A0A087XMI1_POEFO Loading...

Proton-activated chloride channel

AlphaFold DB , UniProt , Accession A0A087XMI1, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 355 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
1M25.4Very low29.4Very low243 Ų243161.1 Ų161.1100%1.19784%0.84SS**  0146.80-89.4-171.9168.700108.5
2P34.2Very low29.3Very low133 Ų133163.1 Ų163.186%0.86484%0.842SS**  trans-81.8173.8-137.437-37.3000113.1
3G32.8Very low29.1Very low74 Ų74164.5 Ų164.576%0.76384%0.838SS**  cis-168.2177.418.500000114.4
4T32.8Very low29Very low131 Ų131163 Ų16380%0.80483%0.833SS**  trans-111.2153.8-156.7-21.30000111.3
5R28.9Very low29.1Very low211 Ų211160.7 Ų160.780%0.79682%0.823SS**  trans69.2156.3153.9-87.4-177.3165.4173.3-1.2116.8
6N30.3Very low29.3Very low113 Ų113161.4 Ų161.460%0.60482%0.822SS**  cis-160.8140.117.4-116.5-15.7000108.1
7R28.8Very low29.4Very low227 Ų227159.3 Ų159.386%0.85781%0.813SS**  43.6106.7100.7-79.6-174.7172.3-174.5-2.3115.7
8S26.5Very low29.5Very low133 Ų133164 Ų16493%0.9382%0.821SS**  trans-72.4123157.8177.90000109.1
9S27.3Very low29.6Very low99 Ų99165.4 Ų165.469%0.69283%0.825SS**  trans-125.6141.5176.3175.90000108.6
10Y26.2Very low29.6Very low234 Ų234161.1 Ų161.192%0.91883%0.825SS**  trans-30.8138.4169.4-66.8-93.2000115.3
11Q30.4Very low29.6Very low174 Ų174159.9 Ų159.981%0.81382%0.82SS**  trans-114.1115.2166.3-162.7152-1.600110
12Q28.3Very low29.8Very low185 Ų185157 Ų15786%0.86480%0.803SS**  trans-88.1138.1174.4-171.3169.811.200107.9
13F26.6Very low29.4Very low181 Ų181154.4 Ų154.479%0.79480%0.801SS**  trans-111.9122.8174.1-90.9-88.6000108.8
14N27.5Very low29.1Very low144 Ų144159 Ų15977%0.7781%0.808SS**  trans-167.9147160.2-98.226.8000102.7
15D31Very low28.8Very low128 Ų128156.1 Ų156.168%0.68481%0.805SS**  cis-163.9-172-12.2-101.3-39000103.5
16E32.3Very low28.7Very low173 Ų173155 Ų15581%0.80881%0.809SS**  trans89134.6165.4-51.1179.1-169.100115.6
17D30.5Very low28.5Very low125 Ų125154.9 Ų154.967%0.66882%0.817SS**  cis-173.8162.1-8.5-100.9-29000104.8
18Y30.7Very low28.6Very low244 Ų244152.9 Ų152.996%0.95782%0.817SS**  trans-174.4120.9133.9-93-64.8000110.8
19E32.7Very low28.7Very low191 Ų191153.9 Ų153.989%0.89381%0.812SS**  trans-66.3151.4178.1-55.9-176.914200113.7
20G28.3Very low28.6Very low79 Ų79153.8 Ų153.881%0.81481%0.812SS**  129.5151.79400000107.8
21D30.9Very low28.9Very low136 Ų136150.6 Ų150.673%0.72781%0.809SS**  cis-168.615217.9-171.726.8000110.8
22E29.5Very low28.9Very low181 Ų181148.7 Ų148.785%0.84680%0.804SS**  trans39.1138153.1-81.2170.7-163.900126.9
23G25.5Very low28.9Very low80 Ų80148 Ų14883%0.82581%0.807SS**  trans167.884.2158.700000116
24N26.8Very low29.3Very low169 Ų169145.5 Ų145.590%0.90481%0.805SS**  trans-57.3148.7-177.5-165.716000116.2
25G24.7Very low29.4Very low72 Ų72146.2 Ų146.274%0.74281%0.81SS**  trans172.789.9173.300000115.2
26Q27.2Very low29.4Very low186 Ų186149.3 Ų149.387%0.86982%0.82SS**  trans-70.3128.7179.2-172.9175.30.200113.2
27S26.7Very low29.4Very low112 Ų112149.6 Ų149.678%0.78382%0.821SS**  trans-162.7117149.248.20000111.2
28Q31.4Very low29.3Very low185 Ų185150 Ų15086%0.86483%0.829SS**  trans-54131.8160.9-71.3161-56.400109.4
29D27.1Very low29.3Very low154 Ų154144.6 Ų144.682%0.82482%0.82SS**  trans-154.5161.3140-138-13.2000112
30S25.7Very low29.2Very low97 Ų97141.3 Ų141.368%0.67882%0.816SS**  trans-98.6144.8-133.2-45.60000111.8D32S30-D32 PolarHBondContact O-N 3.28Å
31I33.9Very low29.3Very low166 Ų166144.1 Ų144.185%0.85182%0.817SS**  trans-75.6110.5166.1-66.8167.2000106.7
32D29.3Very low29.2Very low135 Ų135146.7 Ų146.772%0.72282%0.824SS**  trans-164.4114.6150.7-95.8-27.6000108.3S30S30-D32 PolarHBondContact O-N 3.28Å
33D29Very low29Very low171 Ų171143.5 Ų143.591%0.91482%0.822SS**  trans-155.5100.7148.2-97.2-27.9000107.7
34V34.5Very low29.1Very low127 Ų127147.5 Ų147.577%0.7782%0.824SS**  trans-72.4132.2175.9169.60000108.6E36V34-E36 PolarHBondContact O-N 2.81Å; V34-E36 VanDerWaalsContact O-N 3.16Å
35D29.6Very low29Very low160 Ų160143 Ų14386%0.85682%0.818SS**  trans-55.7112.9170.1-76.5-53.4000110.6E37D35-E37 PolarHBondContact O-N 2.98Å
36E30.4Very low29.1Very low193 Ų193147.1 Ų147.190%0.90282%0.823SS**  trans-82.796.3170.3-159.4175.8-157.700108.8V34V34-E36 PolarHBondContact O-N 2.81Å; V34-E36 VanDerWaalsContact O-N 3.16Å
37E31.8Very low29.2Very low178 Ų178145.2 Ų145.283%0.83282%0.824SS**  trans-83.9116.3172.3-151.5174.1-155.200109.5D35D35-E37 PolarHBondContact O-N 2.98Å
38T29.8Very low29.4Very low135 Ų135149.8 Ų149.883%0.82882%0.824SS**  trans-46.3126.517744.10000114.6
39V29.7Very low29.4Very low129 Ų129147.6 Ų147.678%0.78281%0.814SS**  trans-119.9138.9162.1-177.20000108.7
40P30.7Very low29.6Very low122 Ų122147.3 Ų147.379%0.79281%0.807SS**  trans-75.4147.5-174.5-3.320.6000112.4E42P40-E42 PolarHBondContact O-N 3Å
41V31.2Very low29.8Very low138 Ų138149.1 Ų149.184%0.83681%0.81SS**  trans-65.6120174.8176.70000110.6
42E28.4Very low29.7Very low190 Ų190148.1 Ų148.189%0.88881%0.806SS**  trans-118.6130153.3-84.5-171.916600110P40P40-E42 PolarHBondContact O-N 3Å
43S26.3Very low29.8Very low114 Ų114150.7 Ų150.780%0.79782%0.816SS**  trans-69.1126.1-171.9179.10000112.2
44N26.1Very low30.1Very low164 Ų164154.4 Ų154.488%0.87782%0.817SS**  trans-104.3107.8167.9-98.9-11.7000110.1
45G25.4Very low30.1Very low75 Ų75151.5 Ų151.577%0.77381%0.813SS**  trans-90.2127.5162.100000110.7
46N27.4Very low30.7Very low158 Ų158151.8 Ų151.885%0.84581%0.814SS**  trans-63.5147.4176.8-66.6-30.4000113.3
47V28.6Very low31.3Very low147 Ų147147.9 Ų147.989%0.89181%0.809SS**  -162.4141124.9171.60000110.8
48R31.2Very low32.3Very low208 Ų208144.5 Ų144.579%0.78580%0.802SS**  trans-46.6141.6179.3-90.5177.3164.6-174.7-7.1118.9
49Q31Very low33.3Very low138 Ų138142.2 Ų142.265%0.64579%0.79SS**  77.8126.499.1-135.3-167.8-41.100112
50E31.1Very low34.5Very low148 Ų148147.5 Ų147.569%0.69280%0.795SS**  cis-162.1152.748.3-81.7172163.100113.3
51D31.2Very low35.7Very low136 Ų136152.4 Ų152.473%0.72780%0.798SS**  trans67.4119.5141.1-66.2-4.9000126.9
52D31.5Very low36.6Very low145 Ų145154 Ų15478%0.77579%0.794SS**  trans64.5109.4133.3-75.3-15.5000122.4
53M31.7Very low38.3Very low188 Ų188147.9 Ų147.993%0.92677%0.772SS**  -166.9118.9110.7-97.9-139.8-156.300112.6
54R35.6Very low40.1Very low249 Ų249149.4 Ų149.494%0.9477%0.765SS**  trans15.3108.3143.8-94.9174168.7-162.5-2117.8
55G33.3Very low42.3Very low66 Ų66145.9 Ų145.968%0.6875%0.749SS**  trans-160.173.8162.400000111S57G55-S57 PolarHBondContact O-N 2.73Å
56N42.6Very low44.6Very low166 Ų166146.1 Ų146.189%0.88874%0.738SS**  trans-58.9105178.1-162.546.9000110.4
57S43.6Very low47.1Very low112 Ų112144.6 Ų144.678%0.78373%0.727SS**  trans-147.5105.8167.945.90000112.8G55G55-S57 PolarHBondContact O-N 2.73Å
58P52Low49.8Very low107 Ų107144.3 Ų144.370%0.69571%0.714SS**  trans-118151.9144.634.5-23.1000110.5
59P51.2Low52.4Low87 Ų87139 Ų13957%0.56570%0.701SS**  cis-131.511717.234.4-14000114R61 F62P59-R61 PolarHBondContact O-N 3.16Å; P59-F62 HydrophobicContact CB-CD2 4.14Å; P59-F62 HydrophobicContact CG-CD2 4.28Å
60R55.3Low55.1Low239 Ų239136.8 Ų136.890%0.90270%0.697SS**THydrogen-bonded Turntrans-8213.1164.4-104.7-177.5178.5-177.80.4114
61R54.3Low57.9Low226 Ų226135.6 Ų135.685%0.85369%0.689SS**THydrogen-bonded Turntrans-103.2-14.9178.2-74.7-174179.8177.60.2114.6P59P59-R61 PolarHBondContact O-N 3.16Å
62F51.3Low60.6Low172 Ų172132.6 Ų132.675%0.75468%0.676SS**SBendtrans-86.4-11.5179.7-94.4-86.8000114.9P59P59-F62 HydrophobicContact CB-CD2 4.14Å; P59-F62 HydrophobicContact CG-CD2 4.28Å
63S63Low63.5Low60 Ų60129.3 Ų129.342%0.4266%0.661SS.*Hα-helixtrans-91-22.1179.767.80000114.4M67S63-M67 WeakPolarHBondContact O-CB 3.15Å; S63-M67 PolarHBondContact O-N 2.98Å
64K65.1Low66.5Low147 Ų147124.6 Ų124.664%0.63964%0.639SS**Hα-helixtrans-68.3-40.4-178.5-87.5-174.3176.7-179.10112.6K68K64-K68 VanDerWaalsContact O-CB 3.31Å; K64-K68 WeakPolarHBondContact O-CB 3.46Å; K64-K68 WeakPolarHBondContact O-CG 3.38Å; K64-K68 PolarHBondContact O-N 3.25Å
65T72.4Confident69.2Low89 Ų89115.7 Ų115.755%0.54661%0.61SS.*Hα-helixtrans-73.3-40.5180-46.90000111.4K68 N69T65-K68 PolarHBondContact O-N 3.38Å; T65-N69 WeakPolarHBondContact O-CB 3.49Å; T65-N69 PolarHBondContact O-N 2.91Å; T65-N69 PolarHBondContact O-OD1 3Å
66C72.4Confident72.1Confident80 Ų80116.8 Ų116.854%0.54160%0.6SS.*Hα-helixtrans-62.6-45.2173.2-173.50000111.4K68 N69 V70C66-K68 PolarHBondContact O-N 3.1Å; C66-N69 PolarHBondContact O-N 3.39Å; C66-V70 VanDerWaalsContact O-CG2 3.29Å; C66-V70 WeakPolarHBondContact O-CG2 3.22Å; C66-V70 PolarHBondContact O-N 3.25Å
67M81.1Confident74.6Confident127 Ų127114.8 Ų114.863%0.62658%0.583SS**Hα-helixtrans-65.5-38.4177.2-170.1-175.7-61.200112.6S63 F71S63-M67 WeakPolarHBondContact O-CB 3.15Å; S63-M67 PolarHBondContact O-N 2.98Å; M67-F71 VanDerWaalsContact O-CB 3.28Å; M67-F71 WeakPolarHBondContact O-CB 3.36Å; M67-F71 PolarHBondContact O-N 3.26Å
68K85.3Confident77Confident141 Ų141113.2 Ų113.261%0.61357%0.565SS**Hα-helixtrans-62-46.7171.7-79.9177177.9-171.30111.3K64 T65 C66 V70 F71 T72K64-K68 VanDerWaalsContact O-CB 3.31Å; K64-K68 WeakPolarHBondContact O-CB 3.46Å; K64-K68 WeakPolarHBondContact O-CG 3.38Å; K64-K68 PolarHBondContact O-N 3.25Å; T65-K68 PolarHBondContact O-N 3.38Å; C66-K68 PolarHBondContact O-N 3.1Å; K68-V70 PolarHBondContact O-N 2.78Å; K68-F71 PolarHBondContact O-N 3.45Å; K68-T72 WeakPolarHBondContact O-CB 3.11Å; K68-T72 PolarHBondContact O-N 2.81Å; K68-T72 PolarHBondContact O-OG1 2.78Å
