210 PolarHBondContact O-ND2 3.29Å
182I90.9Very high80.2Confident14 Ų1486.9 Ų86.97%0.07246%0.463CS..SBendtrans-115.6131.4176.4-52174.5000108.9T179 I187 I202 L205 R206T179-I182 PolarHBondContact O-N 3.48Å; I182-I187 HydrophobicContact CB-CD1 4.36Å; I182-I187 HydrophobicContact CG2-CD1 3.89Å; I182-I187 HydrophobicContact CG2-CG1 3.6Å; I182-I202 HydrophobicContact CD1-CB 4.37Å; I182-I202 HydrophobicContact CD1-CG2 3.77Å; I182-L205 HydrophobicContact CD1-CB 4.37Å; I182-L205 HydrophobicContact CG2-CB 4.15Å; I182-L205 HydrophobicContact CG2-CD1 3.57Å; I182-L205 HydrophobicContact CG2-CG 4.42Å; I182-R206 HydrophobicContact CD1-CG 3.68Å
183E93.1Very high82.6Confident99 Ų9987.3 Ų87.346%0.46345%0.454SS..  trans-72.4130.2175.6-167169174.900109.8K185 D186 I187E183-K185 HydrophobicContact CG-CB 4.17Å; E183-K185 HydrophobicContact CG-CG 4.29Å; E183-K185 PolarHBondContact O-N 2.6Å; E183-K185 IonicContact OE1-NZ 3.28Å; E183-K185 PolarHBondContact OE1-NZ 2.92Å; E183-D186 HydrophobicContact CB-CB 4.46Å; E183-D186 WeakPolarHBondContact O-CB 3.39Å; E183-D186 PolarHBondContact O-N 2.8Å; E183-I187 PolarHBondContact O-N 3.46Å
184E92.4Very high84.6Confident127 Ų12780.4 Ų80.459%0.59342%0.423SS*.Hα-helixtrans-58.1-33.7-179.8-69.1176.317000112.1D186 I187 E188E184-D186 PolarHBondContact O-N 3.13Å; E184-I187 WeakPolarHBondContact O-CB 3.18Å; E184-I187 PolarHBondContact O-N 2.85Å; E184-E188 PolarHBondContact O-N 3.26Å
185K93.8Very high86.8Confident138 Ų13880.8 Ų80.860%0.643%0.425SS*.Hα-helixtrans-60.5-34.6174.2-57.2-164.9-162.9106.60112.7E183 L189E183-K185 HydrophobicContact CG-CB 4.17Å; E183-K185 HydrophobicContact CG-CG 4.29Å; E183-K185 PolarHBondContact O-N 2.6Å; E183-K185 IonicContact OE1-NZ 3.28Å; E183-K185 PolarHBondContact OE1-NZ 2.92Å; K185-L189 WeakPolarHBondContact O-CB 3.42Å; K185-L189 PolarHBondContact O-N 2.92Å
186D94.4Very high88.5Confident24 Ų2475 Ų7513%0.12840%0.399CS..Hα-helixtrans-72.3-39.3179.9-67.6-7.7000110.8E183 E184 L189 V190 L205 L212E183-D186 HydrophobicContact CB-CB 4.46Å; E183-D186 WeakPolarHBondContact O-CB 3.39Å; E183-D186 PolarHBondContact O-N 2.8Å; E184-D186 PolarHBondContact O-N 3.13Å; D186-L189 PolarHBondContact O-N 2.92Å; D186-V190 VanDerWaalsContact O-CG2 3.28Å; D186-V190 WeakPolarHBondContact O-CG2 3.44Å; D186-V190 PolarHBondContact O-N 2.87Å; D186-L205 HydrophobicContact CB-CD1 3.95Å; D186-L205 HydrophobicContact CB-CD2 4.16Å; D186-L212 HydrophobicContact CB-CD2 3.46Å; D186-L212 VanDerWaalsContact CB-CD2 3.46Å; D186-L212 HydrophobicContact CB-CG 4.27Å; D186-L212 VanDerWaalsContact CG-CD2 3.46Å; D186-L212 WeakPolarHBondContact OD1-CD1 3.3Å; D186-L212 WeakPolarHBondContact OD1-CD2 3.46Å
187I94.6Very high90.2Very high4 Ų470.6 Ų70.62%0.02139%0.385CS..Hα-helixtrans-61.3-50175.1-57.3170.9000109.4T179 I182 E183 E184 L189 V190 M191 R198 A201 I202 L205T179-I187 HydrophobicContact CG2-CD1 3.86Å; I182-I187 HydrophobicContact CB-CD1 4.36Å; I182-I187 HydrophobicContact CG2-CD1 3.89Å; I182-I187 HydrophobicContact CG2-CG1 3.6Å; E183-I187 PolarHBondContact O-N 3.46Å; E184-I187 WeakPolarHBondContact O-CB 3.18Å; E184-I187 PolarHBondContact O-N 2.85Å; I187-L189 VanDerWaalsContact C-N 3.29Å; I187-L189 PolarHBondContact O-N 3.41Å; I187-V190 PolarHBondContact O-N 3.02Å; I187-M191 HydrophobicContact CG2-CG 4.34Å; I187-M191 HydrophobicContact CG2-SD 3.91Å; I187-M191 WeakPolarHBondContact O-CB 3.42Å; I187-M191 VanDerWaalsContact O-CG 3.25Å; I187-M191 WeakPolarHBondContact O-CG 3.4Å; I187-M191 PolarHBondContact O-N 2.94Å; I187-R198 HydrophobicContact CG2-CG 3.74Å; I187-A201 HydrophobicContact CG2-CB 3.99Å; I187-I202 HydrophobicContact CD1-CD1 4.2Å; I187-I202 HydrophobicContact CD1-CG1 3.74Å; I187-I202 HydrophobicContact CG1-CG1 4.11Å; I187-I202 HydrophobicContact CG2-CG1 4.24Å; I187-L205 HydrophobicContact CB-CD1 4.43Å; I187-L205 HydrophobicContact CG1-CD1 3.8Å
188E95.6Very high91.3Very high131 Ų13171.5 Ų71.561%0.61239%0.385SS*.Hα-helixtrans-58.8-40176.5-73.7-176.8179.300112.3E184 M191 S192E184-E188 PolarHBondContact O-N 3.26Å; E188-M191 PolarHBondContact O-N 3.15Å; E188-S192 VanDerWaalsContact O-CB 3.28Å; E188-S192 WeakPolarHBondContact O-CB 3.4Å; E188-S192 PolarHBondContact O-N 2.83Å; E188-S192 PolarHBondContact O-OG 3.16Å
189L95.8Very high92.1Very high66 Ų6670.5 Ų70.535%0.34639%0.386SS..Hα-helixtrans-66.5-44.3178.5-16268.1000111.5K185 D186 I187 S192 Q193 L212 I216K185-L189 WeakPolarHBondContact O-CB 3.42Å; K185-L189 PolarHBondContact O-N 2.92Å; D186-L189 PolarHBondContact O-N 2.92Å; I187-L189 VanDerWaalsContact C-N 3.29Å; I187-L189 PolarHBondContact O-N 3.41Å; L189-S192 PolarHBondContact O-N 3.3Å; L189-S192 PolarHBondContact O-OG 3.29Å; L189-S192 VanDerWaalsContact O-OG 3.13Å; L189-Q193 HydrophobicContact CD1-CG 4.29Å; L189-Q193 HydrophobicContact CG-CG 4.36Å; L189-Q193 VanDerWaalsContact O-CB 3.26Å; L189-Q193 WeakPolarHBondContact O-CB 3.32Å; L189-Q193 VanDerWaalsContact O-CG 3.29Å; L189-Q193 WeakPolarHBondContact O-CG 3.45Å; L189-Q193 PolarHBondContact O-N 3.04Å; L189-L212 HydrophobicContact CD2-CD2 4.11Å; L189-I216 HydrophobicContact CD2-CD1 4.27Å; L189-I216 HydrophobicContact CG-CD1 4.24Å
190V94Very high92.6Very high0 Ų072.5 Ų72.50%039%0.391CS..Hα-helixtrans-64.9-42.9176176.10000110.8D186 I187 A194 V196 A201 L205 A215 I216D186-V190 VanDerWaalsContact O-CG2 3.28Å; D186-V190 WeakPolarHBondContact O-CG2 3.44Å; D186-V190 PolarHBondContact O-N 2.87Å; I187-V190 PolarHBondContact O-N 3.02Å; V190-A194 HydrophobicContact CG1-CB 4.46Å; V190-A194 WeakPolarHBondContact O-CA 3.14Å; V190-A194 WeakPolarHBondContact O-CB 3.28Å; V190-A194 PolarHBondContact O-N 3.23Å; V190-V196 HydrophobicContact CG1-CG2 4.12Å; V190-A201 HydrophobicContact CB-CB 3.9Å; V190-A201 HydrophobicContact CG1-CB 3.68Å; V190-L205 HydrophobicContact CG2-CD1 4.16Å; V190-L205 HydrophobicContact CG2-CD2 3.99Å; V190-L205 HydrophobicContact CG2-CG 4.06Å; V190-A215 HydrophobicContact CG2-CB 4.02Å; V190-I216 HydrophobicContact CB-CG1 4.37Å; V190-I216 HydrophobicContact CG2-CD1 4.46Å; V190-I216 HydrophobicContact CG2-CG1 3.78Å
191M94.5Very high93.1Very high64 Ų6467.4 Ų67.432%0.31536%0.36SS..Hα-helixtrans-61.4-47176.9-73177.665.900111.8I187 E188 N195 V196 R198 A201I187-M191 HydrophobicContact CG2-CG 4.34Å; I187-M191 HydrophobicContact CG2-SD 3.91Å; I187-M191 WeakPolarHBondContact O-CB 3.42Å; I187-M191 VanDerWaalsContact O-CG 3.25Å; I187-M191 WeakPolarHBondContact O-CG 3.4Å; I187-M191 PolarHBondContact O-N 2.94Å; E188-M191 PolarHBondContact O-N 3.15Å; M191-N195 WeakPolarHBondContact O-CA 3.29Å; M191-N195 PolarHBondContact O-N 3.22Å; M191-V196 WeakPolarHBondContact CG-O 3.17Å; M191-V196 PolarHBondContact O-N 3.06Å; M191-R198 HydrophobicContact CE-CB 4.04Å; M191-R198 VanDerWaalsContact SD-CA 3.55Å; M191-R198 HydrophobicContact SD-CB 3.65Å; M191-R198 HydrophobicContact SD-CG 3.8Å; M191-A201 HydrophobicContact CG-CB 3.74Å