69N84.8Confident78.9Confident96 Ų96115.2 Ų115.251%0.51356%0.56SS.*Hα-helixtrans-63.5-42.8178.9-68.7-5.5000111.8T65 C66 F71 T72 V73T65-N69 WeakPolarHBondContact O-CB 3.49Å; T65-N69 PolarHBondContact O-N 2.91Å; T65-N69 PolarHBondContact O-OD1 3Å; C66-N69 PolarHBondContact O-N 3.39Å; N69-F71 VanDerWaalsContact C-N 3.34Å; N69-F71 PolarHBondContact O-N 3.3Å; N69-T72 PolarHBondContact O-N 3.43Å; N69-V73 WeakPolarHBondContact O-CB 3.28Å; N69-V73 VanDerWaalsContact O-CG2 3.27Å; N69-V73 WeakPolarHBondContact O-CG2 3.07Å; N69-V73 PolarHBondContact O-N 3.22Å
70V88.1Confident80.9Confident92 Ų92116.1 Ų116.156%0.55856%0.559SS**Hα-helixtrans-62.1-43174.61720000110.8C66 K68 V73 L74C66-V70 VanDerWaalsContact O-CG2 3.29Å; C66-V70 WeakPolarHBondContact O-CG2 3.22Å; C66-V70 PolarHBondContact O-N 3.25Å; K68-V70 PolarHBondContact O-N 2.78Å; V70-V73 PolarHBondContact O-N 3.4Å; V70-L74 VanDerWaalsContact O-CB 3.32Å; V70-L74 WeakPolarHBondContact O-CB 3.33Å; V70-L74 PolarHBondContact O-N 2.91Å
71F89.1Confident82.8Confident122 Ų122109 Ų10954%0.53554%0.542SS..Hα-helixtrans-66.5-39.1176.9-162.9-101.3000112M67 K68 N69 L74 L75M67-F71 VanDerWaalsContact O-CB 3.28Å; M67-F71 WeakPolarHBondContact O-CB 3.36Å; M67-F71 PolarHBondContact O-N 3.26Å; K68-F71 PolarHBondContact O-N 3.45Å; N69-F71 VanDerWaalsContact C-N 3.34Å; N69-F71 PolarHBondContact O-N 3.3Å; F71-L74 PolarHBondContact O-N 3.33Å; F71-L75 HydrophobicContact CD1-CD1 3.66Å; F71-L75 HydrophobicContact CD1-CG 4.03Å; F71-L75 HydrophobicContact CE1-CD1 3.6Å; F71-L75 HydrophobicContact CE1-CD2 4.2Å; F71-L75 HydrophobicContact CE1-CG 3.93Å; F71-L75 WeakPolarHBondContact O-CB 3.42Å; F71-L75 VanDerWaalsContact O-CG 3.25Å; F71-L75 WeakPolarHBondContact O-CG 3.35Å; F71-L75 PolarHBondContact O-N 3.01Å
72T89.7Confident84.8Confident74 Ų74103.2 Ų103.245%0.45453%0.528SS..Hα-helixtrans-62.6-45.8173.9-60.40000111.2K68 N69 L75 I76K68-T72 WeakPolarHBondContact O-CB 3.11Å; K68-T72 PolarHBondContact O-N 2.81Å; K68-T72 PolarHBondContact O-OG1 2.78Å; N69-T72 PolarHBondContact O-N 3.43Å; T72-L75 PolarHBondContact O-N 3.39Å; T72-I76 HydrophobicContact CG2-CD1 4.19Å; T72-I76 VanDerWaalsContact O-CG1 3.28Å; T72-I76 WeakPolarHBondContact O-CG1 3.41Å; T72-I76 PolarHBondContact O-N 3.38Å
73V92.6Very high86.7Confident75 Ų7597.8 Ų97.846%0.45551%0.509SS..Hα-helixtrans-62.3-44.2175.9170.80000110.7N69 V70 L75 I76 F77N69-V73 WeakPolarHBondContact O-CB 3.28Å; N69-V73 VanDerWaalsContact O-CG2 3.27Å; N69-V73 WeakPolarHBondContact O-CG2 3.07Å; N69-V73 PolarHBondContact O-N 3.22Å; V70-V73 PolarHBondContact O-N 3.4Å; V73-L75 PolarHBondContact O-N 2.73Å; V73-I76 WeakPolarHBondContact O-CB 3.35Å; V73-I76 PolarHBondContact O-N 3.37Å; V73-F77 HydrophobicContact CG1-CD2 3.76Å; V73-F77 HydrophobicContact CG1-CE2 3.49Å; V73-F77 VanDerWaalsContact CG1-CE2 3.49Å; V73-F77 WeakPolarHBondContact O-CD2 3.36Å; V73-F77 PolarHBondContact O-N 3.17Å
74L93.2Very high88.1Confident90 Ų9097.7 Ų97.747%0.47151%0.512SS..Hα-helixtrans-59.9-44.7175.7-177.667.8000111.8V70 F71 I76 F77 I78V70-L74 VanDerWaalsContact O-CB 3.32Å; V70-L74 WeakPolarHBondContact O-CB 3.33Å; V70-L74 PolarHBondContact O-N 2.91Å; F71-L74 PolarHBondContact O-N 3.33Å; L74-I76 VanDerWaalsContact C-N 3.34Å; L74-I76 PolarHBondContact O-N 3.35Å; L74-F77 PolarHBondContact O-N 3.37Å; L74-I78 HydrophobicContact CG-CD1 4.05Å; L74-I78 WeakPolarHBondContact O-CG1 3.32Å; L74-I78 PolarHBondContact O-N 2.75Å
75L93.1Very high89.5Confident61 Ų6194.3 Ų94.332%0.31950%0.503SS..Hα-helixtrans-60.8-43.1175.5-74.9174.6000111.3F71 T72 V73 F77 I78 Y79F71-L75 HydrophobicContact CD1-CD1 3.66Å; F71-L75 HydrophobicContact CD1-CG 4.03Å; F71-L75 HydrophobicContact CE1-CD1 3.6Å; F71-L75 HydrophobicContact CE1-CD2 4.2Å; F71-L75 HydrophobicContact CE1-CG 3.93Å; F71-L75 WeakPolarHBondContact O-CB 3.42Å; F71-L75 VanDerWaalsContact O-CG 3.25Å; F71-L75 WeakPolarHBondContact O-CG 3.35Å; F71-L75 PolarHBondContact O-N 3.01Å; T72-L75 PolarHBondContact O-N 3.39Å; V73-L75 PolarHBondContact O-N 2.73Å; L75-F77 VanDerWaalsContact C-N 3.32Å; L75-F77 PolarHBondContact O-N 2.72Å; L75-I78 PolarHBondContact O-N 2.88Å; L75-Y79 HydrophobicContact CB-CD2 4.43Å; L75-Y79 HydrophobicContact CB-CE2 4.32Å; L75-Y79 WeakPolarHBondContact O-CD2 3.37Å; L75-Y79 PolarHBondContact O-N 3.5Å
76I94.3Very high90.5Very high90 Ų9091.9 Ų91.946%0.46249%0.492SS..Hα-helixtrans-57.3-47.3175.2-68.9163.6000110.3T72 V73 L74 I78 Y79 L80T72-I76 HydrophobicContact CG2-CD1 4.19Å; T72-I76 VanDerWaalsContact O-CG1 3.28Å; T72-I76 WeakPolarHBondContact O-CG1 3.41Å; T72-I76 PolarHBondContact O-N 3.38Å; V73-I76 WeakPolarHBondContact O-CB 3.35Å; V73-I76 PolarHBondContact O-N 3.37Å; L74-I76 VanDerWaalsContact C-N 3.34Å; L74-I76 PolarHBondContact O-N 3.35Å; I76-I78 PolarHBondContact O-N 2.88Å; I76-Y79 PolarHBondContact O-N 2.88Å; I76-L80 HydrophobicContact CG2-CD1 4.07Å; I76-L80 HydrophobicContact CG2-CG 4.34Å; I76-L80 WeakPolarHBondContact O-CG 2.93Å; I76-L80 PolarHBondContact O-N 3.26Å
77F93.9Very high91.5Very high124 Ų12488.7 Ų88.754%0.54447%0.47SS..Hα-helixtrans-61.4-43.6176.7-79.5-67.1000112.6V73 L74 L75 Y79 L80 V81V73-F77 HydrophobicContact CG1-CD2 3.76Å; V73-F77 HydrophobicContact CG1-CE2 3.49Å; V73-F77 VanDerWaalsContact CG1-CE2 3.49Å; V73-F77 WeakPolarHBondContact O-CD2 3.36Å; V73-F77 PolarHBondContact O-N 3.17Å; L74-F77 PolarHBondContact O-N 3.37Å; L75-F77 VanDerWaalsContact C-N 3.32Å; L75-F77 PolarHBondContact O-N 2.72Å; F77-Y79 VanDerWaalsContact C-N 3.32Å; F77-Y79 PolarHBondContact O-N 3.03Å; F77-L80 PolarHBondContact O-N 3.4Å; F77-V81 VanDerWaalsContact O-CG2 3.31Å; F77-V81 WeakPolarHBondContact O-CG2 3.34Å; F77-V81 PolarHBondContact O-N 2.74Å
78I95.1Very high92Very high79 Ų7988.1 Ų88.141%0.40546%0.464SS..Hα-helixtrans-59.1-45.2175.8-68.9166.5000110.3L74 L75 I76 V81 L82L74-I78 HydrophobicContact CG-CD1 4.05Å; L74-I78 WeakPolarHBondContact O-CG1 3.32Å; L74-I78 PolarHBondContact O-N 2.75Å; L75-I78 PolarHBondContact O-N 2.88Å; I76-I78 PolarHBondContact O-N 2.88Å; I78-V81 PolarHBondContact O-N 2.89Å; I78-L82 HydrophobicContact CG2-CD1 3.85Å; I78-L82 HydrophobicContact CG2-CG 4.37Å; I78-L82 WeakPolarHBondContact O-CB 3.48Å; I78-L82 VanDerWaalsContact O-CG 3.28Å; I78-L82 WeakPolarHBondContact O-CG 2.8Å; I78-L82 PolarHBondContact O-N 2.85Å
79Y92.2Very high92.4Very high149 Ų14986 Ų8658%0.58446%0.459SS*.Hα-helixtrans-64.9-39.1177.1-77.1-63.4000112.9L75 I76 F77 L82 T83L75-Y79 HydrophobicContact CB-CD2 4.43Å; L75-Y79 HydrophobicContact CB-CE2 4.32Å; L75-Y79 WeakPolarHBondContact O-CD2 3.37Å; L75-Y79 PolarHBondContact O-N 3.5Å; I76-Y79 PolarHBondContact O-N 2.88Å; F77-Y79 VanDerWaalsContact C-N 3.32Å; F77-Y79 PolarHBondContact O-N 3.03Å; Y79-L82 PolarHBondContact O-N 2.88Å; Y79-T83 WeakPolarHBondContact O-CB 3.2Å; Y79-T83 PolarHBondContact O-N 2.96Å; Y79-T83 PolarHBondContact O-OG1 2.94Å
80L93.4Very high92.8Very high105 Ų10582.7 Ų82.755%0.5544%0.444SS..Hα-helixtrans-63.6-44.2175-72.2176.6000111.4I76 F77 T83 A84I76-L80 HydrophobicContact CG2-CD1 4.07Å; I76-L80 HydrophobicContact CG2-CG 4.34Å; I76-L80 WeakPolarHBondContact O-CG 2.93Å; I76-L80 PolarHBondContact O-N 3.26Å; F77-L80 PolarHBondContact O-N 3.4Å; L80-T83 PolarHBondContact O-N 3.22Å; L80-A84 WeakPolarHBondContact O-CB 3.33Å; L80-A84 PolarHBondContact O-N 3.4Å
81V95.3Very high92.9Very high91 Ų9180 Ų8055%0.55242%0.424SS*.Hα-helixtrans-63.7-47.1177171.70000110.8F77 I78 T83 A84 V85F77-V81 VanDerWaalsContact O-CG2 3.31Å; F77-V81 WeakPolarHBondContact O-CG2 3.34Å; F77-V81 PolarHBondContact O-N 2.74Å; I78-V81 PolarHBondContact O-N 2.89Å; V81-T83 VanDerWaalsContact C-N 3.28Å; V81-T83 PolarHBondContact O-N 3.29Å; V81-A84 PolarHBondContact O-N 2.84Å; V81-V85 HydrophobicContact CG1-CG2 4.44Å; V81-V85 WeakPolarHBondContact O-CG2 3.27Å; V81-V85 PolarHBondContact O-N 3.43Å
82L94.8Very high92.9Very high104 Ų10478.1 Ų78.155%0.54542%0.417SS..Hα-helixtrans-59.4-41176.7-73.9170.5000111.8I78 Y79 V85 A86I78-L82 HydrophobicContact CG2-CD1 3.85Å; I78-L82 HydrophobicContact CG2-CG 4.37Å; I78-L82 WeakPolarHBondContact O-CB 3.48Å; I78-L82 VanDerWaalsContact O-CG 3.28Å; I78-L82 WeakPolarHBondContact O-CG 2.8Å; I78-L82 PolarHBondContact O-N 2.85Å; Y79-L82 PolarHBondContact O-N 2.88Å; L82-V85 PolarHBondContact O-N 2.87Å; L82-A86 WeakPolarHBondContact O-CB 3.27Å; L82-A86 PolarHBondContact O-N 2.83Å
83T91.4Very high92.9Very high58 Ų5879.2 Ų79.236%0.35642%0.424SS..Hα-helixtrans-65.9-43.4176.7-55.70000111.1Y79 L80 V81 V85 A86 I87Y79-T83 WeakPolarHBondContact O-CB 3.2Å; Y79-T83 PolarHBondContact O-N 2.96Å; Y79-T83 PolarHBondContact O-OG1 2.94Å; L80-T83 PolarHBondContact O-N 3.22Å; V81-T83 VanDerWaalsContact C-N 3.28Å; V81-T83 PolarHBondContact O-N 3.29Å; T83-V85 PolarHBondContact O-N 3.34Å; T83-A86 PolarHBondContact O-N 3.08Å; T83-I87 HydrophobicContact CG2-CD1 3.84Å; T83-I87 WeakPolarHBondContact O-CG1 3.48Å; T83-I87 PolarHBondContact O-N 3.45Å
84A92.4Very high92.7Very high58 Ų5879 Ų7948%0.47942%0.42SS..Hα-helixtrans-61.3-43.6176.200000111.8L80 V81 I87 F88L80-A84 WeakPolarHBondContact O-CB 3.33Å; L80-A84 PolarHBondContact O-N 3.4Å; V81-A84 PolarHBondContact O-N 2.84Å; A84-I87 PolarHBondContact O-N 3.49Å; A84-F88 VanDerWaalsContact O-CB 3.24Å; A84-F88 WeakPolarHBondContact O-CB 3.37Å; A84-F88 PolarHBondContact O-N 2.85Å
85V95Very high92.3Very high75 Ų7575.5 Ų75.546%0.45540%0.403SS..Hα-helixtrans-62.1-43.7175.6172.40000111.1V81 L82 T83 F88 L89V81-V85 HydrophobicContact CG1-CG2 4.44Å; V81-V85 WeakPolarHBondContact O-CG2 3.27Å; V81-V85 PolarHBondContact O-N 3.43Å; L82-V85 PolarHBondContact O-N 2.87Å; T83-V85 PolarHBondContact O-N 3.34Å; V85-F88 PolarHBondContact O-N 3.47Å; V85-L89 HydrophobicContact CG1-CD1 4.13Å; V85-L89 HydrophobicContact CG1-CG 4.47Å; V85-L89 WeakPolarHBondContact O-CG 3.37Å; V85-L89 PolarHBondContact O-N 2.88Å
86A93.5Very high91.8Very high39 Ų3977 Ų7732%0.32241%0.412SS..Hα-helixtrans-62.3-45.1177.800000112.3L82 T83 F88 L89 A90 F319L82-A86 WeakPolarHBondContact O-CB 3.27Å; L82-A86 PolarHBondContact O-N 2.83Å; T83-A86 PolarHBondContact O-N 3.08Å; A86-F88 VanDerWaalsContact C-N 3.33Å; A86-L89 PolarHBondContact O-N 2.96Å; A86-A90 WeakPolarHBondContact O-CB 3.46Å; A86-A90 PolarHBondContact O-N 2.86Å; A86-F319 HydrophobicContact CB-CE1 4.38Å; A86-F319 HydrophobicContact CB-CZ 4.32Å
87I93.1Very high91.4Very high13 Ų1379 Ų797%0.06742%0.417CS..Hα-helixtrans-64.2-41.2176.6-68.5164000110.7T83 A84 A90 Y91 I312 L315 C316 F319T83-I87 HydrophobicContact CG2-CD1 3.84Å; T83-I87 WeakPolarHBondContact O-CG1 3.48Å; T83-I87 PolarHBondContact O-N 3.45Å; A84-I87 PolarHBondContact O-N 3.49Å; I87-A90 PolarHBondContact O-N 3.46Å; I87-Y91 WeakPolarHBondContact O-CB 3.3Å; I87-Y91 PolarHBondContact O-N 2.96Å; I87-I312 HydrophobicContact CG2-CG2 4.1Å; I87-L315 HydrophobicContact CG2-CB 3.95Å; I87-L315 HydrophobicContact CG2-CD1 4.08Å; I87-C316 VanDerWaalsContact CD1-SG 3.55Å; I87-F319 HydrophobicContact CG1-CD2 3.83Å; I87-F319 HydrophobicContact CG1-CE2 4Å
88F92.4Very high90.8Very high115 Ų11574.7 Ų74.750%0.50440%0.399SS..Hα-helixtrans-61.8-46177.6179.2-100.9000112A84 V85 A86 A90 Y91 Q92A84-F88 VanDerWaalsContact O-CB 3.24Å; A84-F88 WeakPolarHBondContact O-CB 3.37Å; A84-F88 PolarHBondContact O-N 2.85Å; V85-F88 PolarHBondContact O-N 3.47Å; A86-F88 VanDerWaalsContact C-N 3.33Å; F88-A90 PolarHBondContact O-N 2.69Å; F88-Y91 PolarHBondContact O-N 2.97Å; F88-Q92 HydrophobicContact CD1-CG 4.44Å; F88-Q92 VanDerWaalsContact CE1-CD 3.46Å; F88-Q92 HydrophobicContact CE1-CG 4.13Å; F88-Q92 HydrophobicContact CZ-CG 4.19Å; F88-Q92 WeakPolarHBondContact O-CG 3.35Å; F88-Q92 PolarHBondContact O-N 2.86Å
89L93.4Very high89.9Confident96 Ų9673.4 Ų73.450%0.50339%0.393SS..Hα-helixtrans-63.6-40.5176-70.6174000112.1V85 A86 Q92 T93V85-L89 HydrophobicContact CG1-CD1 4.13Å; V85-L89 HydrophobicContact CG1-CG 4.47Å; V85-L89 WeakPolarHBondContact O-CG 3.37Å; V85-L89 PolarHBondContact O-N 2.88Å; A86-L89 PolarHBondContact O-N 2.96Å; L89-Q92 PolarHBondContact O-N 2.75Å; L89-T93 WeakPolarHBondContact O-CB 3.41Å; L89-T93 PolarHBondContact O-N 3.35Å; L89-T93 PolarHBondContact O-OG1 3.17Å
90A92.3Very high89.3Confident26 Ų2673.9 Ų73.922%0.21540%0.398CS..Hα-helixtrans-62.8-44.7174.800000111.5A86 I87 F88 T93 I94 L315 F319A86-A90 WeakPolarHBondContact O-CB 3.46Å; A86-A90 PolarHBondContact O-N 2.86Å; I87-A90 PolarHBondContact O-N 3.46Å; F88-A90 PolarHBondContact O-N 2.69Å; A90-T93 PolarHBondContact O-N 2.9Å; A90-I94 VanDerWaalsContact O-CG1 3.32Å; A90-I94 WeakPolarHBondContact O-CG1 3.27Å; A90-I94 PolarHBondContact O-N 3.41Å; A90-L315 HydrophobicContact CB-CD1 4.28Å; A90-L315 HydrophobicContact CB-CD2 4.31Å; A90-F319 HydrophobicContact CB-CE2 4.34Å
91Y90.6Very high88.6Confident35 Ų3572.5 Ų72.514%0.13739%0.391CS..Hα-helixtrans-60.8-46.7176.2174.1-94.5000111.9I87 F88 T93 I94 S95 V304 P308 I312I87-Y91 WeakPolarHBondContact O-CB 3.3Å; I87-Y91 PolarHBondContact O-N 2.96Å; F88-Y91 PolarHBondContact O-N 2.97Å; Y91-T93 VanDerWaalsContact C-N 3.33Å; Y91-T93 PolarHBondContact O-N 2.91Å; Y91-I94 PolarHBondContact O-N 2.91Å; Y91-S95 WeakPolarHBondContact O-CB 3.45Å; Y91-S95 PolarHBondContact O-N 3.34Å; Y91-V304 HydrophobicContact CD2-CG1 4.17Å; Y91-V304 HydrophobicContact CE2-CG1 3.54Å; Y91-V304 PolarHBondContact OH-O 3.04Å; Y91-P308 HydrophobicContact CE2-CB 4.28Å; Y91-I312 HydrophobicContact CD2-CG1 4.41Å
92Q89.6Confident87.6Confident83 Ų8374.1 Ų74.139%0.38841%0.406SS..Hα-helixtrans-59-44.9175.6-75.9-166.6-17.400111.6F88 L89 I94 S95 D96F88-Q92 HydrophobicContact CD1-CG 4.44Å; F88-Q92 VanDerWaalsContact CE1-CD 3.46Å; F88-Q92 HydrophobicContact CE1-CG 4.13Å; F88-Q92 HydrophobicContact CZ-CG 4.19Å; F88-Q92 WeakPolarHBondContact O-CG 3.35Å; F88-Q92 PolarHBondContact O-N 2.86Å; L89-Q92 PolarHBondContact O-N 2.75Å; Q92-I94 VanDerWaalsContact C-N 3.32Å; Q92-I94 PolarHBondContact O-N 2.84Å; Q92-S95 PolarHBondContact O-N 3Å; Q92-D96 WeakPolarHBondContact O-CB 3.16Å; Q92-D96 PolarHBondContact O-N 2.77Å
93T89.9Confident86.8Confident97 Ų9777.7 Ų77.760%0.59542%0.42SS*.Hα-helixtrans-60.3-42.2178.5-55.50000111.7L89 A90 Y91 F97L89-T93 WeakPolarHBondContact O-CB 3.41Å; L89-T93 PolarHBondContact O-N 3.35Å; L89-T93 PolarHBondContact O-OG1 3.17Å; A90-T93 PolarHBondContact O-N 2.9Å; Y91-T93 VanDerWaalsContact C-N 3.33Å; Y91-T93 PolarHBondContact O-N 2.91Å; T93-F97 WeakPolarHBondContact O-CB 3.43Å; T93-F97 PolarHBondContact O-N 3.08Å
94I87.4Confident86.4Confident70 Ų7076.6 Ų76.636%0.35941%0.414SS..Hα-helixtrans-65.3-46176.4-68.2165000110.5A90 Y91 Q92 D96 F97 L98 V304 L315A90-I94 VanDerWaalsContact O-CG1 3.32Å; A90-I94 WeakPolarHBondContact O-CG1 3.27Å; A90-I94 PolarHBondContact O-N 3.41Å; Y91-I94 PolarHBondContact O-N 2.91Å; Q92-I94 VanDerWaalsContact C-N 3.32Å; Q92-I94 PolarHBondContact O-N 2.84Å; I94-D96 VanDerWaalsContact C-N 3.33Å; I94-D96 PolarHBondContact O-N 2.71Å; I94-F97 PolarHBondContact O-N 2.83Å; I94-L98 HydrophobicContact CG2-CD1 3.98Å; I94-L98 HydrophobicContact CG2-CG 4.37Å; I94-L98 WeakPolarHBondContact O-CG 3.36Å; I94-L98 PolarHBondContact O-N 2.96Å; I94-V304 HydrophobicContact CG2-CG1 4.36Å; I94-V304 HydrophobicContact CG2-CG2 4.48Å; I94-L315 HydrophobicContact CD1-CD1 4.37Å; I94-L315 HydrophobicContact CD1-CD2 3.91Å
95S84.3Confident85.9Confident17 Ų1779.1 Ų79.112%0.11942%0.423CS..Hα-helixtrans-58.7-45.7177.8-174.70000111.2Y91 Q92 F97 L98 N99Y91-S95 WeakPolarHBondContact O-CB 3.45Å; Y91-S95 PolarHBondContact O-N 3.34Å; Q92-S95 PolarHBondContact O-N 3Å; S95-F97 VanDerWaalsContact C-N 3.34Å; S95-F97 PolarHBondContact O-N 2.68Å; S95-L98 PolarHBondContact O-N 3.47Å; S95-N99 WeakPolarHBondContact O-CB 3.45Å; S95-N99 PolarHBondContact O-N 3.38Å; S95-N99 PolarHBondContact O-ND2 2.97Å
96D84.1Confident85.4Confident94 Ų9478.3 Ų78.350%0.50342%0.416SS..Hα-helixtrans-66.9-35.1178.6-75.5-14000112.9Q92 I94 K100Q92-D96 WeakPolarHBondContact O-CB 3.16Å; Q92-D96 PolarHBondContact O-N 2.77Å; I94-D96 VanDerWaalsContact C-N 3.33Å; I94-D96 PolarHBondContact O-N 2.71Å; D96-K100 WeakPolarHBondContact O-CG 3.38Å; D96-K100 PolarHBondContact O-N 3.25Å
97F84.8Confident85.1Confident131 Ų13178.2 Ų78.258%0.57541%0.413SS*.Hα-helixtrans-65.7-47172.7178.9-97.9000111.5T93 I94 S95 N99 K100 L101T93-F97 WeakPolarHBondContact O-CB 3.43Å; T93-F97 PolarHBondContact O-N 3.08Å; I94-F97 PolarHBondContact O-N 2.83Å; S95-F97 VanDerWaalsContact C-N 3.34Å; S95-F97 PolarHBondContact O-N 2.68Å; F97-N99 VanDerWaalsContact C-N 3.26Å; F97-N99 PolarHBondContact O-N 2.71Å; F97-K100 WeakPolarHBondContact O-CB 3.27Å; F97-K100 PolarHBondContact O-N 2.94Å; F97-L101 HydrophobicContact CE1-CD1 4.17Å; F97-L101 HydrophobicContact CE1-CD2 4.23Å; F97-L101 HydrophobicContact CE1-CG 4.35Å; F97-L101 HydrophobicContact CZ-CD2 4.24Å; F97-L101 PolarHBondContact O-N 3.05Å
98L81.3Confident84.9Confident34 Ų3480.8 Ų80.818%0.17843%0.429CS..Hα-helixtrans-62.9-34.7178-70.7176000112.1I94 S95 K100 L101 V304I94-L98 HydrophobicContact CG2-CD1 3.98Å; I94-L98 HydrophobicContact CG2-CG 4.37Å; I94-L98 WeakPolarHBondContact O-CG 3.36Å; I94-L98 PolarHBondContact O-N 2.96Å; S95-L98 PolarHBondContact O-N 3.47Å; L98-K100 PolarHBondContact O-N 2.81Å; L98-L101 HydrophobicContact CD2-CD1 3.69Å; L98-L101 PolarHBondContact O-N 2.76Å; L98-V304 HydrophobicContact CD1-CB 3.71Å; L98-V304 HydrophobicContact CD1-CG1 4.37Å; L98-V304 HydrophobicContact CD1-CG2 3.31Å
99N76.2Confident84.8Confident52 Ų5277.5 Ų77.528%0.27842%0.42SS..THydrogen-bonded Turntrans-64.5-19.6173.1-75.8-28.9000113.7S95 F97 R256 L302S95-N99 WeakPolarHBondContact O-CB 3.45Å; S95-N99 PolarHBondContact O-N 3.38Å; S95-N99 PolarHBondContact O-ND2 2.97Å; F97-N99 VanDerWaalsContact C-N 3.26Å; F97-N99 PolarHBondContact O-N 2.71Å; N99-R256 PolarHBondContact O-NE 3.46Å; N99-L302 WeakPolarHBondContact OD1-CD1 3.41Å
100K79.9Confident84.8Confident158 Ų15879.9 Ų79.969%0.68742%0.423SS*.THydrogen-bonded Turntrans-90.3-12.9176.7-70.6174.2-178.11770113.2D96 F97 L98D96-K100 WeakPolarHBondContact O-CG 3.38Å; D96-K100 PolarHBondContact O-N 3.25Å; F97-K100 WeakPolarHBondContact O-CB 3.27Å; F97-K100 PolarHBondContact O-N 2.94Å; L98-K100 PolarHBondContact O-N 2.81Å