192S94.5Very high93.4Very high83 Ų8364.7 Ų64.758%0.5833%0.33SS*.Hα-helixtrans-73.1-36-177.3590000113.4E188 L189E188-S192 VanDerWaalsContact O-CB 3.28Å; E188-S192 WeakPolarHBondContact O-CB 3.4Å; E188-S192 PolarHBondContact O-N 2.83Å; E188-S192 PolarHBondContact O-OG 3.16Å; L189-S192 PolarHBondContact O-N 3.3Å; L189-S192 PolarHBondContact O-OG 3.29Å; L189-S192 VanDerWaalsContact O-OG 3.13Å
193Q92.9Very high93.5Very high108 Ų10871.7 Ų71.751%0.50536%0.36SS..Hα-helixtrans-87.5-38.3-177.8-65.1-168.817.800113.3L189 I216L189-Q193 HydrophobicContact CD1-CG 4.29Å; L189-Q193 HydrophobicContact CG-CG 4.36Å; L189-Q193 VanDerWaalsContact O-CB 3.26Å; L189-Q193 WeakPolarHBondContact O-CB 3.32Å; L189-Q193 VanDerWaalsContact O-CG 3.29Å; L189-Q193 WeakPolarHBondContact O-CG 3.45Å; L189-Q193 PolarHBondContact O-N 3.04Å; Q193-I216 HydrophobicContact CB-CD1 4.35Å; Q193-I216 HydrophobicContact CB-CG2 4.18Å
194A93.1Very high93.5Very high6 Ų667.7 Ų67.75%0.0534%0.344CS..Hα-helixtrans-95.3-4.9-18000000113.3V190 V196 T219 I220V190-A194 HydrophobicContact CG1-CB 4.46Å; V190-A194 WeakPolarHBondContact O-CA 3.14Å; V190-A194 WeakPolarHBondContact O-CB 3.28Å; V190-A194 PolarHBondContact O-N 3.23Å; A194-V196 HydrophobicContact CB-CG1 4.41Å; A194-V196 HydrophobicContact CB-CG2 4.36Å; A194-V196 PolarHBondContact O-N 3.17Å; A194-T219 HydrophobicContact CB-CG2 3.51Å; A194-I220 HydrophobicContact CB-CG1 3.76Å
195N91.3Very high93.6Very high147 Ų14761.7 Ų61.779%0.78632%0.316SS*.THydrogen-bonded Turntrans55.949.5177.8-150.387.2000112.7M191M191-N195 WeakPolarHBondContact O-CA 3.29Å; M191-N195 PolarHBondContact O-N 3.22Å
196V93Very high93.6Very high18 Ų1860.5 Ų60.511%0.10931%0.307CS..  trans-120.2162-178-65.90000112.9V190 M191 A194 K200 A201 T219V190-V196 HydrophobicContact CG1-CG2 4.12Å; M191-V196 WeakPolarHBondContact CG-O 3.17Å; M191-V196 PolarHBondContact O-N 3.06Å; A194-V196 HydrophobicContact CB-CG1 4.41Å; A194-V196 HydrophobicContact CB-CG2 4.36Å; A194-V196 PolarHBondContact O-N 3.17Å; V196-K200 HydrophobicContact CB-CB 4.08Å; V196-K200 HydrophobicContact CB-CD 3.95Å; V196-K200 HydrophobicContact CB-CG 4.08Å; V196-K200 HydrophobicContact CG1-CD 3.73Å; V196-K200 HydrophobicContact CG1-CG 4.22Å; V196-K200 HydrophobicContact CG2-CB 4.39Å; V196-K200 HydrophobicContact CG2-CG 4.44Å; V196-A201 HydrophobicContact CG2-CB 4.18Å; V196-T219 HydrophobicContact CB-CG2 4.04Å; V196-T219 HydrophobicContact CG1-CG2 3.22Å; V196-T219 HydrophobicContact CG2-CG2 3.73Å
197T93.6Very high93.5Very high94 Ų9468 Ų6858%0.57734%0.339SS*.  trans-66.6158.1173.258.80000111.7A199 K200 A201T197-A199 PolarHBondContact O-N 3.49Å; T197-K200 PolarHBondContact O-N 3.06Å; T197-A201 PolarHBondContact O-N 2.96Å
198R92.1Very high93.4Very high91 Ų9168.8 Ų68.834%0.34335%0.345SS..Hα-helixtrans-58.2-48.4-179.2-164.1-175.8177.3-9712.5112.1E177 I187 M191 K200 A201 I202E177-R198 VanDerWaalsContact OE2-CB 3.23Å; E177-R198 WeakPolarHBondContact OE2-CB 3.36Å; E177-R198 VanDerWaalsContact OE2-CD 3.24Å; E177-R198 WeakPolarHBondContact OE2-CD 3.28Å; E177-R198 WeakPolarHBondContact OE2-CG 3.19Å; E177-R198 IonicContact OE2-CZ 3.7Å; E177-R198 IonicContact OE2-NE 2.67Å; E177-R198 IonicContact OE2-NH1 3.48Å; E177-R198 PolarHBondContact OE2-NH1 2.91Å; I187-R198 HydrophobicContact CG2-CG 3.74Å; M191-R198 HydrophobicContact CE-CB 4.04Å; M191-R198 VanDerWaalsContact SD-CA 3.55Å; M191-R198 HydrophobicContact SD-CB 3.65Å; M191-R198 HydrophobicContact SD-CG 3.8Å; R198-K200 VanDerWaalsContact C-N 3.28Å; R198-K200 PolarHBondContact O-N 2.95Å; R198-A201 WeakPolarHBondContact O-CB 3.35Å; R198-A201 PolarHBondContact O-N 2.91Å; R198-I202 HydrophobicContact CG-CD1 4.24Å; R198-I202 WeakPolarHBondContact O-CG1 3.19Å; R198-I202 PolarHBondContact O-N 2.97Å
199A92.5Very high93.3Very high49 Ų4965.3 Ų65.341%0.40534%0.344SS..Hα-helixtrans-49.5-45.2170.200000113.6E177 T197 K203E177-A199 WeakPolarHBondContact OE1-CA 3.47Å; E177-A199 VanDerWaalsContact OE1-CB 3.29Å; E177-A199 WeakPolarHBondContact OE1-CB 3.5Å; E177-A199 PolarHBondContact OE1-N 2.98Å; E177-A199 PolarHBondContact OE2-N 3.43Å; E177-A199 VanDerWaalsContact OE2-N 3.15Å; T197-A199 PolarHBondContact O-N 3.49Å; A199-K203 VanDerWaalsContact O-CB 3.32Å; A199-K203 WeakPolarHBondContact O-CB 3.32Å; A199-K203 PolarHBondContact O-N 3.3Å
200K92.4Very high93.1Very high85 Ų8565.3 Ų65.337%0.3734%0.344SS..Hα-helixtrans-70.9-35.8-179-172.6168.8176.7-173.60111.7V196 T197 R198 A204V196-K200 HydrophobicContact CB-CB 4.08Å; V196-K200 HydrophobicContact CB-CD 3.95Å; V196-K200 HydrophobicContact CB-CG 4.08Å; V196-K200 HydrophobicContact CG1-CD 3.73Å; V196-K200 HydrophobicContact CG1-CG 4.22Å; V196-K200 HydrophobicContact CG2-CB 4.39Å; V196-K200 HydrophobicContact CG2-CG 4.44Å; T197-K200 PolarHBondContact O-N 3.06Å; R198-K200 VanDerWaalsContact C-N 3.28Å; R198-K200 PolarHBondContact O-N 2.95Å; K200-A204 WeakPolarHBondContact O-CB 3.35Å; K200-A204 PolarHBondContact O-N 2.9Å
201A93.2Very high93.2Very high0 Ų069 Ų690%036%0.364CS..Hα-helixtrans-65.3-47.1173.600000112.1I187 V190 M191 V196 T197 R198 K203 A204 L205I187-A201 HydrophobicContact CG2-CB 3.99Å; V190-A201 HydrophobicContact CB-CB 3.9Å; V190-A201 HydrophobicContact CG1-CB 3.68Å; M191-A201 HydrophobicContact CG-CB 3.74Å; V196-A201 HydrophobicContact CG2-CB 4.18Å; T197-A201 PolarHBondContact O-N 2.96Å; R198-A201 WeakPolarHBondContact O-CB 3.35Å; R198-A201 PolarHBondContact O-N 2.91Å; A201-K203 VanDerWaalsContact C-N 3.33Å; A201-K203 PolarHBondContact O-N 3Å; A201-A204 WeakPolarHBondContact O-CB 3.4Å; A201-A204 PolarHBondContact O-N 3.17Å; A201-A204 VanDerWaalsContact O-N 3.17Å; A201-L205 WeakPolarHBondContact O-CG 3.25Å; A201-L205 PolarHBondContact O-N 3.36Å
202I93.4Very high93.1Very high11 Ų1168.4 Ų68.46%0.05636%0.362CS..Hα-helixtrans-58.1-47.1175.6-70.6171.8000110.4E177 T179 I182 I187 R198 A204 L205 R206E177-I202 HydrophobicContact CB-CD1 3.85Å; E177-I202 VanDerWaalsContact OE2-CD1 3.3Å; E177-I202 WeakPolarHBondContact OE2-CD1 3.38Å; T179-I202 HydrophobicContact CG2-CD1 4.2Å; I182-I202 HydrophobicContact CD1-CB 4.37Å; I182-I202 HydrophobicContact CD1-CG2 3.77Å; I187-I202 HydrophobicContact CD1-CD1 4.2Å; I187-I202 HydrophobicContact CD1-CG1 3.74Å; I187-I202 HydrophobicContact CG1-CG1 4.11Å; I187-I202 HydrophobicContact CG2-CG1 4.24Å; R198-I202 HydrophobicContact CG-CD1 4.24Å; R198-I202 WeakPolarHBondContact O-CG1 3.19Å; R198-I202 PolarHBondContact O-N 2.97Å; I202-A204 VanDerWaalsContact C-N 3.32Å; I202-A204 PolarHBondContact O-N 3.32Å; I202-L205 PolarHBondContact O-N 2.93Å; I202-R206 WeakPolarHBondContact O-CG 3.41Å; I202-R206 PolarHBondContact O-N 3.41Å