101L79.9Confident84.8Confident77 Ų7784.1 Ų84.140%0.40344%0.437SS..SBendtrans-73.3143.5175.4-63.5175.7000110.4F97 L98 P104F97-L101 HydrophobicContact CE1-CD1 4.17Å; F97-L101 HydrophobicContact CE1-CD2 4.23Å; F97-L101 HydrophobicContact CE1-CG 4.35Å; F97-L101 HydrophobicContact CZ-CD2 4.24Å; F97-L101 PolarHBondContact O-N 3.05Å; L98-L101 HydrophobicContact CD2-CD1 3.69Å; L98-L101 PolarHBondContact O-N 2.76Å; L101-P104 HydrophobicContact CB-CB 4.48Å
102S73.6Confident84.9Confident124 Ų12488.3 Ų88.387%0.86746%0.457SS*.SBendtrans-72.7-34.9-177.551.50000113.1
103Q78.3Confident85Confident179 Ų17985.5 Ų85.584%0.83645%0.446SS*.SBendtrans-140.271.5-177.3-67.5179-11.800110.3
104P82Confident84.9Confident35 Ų3585.8 Ų85.823%0.22744%0.444CS..PPolyproline II helixtrans-70.7151.8176.230.4-33.8000111L101 M106 L302L101-P104 HydrophobicContact CB-CB 4.48Å; P104-M106 HydrophobicContact CG-SD 4.4Å; P104-M106 PolarHBondContact O-N 2.03Å; P104-L302 HydrophobicContact CB-CD2 3.37Å; P104-L302 HydrophobicContact CG-CD2 3.17Å
105V82.7Confident85.1Confident111 Ų11186 Ų8667%0.67345%0.451SS*.PPolyproline II helixtrans-69.2126.7173179.90000109.3I303V105-I303 PolarHBondContact O-N 3.36Å
106M84.4Confident85.6Confident59 Ų5985.4 Ų85.429%0.29145%0.447SS..EExtended strand (participates in β ladder)trans-101.9145.8179.9-55.7-67-84.600110.5P104 T253 S254 I300 R301 L302P104-M106 HydrophobicContact CG-SD 4.4Å; P104-M106 PolarHBondContact O-N 2.03Å; M106-T253 HydrophobicContact CE-CG2 4.27Å; M106-S254 WeakPolarHBondContact CE-O 3.44Å; M106-I300 HydrophobicContact CB-CG2 3.45Å; M106-I300 VanDerWaalsContact CB-CG2 3.45Å; M106-I300 HydrophobicContact CE-CG2 3.99Å; M106-I300 HydrophobicContact CG-CG2 3.95Å; M106-R301 CarbonylContact C-O 3.42Å; M106-R301 VanDerWaalsContact CA-O 3.3Å; M106-R301 WeakPolarHBondContact CA-O 3.45Å; M106-R301 VanDerWaalsContact CE-C 3.44Å; M106-L302 HydrophobicContact CE-CG 4.49Å; M106-L302 HydrophobicContact SD-CB 4.38Å; M106-L302 HydrophobicContact SD-CD2 3.47Å; M106-L302 WeakPolarHBondContact SD-CD2 3.1Å; M106-L302 HydrophobicContact SD-CG 3.88Å
107S86.9Confident86.1Confident37 Ų3784.1 Ų84.126%0.25945%0.445SS..EExtended strand (participates in β ladder)trans-94.6148168.2-175.70000109.9I300 R301S107-I300 WeakPolarHBondContact O-CA 3.45Å; S107-R301 PolarHBondContact N-O 2.88Å; S107-R301 PolarHBondContact O-N 3.24Å
108V89.6Confident86.6Confident67 Ų6779.3 Ų79.341%0.40643%0.427SS..EExtended strand (participates in β ladder)trans-104.5134.5173.6-177.10000108.7Y110 Q298 I300V108-Y110 HydrophobicContact CG1-CE2 3.95Å; V108-Q298 HydrophobicContact CG1-CG 3.55Å; V108-I300 HydrophobicContact CG2-CG1 4.42Å
109S90.5Very high87.3Confident45 Ų4577.7 Ų77.732%0.31542%0.419SS..EExtended strand (participates in β ladder)trans-132.8147.4171.356.20000109.5Q298 E299S109-Q298 CarbonylContact O-C 3.57Å; S109-E299 PolarHBondContact N-O 3.41Å; S109-E299 PolarHBondContact O-N 3.43Å; S109-E299 WeakPolarHBondContact OG-CB 3.44Å; S109-E299 PolarHBondContact OG-O 2.95Å
110Y92.4Very high88.3Confident146 Ų14675.2 Ų75.257%0.57341%0.405SS*.EExtended strand (participates in β ladder)trans-109.6125177.6-65.6-84000108.4V108 Q298V108-Y110 HydrophobicContact CG1-CE2 3.95Å; Y110-Q298 HydrophobicContact CD1-CB 4.3Å; Y110-Q298 HydrophobicContact CD1-CG 4.46Å; Y110-Q298 HydrophobicContact CE1-CB 4.06Å; Y110-Q298 HydrophobicContact CE1-CG 3.94Å
111K92.4Very high89.2Confident116 Ų11667.7 Ų67.750%0.50437%0.373SS..EExtended strand (participates in β ladder)trans-111.7115.5176.3-177.4-179.5177.7-177.30108.9Y296 I297 E299K111-Y296 WeakPolarHBondContact O-CA 3.48Å; K111-I297 PolarHBondContact N-O 3.16Å; K111-I297 PolarHBondContact O-N 2.99Å; K111-E299 WeakPolarHBondContact CD-OE1 3.39Å
112E93.4Very high90Very high122 Ų12264 Ų6457%0.5735%0.353SS*.EExtended strand (participates in β ladder)trans-66.6137.6173.1-164.7175.7179.600110.2P295 Y296E112-P295 CarbonylContact C-O 3.6Å; E112-P295 WeakPolarHBondContact CA-O 3.21Å; E112-P295 HydrophobicContact CG-CB 4.42Å; E112-P295 HydrophobicContact CG-CG 4.49Å; E112-Y296 HydrophobicContact CB-CD1 3.91Å; E112-Y296 HydrophobicContact CB-CE1 3.78Å; E112-Y296 HydrophobicContact CG-CD1 4.3Å; E112-Y296 HydrophobicContact CG-CE1 3.96Å
113V91.9Very high91.1Very high24 Ų2458.1 Ų58.115%0.14531%0.312CS..  trans-130.3140.6175.9-66.50000110.4F116 P295 I297V113-F116 HydrophobicContact CG2-CD1 4.3Å; V113-F116 HydrophobicContact CG2-CD2 3.72Å; V113-F116 HydrophobicContact CG2-CE1 3.96Å; V113-F116 HydrophobicContact CG2-CE2 3.29Å; V113-F116 HydrophobicContact CG2-CG 4.2Å; V113-F116 HydrophobicContact CG2-CZ 3.44Å; V113-F116 VanDerWaalsContact CG2-CZ 3.44Å; V113-P295 WeakPolarHBondContact CG2-O 3.33Å; V113-P295 PolarHBondContact N-O 3.44Å; V113-I297 HydrophobicContact CB-CD1 4.49Å; V113-I297 HydrophobicContact CG1-CD1 3.57Å; V113-I297 HydrophobicContact CG1-CG1 3.97Å; V113-I297 HydrophobicContact CG2-CD1 4.17Å; V113-I297 HydrophobicContact CG2-CG1 4Å
114D86.9Confident91.9Very high104 Ų10450.1 Ų50.156%0.55628%0.275SS*.SBendtrans-73.7-34.4178.9-66.6-42.8000111.9K184D114-K184 WeakPolarHBondContact OD1-CE 3.29Å; D114-K184 IonicContact OD1-NZ 2.72Å; D114-K184 PolarHBondContact OD1-NZ 2.67Å
115S92.4Very high92.3Very high73 Ų7348.7 Ų48.751%0.5127%0.265SS..SBendtrans-149150.7174.861.80000110.5S181S115-S181 WeakPolarHBondContact CA-O 3.12Å
116F93.9Very high92.5Very high6 Ų646.8 Ų46.83%0.02625%0.251CS..PPolyproline II helixtrans-94.1149.8173.5-72.5-105.3000109.8V113 S181 V183 L250 W292 I297V113-F116 HydrophobicContact CG2-CD1 4.3Å; V113-F116 HydrophobicContact CG2-CD2 3.72Å; V113-F116 HydrophobicContact CG2-CE1 3.96Å; V113-F116 HydrophobicContact CG2-CE2 3.29Å; V113-F116 HydrophobicContact CG2-CG 4.2Å; V113-F116 HydrophobicContact CG2-CZ 3.44Å; V113-F116 VanDerWaalsContact CG2-CZ 3.44Å; F116-S181 PolarHBondContact N-O 2.86Å; F116-S181 WeakPolarHBondContact O-CB 3.09Å; F116-S181 PolarHBondContact O-OG 2.87Å; F116-V183 HydrophobicContact CD2-CG2 3.34Å; F116-V183 HydrophobicContact CE2-CG2 3.42Å; F116-V183 VanDerWaalsContact CE2-CG2 3.42Å; F116-L250 HydrophobicContact CD1-CB 4.41Å; F116-L250 HydrophobicContact CD1-CD2 4.3Å; F116-L250 HydrophobicContact CE1-CB 3.98Å; F116-L250 HydrophobicContact CE1-CD2 4.5Å; F116-W292 HydrophobicContact CB-CD2 4.42Å; F116-W292 HydrophobicContact CB-CH2 4.24Å; F116-W292 HydrophobicContact CB-CZ2 3.48Å; F116-W292 VanDerWaalsContact CB-CZ2 3.48Å; F116-W292 HydrophobicContact CD1-CD2 4.19Å; F116-W292 AromaticContact CD1-CE2 3.99Å; F116-W292 HydrophobicContact CD1-CE3 4.05Å; F116-W292 AromaticContact CD1-CH2 3.52Å; F116-W292 HydrophobicContact CD1-CH2 3.52Å; F116-W292 AromaticContact CD1-CZ2 3.66Å; F116-W292 HydrophobicContact CD1-CZ2 3.66Å; F116-W292 AromaticContact CD1-CZ3 3.75Å; F116-W292 HydrophobicContact CD1-CZ3 3.75Å; F116-W292 AromaticContact CD2-CD2 3.96Å; F116-W292 HydrophobicContact CD2-CD2 3.96Å; F116-W292 AromaticContact CD2-CE2 3.97Å; F116-W292 HydrophobicContact CD2-CE3 4.42Å; F116-W292 HydrophobicContact CD2-CG 4.16Å; F116-W292 HydrophobicContact CD2-CZ2 4.43Å; F116-W292 HydrophobicContact CE1-CD2 4.44Å; F116-W292 AromaticContact CE1-CE3 3.98Å; F116-W292 HydrophobicContact CE1-CE3 3.98Å; F116-W292 HydrophobicContact CE1-CH2 4.07Å; F116-W292 AromaticContact CE1-CZ3 3.81Å; F116-W292 HydrophobicContact CE1-CZ3 3.81Å; F116-W292 HydrophobicContact CE2-CD2 4.24Å; F116-W292 HydrophobicContact CE2-CE3 4.38Å; F116-W292 HydrophobicContact CE2-CG 4.43Å; F116-W292 AromaticContact CG-CD2 3.94Å; F116-W292 HydrophobicContact CG-CD2 3.94Å; F116-W292 AromaticContact CG-CE2 3.59Å; F116-W292 HydrophobicContact CG-CE3 4.27Å; F116-W292 AromaticContact CG-CH2 3.98Å; F116-W292 HydrophobicContact CG-CH2 3.98Å; F116-W292 AromaticContact CG-CZ2 3.6Å; F116-W292 HydrophobicContact CG-CZ2 3.6Å; F116-W292 HydrophobicContact CG-CZ3 4.31Å; F116-W292 HydrophobicContact CZ-CD2 4.47Å; F116-W292 HydrophobicContact CZ-CE3 4.16Å; F116-W292 HydrophobicContact CZ-CZ3 4.44Å; F116-I297 HydrophobicContact CD1-CD1 4.44Å; F116-I297 HydrophobicContact CD1-CG1 4.21Å; F116-I297 HydrophobicContact CE1-CD1 4.21Å; F116-I297 HydrophobicContact CE1-CG1 3.51Å; F116-I297 HydrophobicContact CZ-CG1 4.07Å
117S94.8Very high92.6Very high66 Ų6650.1 Ų50.146%0.46227%0.27SS..PPolyproline II helixtrans-58.2132.4160.2-580000108.6P119S117-P119 WeakPolarHBondContact O-CD 2.92Å; S117-P119 VanDerWaalsContact O-N 3.13Å
118P95.8Very high92.8Very high31 Ų3148.4 Ų48.420%0.20126%0.258CS..PPolyproline II helixtrans-55.9120.1-179.2-21.428.8000109.8R178 K212 F213P118-R178 HydrophobicContact CB-CG 3.67Å; P118-R178 HydrophobicContact CG-CG 4.45Å; P118-R178 VanDerWaalsContact CG-CZ 3.42Å; P118-K212 CarbonylContact O-C 3.57Å; P118-K212 WeakPolarHBondContact O-CA 3.16Å; P118-F213 PolarHBondContact O-N 3.19Å
119P96.4Very high92.9Very high0 Ų051.4 Ų51.40%027%0.268CS..PPolyproline II helixtrans-73.6152.8179.131.3-32000109.4S117 G179 P180 F210 M248 F263 W292S117-P119 WeakPolarHBondContact O-CD 2.92Å; S117-P119 VanDerWaalsContact O-N 3.13Å; P119-G179 WeakPolarHBondContact O-CA 3.36Å; P119-G179 PolarHBondContact O-N 3.03Å; P119-P180 WeakPolarHBondContact CD-O 3.25Å; P119-F210 WeakPolarHBondContact CA-O 3.03Å; P119-M248 HydrophobicContact CG-CE 3.92Å; P119-M248 HydrophobicContact CG-SD 3.9Å; P119-F263 HydrophobicContact CB-CE1 3.94Å; P119-F263 HydrophobicContact CB-CZ 3.74Å; P119-W292 HydrophobicContact CB-CZ2 4.37Å; P119-W292 HydrophobicContact CG-CH2 4.41Å; P119-W292 HydrophobicContact CG-CZ2 3.77Å