203K92.7Very high93.2Very high161 Ų16169.7 Ų69.770%0.737%0.366SS*.Hα-helixtrans-61.4-40177.2-173173.8-175.5169.90112.4A199 A201 K207A199-K203 VanDerWaalsContact O-CB 3.32Å; A199-K203 WeakPolarHBondContact O-CB 3.32Å; A199-K203 PolarHBondContact O-N 3.3Å; A201-K203 VanDerWaalsContact C-N 3.33Å; A201-K203 PolarHBondContact O-N 3Å; K203-K207 VanDerWaalsContact O-CB 3.31Å; K203-K207 WeakPolarHBondContact O-CB 3.42Å; K203-K207 PolarHBondContact O-N 3.23Å
204A93.7Very high93.3Very high15 Ų1567.3 Ų67.312%0.12436%0.357CS..Hα-helixtrans-65.2-45.9177.100000111.7K200 A201 I202 K207 S208 A215 T219K200-A204 WeakPolarHBondContact O-CB 3.35Å; K200-A204 PolarHBondContact O-N 2.9Å; A201-A204 WeakPolarHBondContact O-CB 3.4Å; A201-A204 PolarHBondContact O-N 3.17Å; A201-A204 VanDerWaalsContact O-N 3.17Å; I202-A204 VanDerWaalsContact C-N 3.32Å; I202-A204 PolarHBondContact O-N 3.32Å; A204-K207 PolarHBondContact O-N 2.9Å; A204-S208 WeakPolarHBondContact O-CB 3.35Å; A204-S208 PolarHBondContact O-N 3.32Å; A204-S208 PolarHBondContact O-OG 3.19Å; A204-A215 HydrophobicContact CB-CB 4.17Å; A204-T219 VanDerWaalsContact CB-OG1 3.29Å; A204-T219 WeakPolarHBondContact CB-OG1 3.06Å
205L95.5Very high93.4Very high0 Ų067 Ų670%036%0.355CS..Hα-helixtrans-64.8-42178.3-72.2164000112.1I182 D186 I187 V190 A201 I202 K207 S208 G209 N210 L212 A215I182-L205 HydrophobicContact CD1-CB 4.37Å; I182-L205 HydrophobicContact CG2-CB 4.15Å; I182-L205 HydrophobicContact CG2-CD1 3.57Å; I182-L205 HydrophobicContact CG2-CG 4.42Å; D186-L205 HydrophobicContact CB-CD1 3.95Å; D186-L205 HydrophobicContact CB-CD2 4.16Å; I187-L205 HydrophobicContact CB-CD1 4.43Å; I187-L205 HydrophobicContact CG1-CD1 3.8Å; V190-L205 HydrophobicContact CG2-CD1 4.16Å; V190-L205 HydrophobicContact CG2-CD2 3.99Å; V190-L205 HydrophobicContact CG2-CG 4.06Å; A201-L205 WeakPolarHBondContact O-CG 3.25Å; A201-L205 PolarHBondContact O-N 3.36Å; I202-L205 PolarHBondContact O-N 2.93Å; L205-K207 VanDerWaalsContact C-N 3.34Å; L205-K207 PolarHBondContact O-N 3.23Å; L205-S208 PolarHBondContact O-N 3.39Å; L205-S208 PolarHBondContact O-OG 3.33Å; L205-G209 PolarHBondContact O-N 2.81Å; L205-N210 PolarHBondContact O-N 3.3Å; L205-L212 HydrophobicContact CD2-CD2 4.29Å; L205-A215 HydrophobicContact CD2-CB 3.76Å; L205-A215 HydrophobicContact CG-CB 4.17Å
206R92.6Very high93.5Very high114 Ų11461 Ų6143%0.4332%0.322SS..Hα-helixtrans-61.5-43.9174.2-73.4-178.6169.3-162.9-18.8111.9D178 I182 I202 S208 G209D178-R206 VanDerWaalsContact O-CZ 3.24Å; D178-R206 PolarHBondContact O-NH2 2.92Å; D178-R206 IonicContact OD1-NH2 3.05Å; D178-R206 PolarHBondContact OD1-NH2 3.3Å; D178-R206 IonicContact OD2-CZ 3.76Å; D178-R206 IonicContact OD2-NH1 3.76Å; D178-R206 PolarHBondContact OD2-NH1 3.06Å; D178-R206 IonicContact OD2-NH2 2.63Å; D178-R206 PolarHBondContact OD2-NH2 3.05Å; I182-R206 HydrophobicContact CD1-CG 3.68Å; I202-R206 WeakPolarHBondContact O-CG 3.41Å; I202-R206 PolarHBondContact O-N 3.41Å; R206-S208 VanDerWaalsContact C-N 3.32Å; R206-S208 PolarHBondContact O-N 3.34Å; R206-G209 PolarHBondContact O-N 3.2Å