120G96.7Very high93.1Very high0 Ų051.7 Ų51.70%027%0.265CS..EExtended strand (participates in β ladder)trans-87.1121.4169.700000110.2L209 F210G120-L209 WeakPolarHBondContact O-CA 3.05Å; G120-F210 PolarHBondContact N-O 2.87Å; G120-F210 WeakPolarHBondContact O-CD1 3.44Å; G120-F210 PolarHBondContact O-N 3.38Å
121I97.5Very high93.1Very high0 Ų045.2 Ų45.20%024%0.241CC..EExtended strand (participates in β ladder)trans-100.197.8175.8-52.3170.4000107.5L123 V176 V177 I189 M191 L209 F290I121-L123 HydrophobicContact CG2-CD1 4.16Å; I121-L123 HydrophobicContact CG2-CG 4.14Å; I121-V176 CarbonylContact O-C 3.54Å; I121-V176 WeakPolarHBondContact O-CA 3.44Å; I121-V177 PolarHBondContact N-O 2.89Å; I121-V177 PolarHBondContact O-N 2.92Å; I121-I189 HydrophobicContact CD1-CG2 3.87Å; I121-M191 HydrophobicContact CD1-CE 4.33Å; I121-M191 HydrophobicContact CG2-CE 4.4Å; I121-L209 HydrophobicContact CB-CD2 4.13Å; I121-L209 HydrophobicContact CG1-CD2 3.76Å; I121-L209 HydrophobicContact CG2-CD2 3.98Å; I121-F290 HydrophobicContact CD1-CB 3.91Å; I121-F290 HydrophobicContact CD1-CD1 4.24Å; I121-F290 HydrophobicContact CD1-CD2 3.86Å; I121-F290 HydrophobicContact CD1-CE2 4.42Å; I121-F290 HydrophobicContact CD1-CG 3.76Å; I121-F290 HydrophobicContact CG2-CD2 4.32Å; I121-F290 HydrophobicContact CG2-CE1 4.14Å; I121-F290 HydrophobicContact CG2-CE2 3.81Å; I121-F290 HydrophobicContact CG2-CZ 3.71Å
122A96.9Very high93.1Very high0 Ų039.9 Ų39.90%022%0.218CC..EExtended strand (participates in β ladder)trans-88.5110.7177.500000109.9F124 V176 Y207 M208 F210 M226A122-F124 HydrophobicContact CB-CE2 4.42Å; A122-V176 HydrophobicContact CB-CG1 4.49Å; A122-V176 HydrophobicContact CB-CG2 3.98Å; A122-Y207 CarbonylContact O-C 3.55Å; A122-Y207 WeakPolarHBondContact O-CA 3.49Å; A122-Y207 WeakPolarHBondContact O-CB 3.3Å; A122-M208 HydrophobicContact CB-CB 4.3Å; A122-M208 HydrophobicContact CB-CE 4.05Å; A122-M208 PolarHBondContact N-O 2.83Å; A122-M208 PolarHBondContact O-N 3.22Å; A122-F210 HydrophobicContact CB-CE1 4.35Å; A122-M226 HydrophobicContact CB-CE 3.5Å
123L96.9Very high93.2Very high0 Ų034.2 Ų34.20%019%0.192CC..EExtended strand (participates in β ladder)trans-98.4142178.5-64131.6000109.8I121 P125 A174 V175 V177 M191 F193 I205 F238I121-L123 HydrophobicContact CG2-CD1 4.16Å; I121-L123 HydrophobicContact CG2-CG 4.14Å; L123-P125 WeakPolarHBondContact O-CD 3.1Å; L123-A174 CarbonylContact O-C 3.44Å; L123-A174 VanDerWaalsContact O-CA 3.29Å; L123-A174 WeakPolarHBondContact O-CA 3.5Å; L123-V175 WeakPolarHBondContact CB-O 3.35Å; L123-V175 PolarHBondContact N-O 2.86Å; L123-V175 PolarHBondContact O-N 3.18Å; L123-V177 HydrophobicContact CD1-CG2 3.82Å; L123-M191 HydrophobicContact CD1-CE 4.11Å; L123-M191 HydrophobicContact CD1-SD 3.69Å; L123-F193 HydrophobicContact CD1-CZ 3.92Å; L123-F193 HydrophobicContact CD2-CE2 4.27Å; L123-F193 HydrophobicContact CD2-CZ 3.87Å; L123-F193 HydrophobicContact CG-CZ 4.3Å; L123-I205 HydrophobicContact CD2-CG2 4.37Å; L123-F238 HydrophobicContact CD2-CE1 3.65Å; L123-F238 HydrophobicContact CD2-CZ 3.92Å
124F94.5Very high93.3Very high11 Ų1136.4 Ų36.45%0.04820%0.2CC..EExtended strand (participates in β ladder)trans-115.277.2177.9-59.6-85000108.3A122 D126 Y162 A174 S206 M208 M235A122-F124 HydrophobicContact CB-CE2 4.42Å; F124-D126 PolarHBondContact O-N 2.81Å; F124-Y162 AromaticContact CE1-CE1 3.96Å; F124-Y162 HydrophobicContact CE1-CE1 3.96Å; F124-Y162 WeakPolarHBondContact CE1-OH 3.48Å; F124-Y162 WeakPolarHBondContact CZ-OH 3.35Å; F124-A174 HydrophobicContact CD1-CB 4.11Å; F124-A174 HydrophobicContact CE1-CB 3.73Å; F124-A174 HydrophobicContact CZ-CB 4.29Å; F124-S206 PolarHBondContact N-O 3.31Å; F124-M208 HydrophobicContact CE2-CB 4.07Å; F124-M235 HydrophobicContact CD2-CE 3.36Å; F124-M235 HydrophobicContact CD2-SD 4.31Å; F124-M235 HydrophobicContact CE2-CE 3.29Å; F124-M235 HydrophobicContact CE2-SD 3.62Å; F124-M235 HydrophobicContact CG-CE 4.23Å; F124-M235 HydrophobicContact CZ-CE 4.1Å; F124-M235 HydrophobicContact CZ-SD 4.19Å
125P91.6Very high93.6Very high4 Ų432.9 Ų32.93%0.02618%0.18CC..  trans-75.4-11.8-174.331.2-36.6000113.5L123 D127 A128 V175 F193 I205L123-P125 WeakPolarHBondContact O-CD 3.1Å; P125-D127 PolarHBondContact O-N 2.85Å; P125-A128 HydrophobicContact CB-CB 3.94Å; P125-A128 WeakPolarHBondContact CB-O 3.31Å; P125-A128 VanDerWaalsContact O-CB 3.27Å; P125-A128 WeakPolarHBondContact O-CB 3.4Å; P125-A128 PolarHBondContact O-N 2.9Å; P125-V175 HydrophobicContact CG-CG2 3.82Å; P125-F193 HydrophobicContact CB-CD1 4.43Å; P125-I205 HydrophobicContact CB-CD1 4.5Å
126D87.2Confident93.6Very high71 Ų7130.8 Ų30.838%0.3816%0.162SC..THydrogen-bonded Turntrans49.8-103.7-171.8-68.9-36.6000111.2F124 R173F124-D126 PolarHBondContact O-N 2.81Å; D126-R173 PolarHBondContact O-NH2 2.91Å
127D86.9Confident93.6Very high129 Ų12935.8 Ų35.869%0.6918%0.181SC*.THydrogen-bonded Turntrans-89-10.5178.1-64.7-41000114.2P125P125-D127 PolarHBondContact O-N 2.85Å
128A90.9Very high93.3Very high1 Ų138.7 Ų38.71%0.00819%0.187CC..  trans-71.3150.2177.700000111.8P125 S194 Q195 I205P125-A128 HydrophobicContact CB-CB 3.94Å; P125-A128 WeakPolarHBondContact CB-O 3.31Å; P125-A128 VanDerWaalsContact O-CB 3.27Å; P125-A128 WeakPolarHBondContact O-CB 3.4Å; P125-A128 PolarHBondContact O-N 2.9Å; A128-S194 CarbonylContact C-O 3.58Å; A128-S194 WeakPolarHBondContact CA-O 3.48Å; A128-Q195 HydrophobicContact CB-CB 3.9Å; A128-Q195 HydrophobicContact CB-CG 4.03Å; A128-I205 HydrophobicContact CB-CD1 3.82Å; A128-I205 HydrophobicContact CB-CG1 4.42Å
129Q92Very high92.5Very high130 Ų13040.3 Ų40.361%0.60719%0.194SC*.EExtended strand (participates in β ladder)trans-113.7136178.3-62.4-174.58.800110L131 F193 S194Q129-L131 PolarHBondContact O-N 2.94Å; Q129-F193 CarbonylContact O-C 3.57Å; Q129-F193 WeakPolarHBondContact O-CA 3.46Å; Q129-F193 WeakPolarHBondContact O-CB 3.39Å; Q129-S194 PolarHBondContact N-O 3.07Å; Q129-S194 PolarHBondContact O-N 2.78Å
130L93.5Very high91.7Very high51 Ų5145.8 Ų45.827%0.26722%0.223SC..EExtended strand (participates in β ladder)trans-73.9118.3171.4-18071.3000108.6C133 I157 M191 F193L130-C133 HydrophobicContact CD1-CB 4.49Å; L130-C133 HydrophobicContact CD2-CB 4.24Å; L130-I157 HydrophobicContact CD2-CD1 3.55Å; L130-M191 HydrophobicContact CD1-CB 4.08Å; L130-M191 HydrophobicContact CD1-CG 4.27Å; L130-F193 HydrophobicContact CB-CD1 3.97Å; L130-F193 HydrophobicContact CB-CE1 3.8Å; L130-F193 HydrophobicContact CD1-CD1 3.98Å; L130-F193 HydrophobicContact CD1-CD2 4.36Å; L130-F193 HydrophobicContact CD1-CE1 3.49Å; L130-F193 VanDerWaalsContact CD1-CE1 3.49Å; L130-F193 HydrophobicContact CD1-CE2 3.9Å; L130-F193 HydrophobicContact CD1-CG 4.38Å; L130-F193 HydrophobicContact CD1-CZ 3.43Å; L130-F193 VanDerWaalsContact CD1-CZ 3.43Å; L130-F193 HydrophobicContact CG-CE1 4.21Å
131L92.7Very high91.1Very high11 Ų1147 Ų476%0.05823%0.229CC..EExtended strand (participates in β ladder)trans-91-37.9-179.8-68.8-178.7000112.9Q129 P150 Q151 Q192 S194 L285Q129-L131 PolarHBondContact O-N 2.94Å; L131-P150 HydrophobicContact CD2-CB 4.39Å; L131-P150 HydrophobicContact CD2-CG 3.91Å; L131-P150 WeakPolarHBondContact O-CA 3.39Å; L131-Q151 PolarHBondContact O-N 2.82Å; L131-Q192 HydrophobicContact CB-CB 4.45Å; L131-Q192 HydrophobicContact CB-CG 4.18Å; L131-Q192 HydrophobicContact CD1-CG 4.12Å; L131-Q192 PolarHBondContact N-O 2.71Å; L131-S194 WeakPolarHBondContact CD2-OG 3.3Å; L131-S194 WeakPolarHBondContact CG-OG 3.43Å; L131-L285 HydrophobicContact CD1-CD2 4.07Å
132S93.1Very high90.4Very high4 Ų450.2 Ų50.23%0.02825%0.251CS..EExtended strand (participates in β ladder)trans-153.9142.2-175.4-174.70000109.8M191 Q192S132-M191 WeakPolarHBondContact O-CA 3.46Å; S132-Q192 PolarHBondContact N-O 2.78Å; S132-Q192 PolarHBondContact O-N 2.82Å
133C93.8Very high89.8Confident2 Ų255.8 Ų55.81%0.01429%0.287CS..EExtended strand (participates in β ladder)trans-143121.6171.8-176.50000109.1L130 G153 D154 C155 I189 F190 M191L130-C133 HydrophobicContact CD1-CB 4.49Å; L130-C133 HydrophobicContact CD2-CB 4.24Å; C133-G153 CarbonylContact O-C 3.42Å; C133-G153 WeakPolarHBondContact O-CA 3.35Å; C133-D154 PolarHBondContact O-N 2.86Å; C133-C155 HydrophobicContact CB-CB 3.64Å; C133-C155 WeakPolarHBondContact CB-SG 3.45Å; C133-C155 PolarHBondContact O-SG 2.85Å; C133-C155 WeakPolarHBondContact SG-CB 3.44Å; C133-C155 CovalentContact SG-SG 2.03Å; C133-C155 PolarHBondContact SG-SG 2.82Å; C133-I189 VanDerWaalsContact SG-CD1 3.59Å; C133-F190 WeakPolarHBondContact CA-O 3.36Å; C133-M191 HydrophobicContact CB-CG 3.97Å; C133-M191 VanDerWaalsContact SG-CG 3.51Å
134K93.9Very high89Confident71 Ų7158.9 Ų58.931%0.30930%0.303SS..EExtended strand (participates in β ladder)trans-142.5141.2-179.7-67.9-175.4178.7174.70111.9E152 C155 I189 F190K134-E152 WeakPolarHBondContact CE-O 3.44Å; K134-E152 PolarHBondContact NZ-O 3.04Å; K134-C155 PolarHBondContact N-SG 2.71Å; K134-I189 WeakPolarHBondContact O-CA 3.47Å; K134-F190 PolarHBondContact N-O 2.76Å; K134-F190 PolarHBondContact O-N 3.1Å