207K93.3Very high93.6Very high180 Ų18064.8 Ų64.878%0.78334%0.34SS*.Hα-helixtrans-68-32.5-179.9-170.9178.4-179.9-1750112.3K203 A204 L205K203-K207 VanDerWaalsContact O-CB 3.31Å; K203-K207 WeakPolarHBondContact O-CB 3.42Å; K203-K207 PolarHBondContact O-N 3.23Å; A204-K207 PolarHBondContact O-N 2.9Å; L205-K207 VanDerWaalsContact C-N 3.34Å; L205-K207 PolarHBondContact O-N 3.23Å
208S92.3Very high93.5Very high21 Ų2162.6 Ų62.615%0.14733%0.326CS..Hα-helixtrans-88-0.2177.670.50000113.8A204 L205 R206 D211A204-S208 WeakPolarHBondContact O-CB 3.35Å; A204-S208 PolarHBondContact O-N 3.32Å; A204-S208 PolarHBondContact O-OG 3.19Å; L205-S208 PolarHBondContact O-N 3.39Å; L205-S208 PolarHBondContact O-OG 3.33Å; R206-S208 VanDerWaalsContact C-N 3.32Å; R206-S208 PolarHBondContact O-N 3.34Å; S208-D211 WeakPolarHBondContact CB-O 3.5Å; S208-D211 WeakPolarHBondContact O-CB 3.44Å; S208-D211 PolarHBondContact O-N 3.47Å; S208-D211 PolarHBondContact OG-N 3.46Å; S208-D211 PolarHBondContact OG-O 3.01Å
209G92.6Very high93.6Very high58 Ų5858.5 Ų58.560%0.59831%0.311SS*.THydrogen-bonded Turntrans64.144.3-176.400000112.6L205 R206 D211L205-G209 PolarHBondContact O-N 2.81Å; R206-G209 PolarHBondContact O-N 3.2Å; G209-D211 PolarHBondContact O-N 2.95Å
210N91.9Very high93.6Very high66 Ų6659 Ų5935%0.35331%0.307SS..THydrogen-bonded Turntrans62.814.1-175.3-58.579.1000114.5G181 L205 L212G181-N210 PolarHBondContact O-ND2 3.29Å; L205-N210 PolarHBondContact O-N 3.3Å; N210-L212 PolarHBondContact O-N 3.15Å; N210-L212 VanDerWaalsContact O-N 3.15Å
211D96.2Very high93.6Very high78 Ų7859.7 Ų59.742%0.41731%0.314SS..  trans-73106.9169-178.8-16.7000109.7S208 G209 V213 N214 A215S208-D211 WeakPolarHBondContact CB-O 3.5Å; S208-D211 WeakPolarHBondContact O-CB 3.44Å; S208-D211 PolarHBondContact O-N 3.47Å; S208-D211 PolarHBondContact OG-N 3.46Å; S208-D211 PolarHBondContact OG-O 3.01Å; G209-D211 PolarHBondContact O-N 2.95Å; D211-V213 PolarHBondContact OD1-N 2.84Å; D211-N214 HydrophobicContact CB-CB 3.98Å; D211-N214 VanDerWaalsContact CG-CB 3.45Å; D211-N214 PolarHBondContact OD1-N 3.01Å; D211-N214 WeakPolarHBondContact OD2-CB 3.31Å; D211-A215 WeakPolarHBondContact O-CB 3.46Å; D211-A215 PolarHBondContact O-N 2.93Å
212L93.5Very high93.4Very high51 Ų5164.5 Ų64.527%0.26734%0.339SS..Hα-helixtrans-56-48.8177-82.8168.5000113.3D186 L189 L205 N210 A215 I216D186-L212 HydrophobicContact CB-CD2 3.46Å; D186-L212 VanDerWaalsContact CB-CD2 3.46Å; D186-L212 HydrophobicContact CB-CG 4.27Å; D186-L212 VanDerWaalsContact CG-CD2 3.46Å; D186-L212 WeakPolarHBondContact OD1-CD1 3.3Å; D186-L212 WeakPolarHBondContact OD1-CD2 3.46Å; L189-L212 HydrophobicContact CD2-CD2 4.11Å; L205-L212 HydrophobicContact CD2-CD2 4.29Å; N210-L212 PolarHBondContact O-N 3.15Å; N210-L212 VanDerWaalsContact O-N 3.15Å; L212-A215 PolarHBondContact O-N 2.77Å; L212-I216 WeakPolarHBondContact O-CB 3.36Å; L212-I216 WeakPolarHBondContact O-CG1 3.45Å; L212-I216 PolarHBondContact O-N 2.68Å
213V95Very high92.9Very high111 Ų11167 Ų6767%0.67336%0.358SS*.Hα-helixtrans-70.5-43.6-173178.60000109.3D211 I216 M217D211-V213 PolarHBondContact OD1-N 2.84Å; V213-I216 PolarHBondContact O-N 3.33Å; V213-M217 WeakPolarHBondContact O-CB 3.34Å; V213-M217 PolarHBondContact O-N 2.71Å