135H93.9Very high88.2Confident30 Ų3063.1 Ų63.114%0.13933%0.329CS..EExtended strand (participates in β ladder)trans-82.3136167-71.1-107.8000109.6R178 E187 L188H135-R178 PolarHBondContact CE1-O 3.39Å; H135-R178 PolarHBondContact NE2-O 2.95Å; H135-E187 IonicContact CE1-OE1 2.71Å; H135-E187 PolarHBondContact CE1-OE1 3.1Å; H135-E187 IonicContact CG-OE1 3.18Å; H135-E187 IonicContact ND1-OE1 3.02Å; H135-E187 PolarHBondContact ND1-OE1 2.7Å; H135-L188 CarbonylContact C-O 3.54Å; H135-L188 WeakPolarHBondContact CA-O 3.48Å
136H93.4Very high87.7Confident29 Ų2968.2 Ų68.213%0.13436%0.357CS..EExtended strand (participates in β ladder)trans-126.1159171-60-80.5000109.7I141 P142 E187 L188H136-I141 HydrophobicContact CB-CG1 4.42Å; H136-P142 WeakPolarHBondContact CE1-CD 3.45Å; H136-E187 CarbonylContact O-C 3.54Å; H136-E187 WeakPolarHBondContact O-CA 3.38Å; H136-L188 HydrophobicContact CB-CD1 3.63Å; H136-L188 HydrophobicContact CB-CG 4.08Å; H136-L188 PolarHBondContact N-O 3.17Å; H136-L188 PolarHBondContact O-N 3.43Å
137Y92.5Very high87.5Confident110 Ų11066.1 Ų66.143%0.43135%0.347SS..  trans-126.6157.1-179-59.4-89.4000109.7D139 N140 N185 E187Y137-D139 VanDerWaalsContact C-N 3.32Å; Y137-D139 PolarHBondContact O-N 2.64Å; Y137-N140 PolarHBondContact O-N 2.83Å; Y137-N185 HydrophobicContact CD1-CB 4.09Å; Y137-E187 HydrophobicContact CD1-CB 3.88Å; Y137-E187 HydrophobicContact CD1-CG 4.03Å; Y137-E187 HydrophobicContact CE1-CB 3.79Å; Y137-E187 HydrophobicContact CE1-CG 3.56Å
138H88.3Confident87.2Confident128 Ų12861.1 Ų61.159%0.59333%0.326SS*.THydrogen-bonded Turntrans59.836.5176.1-46.2-57.3000114.3N140 N185 K186H138-N140 PolarHBondContact O-N 2.83Å; H138-N185 PolarHBondContact N-O 3.25Å; H138-N185 PolarHBondContact ND1-O 2.58Å; H138-K186 PolarHBondContact N-O 2.88Å
139D78.8Confident86.9Confident65 Ų6564.1 Ų64.135%0.34834%0.344SS..THydrogen-bonded Turntrans58.313-179.4-55.9-27.9000115.1Y137 I141 K186Y137-D139 VanDerWaalsContact C-N 3.32Å; Y137-D139 PolarHBondContact O-N 2.64Å; D139-I141 PolarHBondContact O-N 3.5Å; D139-K186 VanDerWaalsContact CG-CD 3.44Å; D139-K186 WeakPolarHBondContact OD1-CD 3.19Å; D139-K186 WeakPolarHBondContact OD2-CD 3.45Å; D139-K186 IonicContact OD2-NZ 2.73Å; D139-K186 PolarHBondContact OD2-NZ 3.36Å
140N80.8Confident86.7Confident114 Ų11463 Ų6361%0.6135%0.348SS*.  trans-9793.5-173.5-170.322.1000111.6Y137 H138Y137-N140 PolarHBondContact O-N 2.83Å; H138-N140 PolarHBondContact O-N 2.83Å
141I84.3Confident86.3Confident25 Ų2563.3 Ų63.313%0.12835%0.348CS..  trans-93.3115.9168-67165.1000108H136 D139 L188 F190 W245 V289H136-I141 HydrophobicContact CB-CG1 4.42Å; D139-I141 PolarHBondContact O-N 3.5Å; I141-L188 HydrophobicContact CD1-CD1 3.53Å; I141-L188 HydrophobicContact CD1-CD2 3.96Å; I141-L188 HydrophobicContact CD1-CG 4.44Å; I141-L188 HydrophobicContact CG1-CD1 3.64Å; I141-L188 HydrophobicContact CG1-CD2 4.17Å; I141-F190 HydrophobicContact CD1-CB 4.33Å; I141-F190 HydrophobicContact CG2-CD1 4.38Å; I141-F190 HydrophobicContact CG2-CG 4.43Å; I141-W245 HydrophobicContact CD1-CH2 4.41Å; I141-V289 HydrophobicContact CD1-CG1 4.12Å; I141-V289 HydrophobicContact CD1-CG2 3.62Å
142P83.3Confident85.8Confident69 Ų6971.3 Ų71.345%0.44839%0.385SS..PPolyproline II helixtrans-62.2155178.327.6-33.5000110.6H136 L144H136-P142 WeakPolarHBondContact CE1-CD 3.45Å; P142-L144 PolarHBondContact O-N 3.33Å
143P82.4Confident85.1Confident116 Ų11673 Ų7375%0.75340%0.404SS*.PPolyproline II helixtrans-52.8140.4172.8-24.734000111.4V145P143-V145 PolarHBondContact O-N 2.79Å
144L81.9Confident84.7Confident65 Ų6579.4 Ų79.434%0.3444%0.438SS..PPolyproline II helixtrans-60.5123175.5-74.8163000109.8P142 F190 F272 F287P142-L144 PolarHBondContact O-N 3.33Å; L144-F190 HydrophobicContact CD2-CE1 3.71Å; L144-F190 HydrophobicContact CD2-CZ 3.81Å; L144-F272 HydrophobicContact CD1-CD2 4.23Å; L144-F272 HydrophobicContact CD1-CE2 3.66Å; L144-F287 HydrophobicContact CD1-CD1 4.26Å; L144-F287 HydrophobicContact CD1-CE1 3.71Å; L144-F287 HydrophobicContact CD1-CZ 4.1Å; L144-F287 HydrophobicContact CD2-CE1 4.09Å
145V77.9Confident84.6Confident100 Ų10077.1 Ų77.161%0.60643%0.431SS*.SBendtrans-100.3125.5169.6-175.10000106.8P143 Q151P143-V145 PolarHBondContact O-N 2.79Å; V145-Q151 PolarHBondContact O-NE2 2.8Å
146D81.1Confident84.7Confident112 Ų11280.3 Ų80.360%0.59945%0.446SS*.SBendtrans47.562177-54.9-33.6000115.3G148 T149D146-G148 PolarHBondContact O-N 3.3Å; D146-T149 HydrophobicContact CB-CG2 4.4Å; D146-T149 PolarHBondContact O-N 3.04Å; D146-T149 PolarHBondContact O-OG1 2.9Å
147P83Confident84.8Confident26 Ų2682.3 Ų82.317%0.16946%0.456CS..THydrogen-bonded Turntrans-58.7137.4179.523.7-30.5000111.1F272 R276 L285 F287P147-F272 HydrophobicContact CB-CZ 4.07Å; P147-F272 HydrophobicContact CG-CZ 4.05Å; P147-R276 HydrophobicContact CG-CG 4.08Å; P147-R276 WeakPolarHBondContact O-CD 3.46Å; P147-L285 HydrophobicContact CB-CD1 3.87Å; P147-F287 HydrophobicContact CB-CZ 4.47Å
148G80.4Confident84.9Confident24 Ų2478 Ų7825%0.24744%0.442CS..THydrogen-bonded Turntrans98.1-11.4-179.800000113.7D146D146-G148 PolarHBondContact O-N 3.3Å
149T84.4Confident85.2Confident65 Ų6578 Ų7840%0.39944%0.442SS..SBendtrans-90.8142.617063.20000110.8D146 Q151D146-T149 HydrophobicContact CB-CG2 4.4Å; D146-T149 PolarHBondContact O-N 3.04Å; D146-T149 PolarHBondContact O-OG1 2.9Å; T149-Q151 PolarHBondContact O-N 2.95Å
150P87Confident86Confident107 Ų10775.2 Ų75.270%0.69543%0.427SS*.  trans-60.6133.7170.5-22.132.9000110.7L131L131-P150 HydrophobicContact CD2-CB 4.39Å; L131-P150 HydrophobicContact CD2-CG 3.91Å; L131-P150 WeakPolarHBondContact O-CA 3.39Å
151Q84.8Confident86.7Confident57 Ų5772.7 Ų72.727%0.26642%0.416SS..  trans-121.3150.3176.3-58.1-177.29.400109.7L131 V145 T149 G153L131-Q151 PolarHBondContact O-N 2.82Å; V145-Q151 PolarHBondContact O-NE2 2.8Å; T149-Q151 PolarHBondContact O-N 2.95Å; Q151-G153 PolarHBondContact O-N 2.88Å; Q151-G153 VanDerWaalsContact O-N 3.17Å
152E81.8Confident87.1Confident178 Ų17871.7 Ų71.783%0.83241%0.411SS*.  trans-61.2120.7174.2-168.9168.8-160.200109.8K134K134-E152 WeakPolarHBondContact CE-O 3.44Å; K134-E152 PolarHBondContact NZ-O 3.04Å
153G79.2Confident87.5Confident41 Ų4173.9 Ų73.942%0.42341%0.413SS..  trans-97.4146.9178.700000111.6C133 Q151C133-G153 CarbonylContact O-C 3.42Å; C133-G153 WeakPolarHBondContact O-CA 3.35Å; Q151-G153 PolarHBondContact O-N 2.88Å; Q151-G153 VanDerWaalsContact O-N 3.17Å
154D85.9Confident87.8Confident136 Ų13668.6 Ų68.673%0.72738%0.38SS*.  trans-109.730.2178.3-169.926.2000111.1C133C133-D154 PolarHBondContact O-N 2.86Å
155C92.1Very high88.1Confident23 Ų2366.2 Ų66.216%0.15537%0.369CS..  trans-104.8144.1-177-65.90000111.4C133 K134 I157 V177C133-C155 HydrophobicContact CB-CB 3.64Å; C133-C155 WeakPolarHBondContact CB-SG 3.45Å; C133-C155 PolarHBondContact O-SG 2.85Å; C133-C155 WeakPolarHBondContact SG-CB 3.44Å; C133-C155 CovalentContact SG-SG 2.03Å; C133-C155 PolarHBondContact SG-SG 2.82Å; K134-C155 PolarHBondContact N-SG 2.71Å; C155-I157 HydrophobicContact CB-CD1 4.25Å; C155-I157 HydrophobicContact CB-CG1 3.99Å; C155-I157 PolarHBondContact O-N 2.86Å; C155-V177 HydrophobicContact CB-CG1 4Å
156E95.1Very high88.5Confident97 Ų9768.3 Ų68.345%0.45337%0.37SS..  trans-81.1117.1166.8-168179.5177.900109.5R178 F213E156-R178 HydrophobicContact CB-CB 4.07Å; E156-R178 PolarHBondContact O-N 2.77Å; E156-R178 WeakPolarHBondContact OE2-CD 3.36Å; E156-F213 HydrophobicContact CG-CE1 3.99Å; E156-F213 HydrophobicContact CG-CZ 4.2Å
157I95Very high88.3Confident70 Ų7066.1 Ų66.136%0.35936%0.36SS..EExtended strand (participates in β ladder)trans-125.5138.6-172.4-53.2171.3000109.3L130 C155 V175 V176 V177L130-I157 HydrophobicContact CD2-CD1 3.55Å; C155-I157 HydrophobicContact CB-CD1 4.25Å; C155-I157 HydrophobicContact CB-CG1 3.99Å; C155-I157 PolarHBondContact O-N 2.86Å; I157-V175 HydrophobicContact CG2-CG1 3.56Å; I157-V176 CarbonylContact C-O 3.59Å; I157-V176 WeakPolarHBondContact CA-O 3.48Å; I157-V177 HydrophobicContact CG1-CG1 4.45Å; I157-V177 HydrophobicContact CG1-CG2 4.2Å; I157-V177 HydrophobicContact CG2-CG2 4.4Å
158T95.2Very high87.6Confident21 Ų2173.2 Ų73.213%0.12939%0.391CS..EExtended strand (participates in β ladder)trans-131.5123.3172.1-65.60000109.6V160 V176 L216 I217 K222T158-V160 HydrophobicContact CG2-CG2 3.94Å; T158-V176 PolarHBondContact N-O 3.24Å; T158-V176 WeakPolarHBondContact O-CB 3.32Å; T158-V176 PolarHBondContact O-N 2.78Å; T158-L216 HydrophobicContact CG2-CD2 4.41Å; T158-I217 WeakPolarHBondContact OG1-CD1 3.13Å; T158-K222 HydrophobicContact CG2-CD 4.22Å
159E95.4Very high87.1Confident127 Ų12783.3 Ų83.359%0.59342%0.422SS*.EExtended strand (participates in β ladder)trans-88.3132.6172.6-62.2-168.817700110.7A174 V175E159-A174 WeakPolarHBondContact CA-O 3.49Å; E159-V175 HydrophobicContact CG-CG2 4.38Å
160V95.1Very high87.1Confident6 Ų685.9 Ų85.94%0.03643%0.428CS..EExtended strand (participates in β ladder)trans-133.3128.2178.9-173.80000109.6T158 A174 L216 K222 M226T158-V160 HydrophobicContact CG2-CG2 3.94Å; V160-A174 PolarHBondContact N-O 2.78Å; V160-A174 PolarHBondContact O-N 3.4Å; V160-L216 HydrophobicContact CG2-CD1 4.32Å; V160-L216 HydrophobicContact CG2-CD2 4.42Å; V160-K222 HydrophobicContact CG1-CB 4.03Å; V160-K222 HydrophobicContact CG2-CB 4.12Å; V160-K222 HydrophobicContact CG2-CD 4.38Å; V160-M226 HydrophobicContact CB-CG 4.11Å; V160-M226 HydrophobicContact CG1-CB 4.43Å; V160-M226 HydrophobicContact CG1-CG 3.8Å; V160-M226 HydrophobicContact CG2-CG 4.39Å
161T94.7Very high87.2Confident61 Ų6186.6 Ų86.637%0.37442%0.422SS..EExtended strand (participates in β ladder)trans-107.7128.8174.3-53.30000109.3Q171 K172 S223T161-Q171 VanDerWaalsContact CG2-CD 3.46Å; T161-Q171 HydrophobicContact CG2-CG 3.36Å; T161-K172 WeakPolarHBondContact CA-O 3.45Å; T161-S223 PolarHBondContact O-OG 3.2Å
162Y93.7Very high87.5Confident5 Ų585.9 Ų85.92%0.0242%0.418CS..EExtended strand (participates in β ladder)trans-151.7167.5-177.573.2-79.6000112F124 K172 A174 M226 R227 E230F124-Y162 AromaticContact CE1-CE1 3.96Å; F124-Y162 HydrophobicContact CE1-CE1 3.96Å; F124-Y162 WeakPolarHBondContact CE1-OH 3.48Å; F124-Y162 WeakPolarHBondContact CZ-OH 3.35Å; Y162-K172 HydrophobicContact CE1-CB 4.47Å; Y162-K172 PolarHBondContact N-O 2.82Å; Y162-K172 PolarHBondContact O-N 2.83Å; Y162-A174 HydrophobicContact CE1-CB 4.11Å; Y162-M226 HydrophobicContact CD1-CB 3.73Å; Y162-M226 HydrophobicContact CD1-CG 4.46Å; Y162-M226 HydrophobicContact CD2-CB 4.33Å; Y162-M226 HydrophobicContact CE1-CB 3.81Å; Y162-M226 HydrophobicContact CE1-CE 4.3Å; Y162-M226 HydrophobicContact CE2-CB 4.4Å; Y162-M226 HydrophobicContact CG-CB 4.02Å; Y162-R227 HydrophobicContact CD2-CB 4.05Å; Y162-R227 HydrophobicContact CE2-CB 4.46Å; Y162-E230 WeakPolarHBondContact CE2-OE2 3.46Å; Y162-E230 VanDerWaalsContact CZ-OE2 3.28Å; Y162-E230 PolarHBondContact OH-OE2 3.04Å
163F91.8Very high88Confident114 Ų11481.8 Ų81.850%0.539%0.394SS..EExtended strand (participates in β ladder)trans-96.3126.2174.5-69.6-83.6000109.9Q171F163-Q171 HydrophobicContact CD1-CB 4.26Å; F163-Q171 HydrophobicContact CE1-CB 3.81Å; F163-Q171 HydrophobicContact CE1-CG 4.37Å; F163-Q171 HydrophobicContact CZ-CB 4.22Å; F163-Q171 HydrophobicContact CZ-CG 4.35Å
164G87.3Confident88.8Confident5 Ų579.8 Ų79.85%0.05237%0.374CS..  trans-62.7145.4-176.900000112.5F166G164-F166 VanDerWaalsContact C-N 3.28Å; G164-F166 PolarHBondContact O-N 2.81Å
165P88.4Confident89.3Confident16 Ų1673.7 Ų73.710%0.10434%0.342CS..SBendtrans-70.6-22.2-177.629.4-34.6000113.9R227 E230 R231P165-R227 HydrophobicContact CB-CG 4.01Å; P165-R227 HydrophobicContact CG-CG 4.48Å; P165-E230 VanDerWaalsContact CD-OE2 3.3Å; P165-E230 WeakPolarHBondContact CD-OE2 3.5Å; P165-E230 HydrophobicContact CG-CB 3.98Å; P165-E230 HydrophobicContact CG-CG 3.92Å; P165-R231 HydrophobicContact CB-CG 3.43Å; P165-R231 VanDerWaalsContact CB-CG 3.43Å; P165-R231 VanDerWaalsContact CB-NE 3.3Å; P165-R231 HydrophobicContact CG-CG 3.67Å
166F86.4Confident89.5Confident143 Ų14372.6 Ų72.663%0.62733%0.334SS*.SBendtrans-102.8-14.3-177.1-52.5-65.4000113.4G164 E230G164-F166 VanDerWaalsContact C-N 3.28Å; G164-F166 PolarHBondContact O-N 2.81Å; F166-E230 HydrophobicContact CE2-CG 4.22Å
167T76.9Confident89.6Confident66 Ų6668 Ų6841%0.40531%0.313SS..  trans-132.286.5-177.640.40000108.8R169 K170T167-R169 PolarHBondContact O-N 2.86Å; T167-K170 PolarHBondContact O-N 2.91Å
168E68.6Low89.7Confident176 Ų17668.1 Ų68.182%0.82231%0.309SS*.THydrogen-bonded Turntrans-60.8-4.4-170-63.7-174.8163.100115.2
169R71Confident89.8Confident236 Ų23667.1 Ų67.189%0.89130%0.303SS*.THydrogen-bonded Turntrans-124.8-4.1-174.9-59.3-174.9-176.4-177.90.6115.1T167T167-R169 PolarHBondContact O-N 2.86Å
170K83.5Confident89.8Confident119 Ų11961 Ų6152%0.51727%0.274SS..  trans-103.5113.1179.5-165.9175.5-180-1750109.8T167T167-K170 PolarHBondContact O-N 2.91Å
171Q89.3Confident89.8Confident121 Ų12161.8 Ų61.857%0.56528%0.28SS*.EExtended strand (participates in β ladder)trans-70.7128.3167.9-169.2173.631.100108.2T161 F163T161-Q171 VanDerWaalsContact CG2-CD 3.46Å; T161-Q171 HydrophobicContact CG2-CG 3.36Å; F163-Q171 HydrophobicContact CD1-CB 4.26Å; F163-Q171 HydrophobicContact CE1-CB 3.81Å; F163-Q171 HydrophobicContact CE1-CG 4.37Å; F163-Q171 HydrophobicContact CZ-CB 4.22Å; F163-Q171 HydrophobicContact CZ-CG 4.35Å
172K90.3Very high89.7Confident43 Ų4360.8 Ų60.819%0.18727%0.272CS..EExtended strand (participates in β ladder)trans-111.8141.6178.7-65.7-176.1177.5-175.20109.5T161 Y162 E230T161-K172 WeakPolarHBondContact CA-O 3.45Å; Y162-K172 HydrophobicContact CE1-CB 4.47Å; Y162-K172 PolarHBondContact N-O 2.82Å; Y162-K172 PolarHBondContact O-N 2.83Å; K172-E230 IonicContact NZ-OE1 3.65Å; K172-E230 PolarHBondContact NZ-OE1 3.29Å; K172-E230 IonicContact NZ-OE2 2.98Å
173R93.7Very high89.5Confident91 Ų9161.5 Ų61.534%0.34328%0.277SS..EExtended strand (participates in β ladder)trans-104.5121.4171.3-178.9175.666.5153.30.1108.5D126D126-R173 PolarHBondContact O-NH2 2.91Å
174A95.4Very high89.4Confident0 Ų062.5 Ų62.50%028%0.281CS..EExtended strand (participates in β ladder)trans-112130.6174.600000110.3L123 F124 E159 V160 Y162 V176 M226L123-A174 CarbonylContact O-C 3.44Å; L123-A174 VanDerWaalsContact O-CA 3.29Å; L123-A174 WeakPolarHBondContact O-CA 3.5Å; F124-A174 HydrophobicContact CD1-CB 4.11Å; F124-A174 HydrophobicContact CE1-CB 3.73Å; F124-A174 HydrophobicContact CZ-CB 4.29Å; E159-A174 WeakPolarHBondContact CA-O 3.49Å; V160-A174 PolarHBondContact N-O 2.78Å; V160-A174 PolarHBondContact O-N 3.4Å; Y162-A174 HydrophobicContact CE1-CB 4.11Å; A174-V176 HydrophobicContact CB-CG2 4.47Å; A174-M226 HydrophobicContact CB-CE 4Å
175V96.2Very high89.6Confident7 Ų765.6 Ų65.64%0.04230%0.297CS..EExtended strand (participates in β ladder)trans-99.4107.6169.81800000106.9L123 P125 I157 E159 V177L123-V175 WeakPolarHBondContact CB-O 3.35Å; L123-V175 PolarHBondContact N-O 2.86Å; L123-V175 PolarHBondContact O-N 3.18Å; P125-V175 HydrophobicContact CG-CG2 3.82Å; I157-V175 HydrophobicContact CG2-CG1 3.56Å; E159-V175 HydrophobicContact CG-CG2 4.38Å; V175-V177 HydrophobicContact CG1-CG2 4.36Å
176V97.1Very high89.7Confident0 Ų070.1 Ų70.10%032%0.315CS..EExtended strand (participates in β ladder)trans-98.8125.6-177.5-168.10000110I121 A122 I157 T158 A174 F210 F213 L216 M226I121-V176 CarbonylContact O-C 3.54Å; I121-V176 WeakPolarHBondContact O-CA 3.44Å; A122-V176 HydrophobicContact CB-CG1 4.49Å; A122-V176 HydrophobicContact CB-CG2 3.98Å; I157-V176 CarbonylContact C-O 3.59Å; I157-V176 WeakPolarHBondContact CA-O 3.48Å; T158-V176 PolarHBondContact N-O 3.24Å; T158-V176 WeakPolarHBondContact O-CB 3.32Å; T158-V176 PolarHBondContact O-N 2.78Å; A174-V176 HydrophobicContact CB-CG2 4.47Å; V176-F210 HydrophobicContact CG1-CE1 3.66Å; V176-F210 HydrophobicContact CG1-CZ 3.7Å; V176-F213 HydrophobicContact CB-CE2 4.46Å; V176-F213 HydrophobicContact CG1-CD2 4.03Å; V176-F213 HydrophobicContact CG1-CE2 3.88Å; V176-L216 HydrophobicContact CB-CD2 3.84Å; V176-L216 HydrophobicContact CG1-CD2 3.76Å; V176-L216 HydrophobicContact CG2-CD2 3.88Å; V176-M226 HydrophobicContact CG2-CE 4.06Å; V176-M226 HydrophobicContact CG2-SD 4.08Å
177V97.1Very high90.1Very high0 Ų063.8 Ų63.80%029%0.287CS..EExtended strand (participates in β ladder)trans-115.9140-178.7-172.70000109.8I121 L123 C155 I157 V175 G179 I189 M191I121-V177 PolarHBondContact N-O 2.89Å; I121-V177 PolarHBondContact O-N 2.92Å; L123-V177 HydrophobicContact CD1-CG2 3.82Å; C155-V177 HydrophobicContact CB-CG1 4Å; I157-V177 HydrophobicContact CG1-CG1 4.45Å; I157-V177 HydrophobicContact CG1-CG2 4.2Å; I157-V177 HydrophobicContact CG2-CG2 4.4Å; V175-V177 HydrophobicContact CG1-CG2 4.36Å; V177-G179 PolarHBondContact O-N 2.81Å; V177-I189 HydrophobicContact CG1-CD1 3.4Å; V177-M191 HydrophobicContact CB-SD 4.21Å; V177-M191 HydrophobicContact CG1-SD 4.21Å; V177-M191 HydrophobicContact CG2-SD 3.87Å
178R97.3Very high90.9Very high73 Ų7360.6 Ų60.628%0.27527%0.268SS..EExtended strand (participates in β ladder)trans-67.6115.8171.1-177-175.5175.8-77.95.6109.8P118 H135 E156 I189 F213P118-R178 HydrophobicContact CB-CG 3.67Å; P118-R178 HydrophobicContact CG-CG 4.45Å; P118-R178 VanDerWaalsContact CG-CZ 3.42Å; H135-R178 PolarHBondContact CE1-O 3.39Å; H135-R178 PolarHBondContact NE2-O 2.95Å; E156-R178 HydrophobicContact CB-CB 4.07Å; E156-R178 PolarHBondContact O-N 2.77Å; E156-R178 WeakPolarHBondContact OE2-CD 3.36Å; R178-I189 WeakPolarHBondContact O-CD1 3.38Å; R178-F213 HydrophobicContact CB-CD1 3.96Å; R178-F213 HydrophobicContact CB-CD2 4.2Å; R178-F213 HydrophobicContact CB-CE1 4.12Å; R178-F213 HydrophobicContact CB-CE2 4.35Å; R178-F213 HydrophobicContact CB-CG 3.99Å; R178-F213 HydrophobicContact CB-CZ 4.31Å; R178-F213 HydrophobicContact CG-CB 4.38Å; R178-F213 HydrophobicContact CG-CD1 4.11Å; R178-F213 HydrophobicContact CG-CG 4.21Å
179G96.3Very high92.2Very high0 Ų052.2 Ų52.20%023%0.228CC..  trans-76.3177.7178.700000114.3P119 V177P119-G179 WeakPolarHBondContact O-CA 3.36Å; P119-G179 PolarHBondContact O-N 3.03Å; V177-G179 PolarHBondContact O-N 2.81Å
180P95.5Very high93.3Very high0 Ų041.5 Ų41.50%019%0.188CC..  trans-68.9154.7178.830.3-37.6000112.3P119 E187 M248 W292P119-P180 WeakPolarHBondContact CD-O 3.25Å; P180-E187 HydrophobicContact CB-CB 4Å; P180-E187 HydrophobicContact CB-CG 3.72Å; P180-E187 WeakPolarHBondContact CB-O 3.44Å; P180-M248 HydrophobicContact CG-CE 3.26Å; P180-W292 PolarHBondContact O-NE1 3.44Å