214N94.6Very high92.4Very high57 Ų5766 Ų6631%0.30536%0.359SS..Hα-helixtrans-66.4-40.3176.4-170.532.4000111.6D211 I216 M217 V218D211-N214 HydrophobicContact CB-CB 3.98Å; D211-N214 VanDerWaalsContact CG-CB 3.45Å; D211-N214 PolarHBondContact OD1-N 3.01Å; D211-N214 WeakPolarHBondContact OD2-CB 3.31Å; N214-I216 PolarHBondContact O-N 3.19Å; N214-M217 PolarHBondContact O-N 2.74Å; N214-V218 VanDerWaalsContact O-CB 3.3Å; N214-V218 WeakPolarHBondContact O-CB 3Å; N214-V218 VanDerWaalsContact O-CG2 3.25Å; N214-V218 WeakPolarHBondContact O-CG2 3.29Å; N214-V218 PolarHBondContact O-N 2.77Å; N214-V218 WeakPolarHBondContact OD1-CG2 3.44Å
215A95.2Very high91.4Very high1 Ų172.6 Ų72.61%0.00841%0.405CS..Hα-helixtrans-58.6-49.1174.100000111.4V190 A204 L205 D211 L212 T219V190-A215 HydrophobicContact CG2-CB 4.02Å; A204-A215 HydrophobicContact CB-CB 4.17Å; L205-A215 HydrophobicContact CD2-CB 3.76Å; L205-A215 HydrophobicContact CG-CB 4.17Å; D211-A215 WeakPolarHBondContact O-CB 3.46Å; D211-A215 PolarHBondContact O-N 2.93Å; L212-A215 PolarHBondContact O-N 2.77Å; A215-T219 WeakPolarHBondContact O-CB 3.24Å; A215-T219 PolarHBondContact O-N 2.92Å; A215-T219 PolarHBondContact O-OG1 2.96Å
216I95.1Very high91.2Very high19 Ų1976.3 Ų76.310%0.09743%0.425CS..Hα-helixtrans-65-48.2-180-67.5170000110.6L189 V190 Q193 L212 V213 N214 T219 I220L189-I216 HydrophobicContact CD2-CD1 4.27Å; L189-I216 HydrophobicContact CG-CD1 4.24Å; V190-I216 HydrophobicContact CB-CG1 4.37Å; V190-I216 HydrophobicContact CG2-CD1 4.46Å; V190-I216 HydrophobicContact CG2-CG1 3.78Å; Q193-I216 HydrophobicContact CB-CD1 4.35Å; Q193-I216 HydrophobicContact CB-CG2 4.18Å; L212-I216 WeakPolarHBondContact O-CB 3.36Å; L212-I216 WeakPolarHBondContact O-CG1 3.45Å; L212-I216 PolarHBondContact O-N 2.68Å; V213-I216 PolarHBondContact O-N 3.33Å; N214-I216 PolarHBondContact O-N 3.19Å; I216-T219 PolarHBondContact O-N 2.69Å; I216-I220 HydrophobicContact CG2-CD1 3.6Å; I216-I220 HydrophobicContact CG2-CG1 4.36Å; I216-I220 WeakPolarHBondContact O-CB 3.23Å; I216-I220 VanDerWaalsContact O-CG1 3.3Å; I216-I220 WeakPolarHBondContact O-CG1 3.3Å; I216-I220 PolarHBondContact O-N 2.68Å
217M94.6Very high91.2Very high99 Ų9974.3 Ų74.349%0.48843%0.425SS..Hα-helixtrans-59.2-51.8-179.9-177.5-178.768.900111.5V213 N214 T219 I220 L221V213-M217 WeakPolarHBondContact O-CB 3.34Å; V213-M217 PolarHBondContact O-N 2.71Å; N214-M217 PolarHBondContact O-N 2.74Å; M217-T219 VanDerWaalsContact C-N 3.27Å; M217-T219 PolarHBondContact O-N 2.79Å; M217-I220 PolarHBondContact O-N 3.48Å; M217-L221 HydrophobicContact CG-CD1 3.81Å; M217-L221 HydrophobicContact CG-CG 4.37Å; M217-L221 WeakPolarHBondContact O-CB 3.49Å; M217-L221 WeakPolarHBondContact O-CG 3.17Å; M217-L221 PolarHBondContact O-N 2.61Å
218V91.7Very high91Very high48 Ų4868.4 Ų68.429%0.29141%0.405SS..Hα-helixtrans-63.4-36.8179.6171.90000111.1N214 N222N214-V218 VanDerWaalsContact O-CB 3.3Å; N214-V218 WeakPolarHBondContact O-CB 3Å; N214-V218 VanDerWaalsContact O-CG2 3.25Å; N214-V218 WeakPolarHBondContact O-CG2 3.29Å; N214-V218 PolarHBondContact O-N 2.77Å; N214-V218 WeakPolarHBondContact OD1-CG2 3.44Å; V218-N222 VanDerWaalsContact O-CB 3.29Å; V218-N222 WeakPolarHBondContact O-CB 3.27Å; V218-N222 PolarHBondContact O-N 3.1Å
219T92.8Very high91Very high4 Ų471.2 Ų71.23%0.02542%0.42CS..Hα-helixtrans-70-41.1-179.3-57.10000112.1A194 V196 A204 A215 I216 M217 S223A194-T219 HydrophobicContact CB-CG2 3.51Å; V196-T219 HydrophobicContact CB-CG2 4.04Å; V196-T219 HydrophobicContact CG1-CG2 3.22Å; V196-T219 HydrophobicContact CG2-CG2 3.73Å; A204-T219 VanDerWaalsContact CB-OG1 3.29Å; A204-T219 WeakPolarHBondContact CB-OG1 3.06Å; A215-T219 WeakPolarHBondContact O-CB 3.24Å; A215-T219 PolarHBondContact O-N 2.92Å; A215-T219 PolarHBondContact O-OG1 2.96Å; I216-T219 PolarHBondContact O-N 2.69Å; M217-T219 VanDerWaalsContact C-N 3.27Å; M217-T219 PolarHBondContact O-N 2.79Å; T219-S223 PolarHBondContact O-N 3.38Å
220I94.3Very high90.9Very high60 Ų6072 Ų7231%0.30841%0.409SS..Hα-helixtrans-67.7-43.8174.2-67.9172000110.6A194 I216 M217 N222 S223 L224A194-I220 HydrophobicContact CB-CG1 3.76Å; I216-I220 HydrophobicContact CG2-CD1 3.6Å; I216-I220 HydrophobicContact CG2-CG1 4.36Å; I216-I220 WeakPolarHBondContact O-CB 3.23Å; I216-I220 VanDerWaalsContact O-CG1 3.3Å; I216-I220 WeakPolarHBondContact O-CG1 3.3Å; I216-I220 PolarHBondContact O-N 2.68Å; M217-I220 PolarHBondContact O-N 3.48Å; I220-N222 VanDerWaalsContact C-N 3.28Å; I220-N222 PolarHBondContact O-N 2.93Å; I220-S223 PolarHBondContact O-N 3.28Å; I220-S223 VanDerWaalsContact O-N 3.08Å; I220-S223 PolarHBondContact O-OG 3.3Å; I220-L224 HydrophobicContact CG2-CD1 3.89Å; I220-L224 HydrophobicContact CG2-CG 4.38Å; I220-L224 WeakPolarHBondContact O-CG 3.08Å; I220-L224 PolarHBondContact O-N 3.07Å; I220-L224 VanDerWaalsContact O-N 3.11Å
221L92.1Very high90.8Very high100 Ų10072.4 Ų72.452%0.52441%0.413SS..Hα-helixtrans-62-38.1177.7-71.5173.6000111.7M217 S223 L224 S225M217-L221 HydrophobicContact CG-CD1 3.81Å; M217-L221 HydrophobicContact CG-CG 4.37Å; M217-L221 WeakPolarHBondContact O-CB 3.49Å; M217-L221 WeakPolarHBondContact O-CG 3.17Å; M217-L221 PolarHBondContact O-N 2.61Å; L221-S223 VanDerWaalsContact C-N 3.3Å; L221-S223 PolarHBondContact O-N 3.01Å; L221-L224 PolarHBondContact O-N 3.12Å; L221-S225 PolarHBondContact O-N 3.19Å
222N88.4Confident90.4Very high100 Ų10072 Ų7254%0.53541%0.413SS..Hα-helixtrans-72.4-17.6175.5-74.2-5.8000114V218 I220V218-N222 VanDerWaalsContact O-CB 3.29Å; V218-N222 WeakPolarHBondContact O-CB 3.27Å; V218-N222 PolarHBondContact O-N 3.1Å; I220-N222 VanDerWaalsContact C-N 3.28Å; I220-N222 PolarHBondContact O-N 2.93Å
223S82.9Confident90.2Very high64 Ų6473.6 Ų73.645%0.44842%0.424SS..Hα-helixtrans-91.9-16.717567.40000113.1T219 I220 L221T219-S223 PolarHBondContact O-N 3.38Å; I220-S223 PolarHBondContact O-N 3.28Å; I220-S223 VanDerWaalsContact O-N 3.08Å; I220-S223 PolarHBondContact O-OG 3.3Å; L221-S223 VanDerWaalsContact C-N 3.3Å; L221-S223 PolarHBondContact O-N 3.01Å
224L83.2Confident89.8Confident139 Ų13970.5 Ų70.573%0.72840%0.403SS*.Hα-helixtrans-93.6-11.3176.2-66176.9000113.8I220 L221I220-L224 HydrophobicContact CG2-CD1 3.89Å; I220-L224 HydrophobicContact CG2-CG 4.38Å; I220-L224 WeakPolarHBondContact O-CG 3.08Å; I220-L224 PolarHBondContact O-N 3.07Å; I220-L224 VanDerWaalsContact O-N 3.11Å; L221-L224 PolarHBondContact O-N 3.12Å
225S72.6Confident89.4Confident155 Ų15571.7 Ų71.7100%1.08441%0.412SS*.  trans-92.80175-173.50000111.9L221L221-S225 PolarHBondContact O-N 3.19Å

Retrieved 225 of 225 residues in 362.8 ms (Link to these results)