181S95Very high93.9Very high21 Ų2135.9 Ų35.915%0.14716%0.164CC..  trans-125.6-36.8-176.51790000112.3S115 F116 V183 E187S115-S181 WeakPolarHBondContact CA-O 3.12Å; F116-S181 PolarHBondContact N-O 2.86Å; F116-S181 WeakPolarHBondContact O-CB 3.09Å; F116-S181 PolarHBondContact O-OG 2.87Å; S181-V183 PolarHBondContact O-N 2.59Å; S181-E187 PolarHBondContact N-OE2 2.85Å
182D92.4Very high94.1Very high40 Ų4030.1 Ų30.121%0.21414%0.137CC..  trans-94.899.7-171.2-171.1-15.7000112.2K184 N185 K186 E187D182-K184 PolarHBondContact OD1-N 2.82Å; D182-N185 PolarHBondContact OD1-N 3.26Å; D182-N185 WeakPolarHBondContact OD2-CB 3.45Å; D182-N185 PolarHBondContact OD2-ND2 3.05Å; D182-K186 PolarHBondContact O-N 3.23Å; D182-E187 HydrophobicContact CB-CB 4.1Å; D182-E187 PolarHBondContact N-OE2 2.98Å; D182-E187 WeakPolarHBondContact O-CB 3.4Å; D182-E187 PolarHBondContact O-N 3.32Å
183V90.6Very high94.3Very high21 Ų2128 Ų2813%0.12713%0.128CC..THydrogen-bonded Turntrans-77.2-30.5179-170.30000111.8F116 S181 K186 W292 P295F116-V183 HydrophobicContact CD2-CG2 3.34Å; F116-V183 HydrophobicContact CE2-CG2 3.42Å; F116-V183 VanDerWaalsContact CE2-CG2 3.42Å; S181-V183 PolarHBondContact O-N 2.59Å; V183-K186 PolarHBondContact O-N 3.39Å; V183-K186 VanDerWaalsContact O-N 3.08Å; V183-W292 HydrophobicContact CB-CB 4.39Å; V183-W292 HydrophobicContact CG1-CB 4.12Å; V183-W292 HydrophobicContact CG2-CB 3.51Å; V183-W292 HydrophobicContact CG2-CG 3.63Å; V183-P295 HydrophobicContact CG1-CB 4.13Å
184K88.8Confident94.2Very high134 Ų13424.3 Ų24.358%0.58312%0.116SC*.THydrogen-bonded Turntrans-65.9-42.7-178.4-71.7-171.7178.5179.30111.1D114 D182 K186D114-K184 WeakPolarHBondContact OD1-CE 3.29Å; D114-K184 IonicContact OD1-NZ 2.72Å; D114-K184 PolarHBondContact OD1-NZ 2.67Å; D182-K184 PolarHBondContact OD1-N 2.82Å; K184-K186 PolarHBondContact O-N 2.84Å
185N91.1Very high93.9Very high71 Ų7124.7 Ų24.738%0.3812%0.118SC..THydrogen-bonded Turntrans-83.65.7175.4-69.5-41.8000113.3Y137 H138 D182 E187Y137-N185 HydrophobicContact CD1-CB 4.09Å; H138-N185 PolarHBondContact N-O 3.25Å; H138-N185 PolarHBondContact ND1-O 2.58Å; D182-N185 PolarHBondContact OD1-N 3.26Å; D182-N185 WeakPolarHBondContact OD2-CB 3.45Å; D182-N185 PolarHBondContact OD2-ND2 3.05Å; N185-E187 VanDerWaalsContact C-N 3.31Å; N185-E187 PolarHBondContact O-N 2.84Å
186K91.1Very high93.4Very high111 Ų11129.9 Ų29.948%0.48315%0.145SC..THydrogen-bonded Turntrans49.154.1-176.2-55.5-171.6178.7179.60111.6H138 D139 D182 V183 K184 L188H138-K186 PolarHBondContact N-O 2.88Å; D139-K186 VanDerWaalsContact CG-CD 3.44Å; D139-K186 WeakPolarHBondContact OD1-CD 3.19Å; D139-K186 WeakPolarHBondContact OD2-CD 3.45Å; D139-K186 IonicContact OD2-NZ 2.73Å; D139-K186 PolarHBondContact OD2-NZ 3.36Å; D182-K186 PolarHBondContact O-N 3.23Å; V183-K186 PolarHBondContact O-N 3.39Å; V183-K186 VanDerWaalsContact O-N 3.08Å; K184-K186 PolarHBondContact O-N 2.84Å; K186-L188 PolarHBondContact O-N 3.24Å
187E94.3Very high92.1Very high9 Ų938 Ų384%0.04218%0.183CC..  trans-65.3132.1173-171.7-170.7170.700109.5H135 H136 Y137 P180 S181 D182 N185H135-E187 IonicContact CE1-OE1 2.71Å; H135-E187 PolarHBondContact CE1-OE1 3.1Å; H135-E187 IonicContact CG-OE1 3.18Å; H135-E187 IonicContact ND1-OE1 3.02Å; H135-E187 PolarHBondContact ND1-OE1 2.7Å; H136-E187 CarbonylContact O-C 3.54Å; H136-E187 WeakPolarHBondContact O-CA 3.38Å; Y137-E187 HydrophobicContact CD1-CB 3.88Å; Y137-E187 HydrophobicContact CD1-CG 4.03Å; Y137-E187 HydrophobicContact CE1-CB 3.79Å; Y137-E187 HydrophobicContact CE1-CG 3.56Å; P180-E187 HydrophobicContact CB-CB 4Å; P180-E187 HydrophobicContact CB-CG 3.72Å; P180-E187 WeakPolarHBondContact CB-O 3.44Å; S181-E187 PolarHBondContact N-OE2 2.85Å; D182-E187 HydrophobicContact CB-CB 4.1Å; D182-E187 PolarHBondContact N-OE2 2.98Å; D182-E187 WeakPolarHBondContact O-CB 3.4Å; D182-E187 PolarHBondContact O-N 3.32Å; N185-E187 VanDerWaalsContact C-N 3.31Å; N185-E187 PolarHBondContact O-N 2.84Å
188L94.5Very high90.8Very high0 Ų039.8 Ų39.80%019%0.194CC..EExtended strand (participates in β ladder)trans-134.3157.7172.764.379.1000109.2H135 H136 I141 K186 F190 W245 V289 F290 E291H135-L188 CarbonylContact C-O 3.54Å; H135-L188 WeakPolarHBondContact CA-O 3.48Å; H136-L188 HydrophobicContact CB-CD1 3.63Å; H136-L188 HydrophobicContact CB-CG 4.08Å; H136-L188 PolarHBondContact N-O 3.17Å; H136-L188 PolarHBondContact O-N 3.43Å; I141-L188 HydrophobicContact CD1-CD1 3.53Å; I141-L188 HydrophobicContact CD1-CD2 3.96Å; I141-L188 HydrophobicContact CD1-CG 4.44Å; I141-L188 HydrophobicContact CG1-CD1 3.64Å; I141-L188 HydrophobicContact CG1-CD2 4.17Å; K186-L188 PolarHBondContact O-N 3.24Å; L188-F190 HydrophobicContact CD1-CB 4.49Å; L188-W245 HydrophobicContact CD2-CZ2 3.98Å; L188-V289 HydrophobicContact CB-CG1 4.07Å; L188-V289 HydrophobicContact CD1-CG1 4Å; L188-V289 HydrophobicContact CD2-CG1 4.24Å; L188-V289 HydrophobicContact CG-CG1 4.34Å; L188-F290 VanDerWaalsContact CA-O 3.27Å; L188-F290 WeakPolarHBondContact CA-O 3.38Å; L188-E291 HydrophobicContact CB-CB 3.96Å
189I95.4Very high89.5Confident0 Ų046 Ų460%023%0.226CC..EExtended strand (participates in β ladder)trans-117127.3173.6-170.5175.6000108.7I121 C133 K134 V177 R178 M191 V289 F290I121-I189 HydrophobicContact CD1-CG2 3.87Å; C133-I189 VanDerWaalsContact SG-CD1 3.59Å; K134-I189 WeakPolarHBondContact O-CA 3.47Å; V177-I189 HydrophobicContact CG1-CD1 3.4Å; R178-I189 WeakPolarHBondContact O-CD1 3.38Å; I189-M191 HydrophobicContact CD1-SD 4.48Å; I189-M191 HydrophobicContact CG1-CG 4.39Å; I189-M191 HydrophobicContact CG2-CE 4.29Å; I189-V289 CarbonylContact O-C 3.6Å; I189-V289 VanDerWaalsContact O-CA 3.27Å; I189-V289 WeakPolarHBondContact O-CA 3.5Å; I189-F290 HydrophobicContact CG2-CB 3.65Å; I189-F290 HydrophobicContact CG2-CD2 4.28Å; I189-F290 HydrophobicContact CG2-CG 4.42Å; I189-F290 PolarHBondContact N-O 3.25Å; I189-F290 PolarHBondContact O-N 3.36Å
190F95.1Very high88.5Confident11 Ų1151.4 Ų51.45%0.04825%0.251CS..EExtended strand (participates in β ladder)trans-108.3125.4177.3177.5-120.1000109.6C133 K134 I141 L144 L188 F287 V289C133-F190 WeakPolarHBondContact CA-O 3.36Å; K134-F190 PolarHBondContact N-O 2.76Å; K134-F190 PolarHBondContact O-N 3.1Å; I141-F190 HydrophobicContact CD1-CB 4.33Å; I141-F190 HydrophobicContact CG2-CD1 4.38Å; I141-F190 HydrophobicContact CG2-CG 4.43Å; L144-F190 HydrophobicContact CD2-CE1 3.71Å; L144-F190 HydrophobicContact CD2-CZ 3.81Å; L188-F190 HydrophobicContact CD1-CB 4.49Å; F190-F287 HydrophobicContact CE2-CB 4.13Å; F190-F287 HydrophobicContact CE2-CD1 4.18Å; F190-F287 AromaticContact CZ-CD1 3.73Å; F190-F287 HydrophobicContact CZ-CD1 3.73Å; F190-F287 HydrophobicContact CZ-CE1 4.49Å; F190-V289 HydrophobicContact CD2-CG2 3.62Å; F190-V289 HydrophobicContact CE2-CG2 4.31Å
191M95.3Very high87.7Confident0 Ų058.7 Ų58.70%029%0.29CS..EExtended strand (participates in β ladder)trans-125.6140179.6-69.6175.7-77.500111I121 L123 L130 S132 C133 V177 I189 F193 V288 F290I121-M191 HydrophobicContact CD1-CE 4.33Å; I121-M191 HydrophobicContact CG2-CE 4.4Å; L123-M191 HydrophobicContact CD1-CE 4.11Å; L123-M191 HydrophobicContact CD1-SD 3.69Å; L130-M191 HydrophobicContact CD1-CB 4.08Å; L130-M191 HydrophobicContact CD1-CG 4.27Å; S132-M191 WeakPolarHBondContact O-CA 3.46Å; C133-M191 HydrophobicContact CB-CG 3.97Å; C133-M191 VanDerWaalsContact SG-CG 3.51Å; V177-M191 HydrophobicContact CB-SD 4.21Å; V177-M191 HydrophobicContact CG1-SD 4.21Å; V177-M191 HydrophobicContact CG2-SD 3.87Å; I189-M191 HydrophobicContact CD1-SD 4.48Å; I189-M191 HydrophobicContact CG1-CG 4.39Å; I189-M191 HydrophobicContact CG2-CE 4.29Å; M191-F193 HydrophobicContact CB-CE2 3.75Å; M191-F193 HydrophobicContact CB-CZ 4.29Å; M191-F193 HydrophobicContact SD-CZ 4.47Å; M191-V288 HydrophobicContact CB-CG1 3.87Å; M191-V288 HydrophobicContact CE-CG1 4.03Å; M191-V288 PolarHBondContact N-O 3.35Å; M191-V288 PolarHBondContact O-N 3.28Å; M191-F290 HydrophobicContact CE-CD2 3.43Å; M191-F290 VanDerWaalsContact CE-CD2 3.43Å; M191-F290 HydrophobicContact CE-CE2 3.46Å; M191-F290 VanDerWaalsContact CE-CE2 3.46Å
192Q93.9Very high87Confident0 Ų065.8 Ų65.80%032%0.319CS..EExtended strand (participates in β ladder)trans-122.8133.1177.7179.8174.7-12.500109.8L131 S132 F286 F287L131-Q192 HydrophobicContact CB-CB 4.45Å; L131-Q192 HydrophobicContact CB-CG 4.18Å; L131-Q192 HydrophobicContact CD1-CG 4.12Å; L131-Q192 PolarHBondContact N-O 2.71Å; S132-Q192 PolarHBondContact N-O 2.78Å; S132-Q192 PolarHBondContact O-N 2.82Å; Q192-F286 CarbonylContact C-O 3.59Å; Q192-F286 WeakPolarHBondContact CA-O 3.32Å; Q192-F287 HydrophobicContact CB-CD1 4.22Å; Q192-F287 HydrophobicContact CB-CE1 4.37Å; Q192-F287 HydrophobicContact CG-CD1 3.91Å; Q192-F287 HydrophobicContact CG-CE1 3.65Å
193F93.9Very high86.7Confident0 Ų065.5 Ų65.50%032%0.32CS..EExtended strand (participates in β ladder)trans-123.2154.9174.9-55.2-103.1000110.7L123 P125 Q129 L130 M191 I205 F238 L285 F286 V288L123-F193 HydrophobicContact CD1-CZ 3.92Å; L123-F193 HydrophobicContact CD2-CE2 4.27Å; L123-F193 HydrophobicContact CD2-CZ 3.87Å; L123-F193 HydrophobicContact CG-CZ 4.3Å; P125-F193 HydrophobicContact CB-CD1 4.43Å; Q129-F193 CarbonylContact O-C 3.57Å; Q129-F193 WeakPolarHBondContact O-CA 3.46Å; Q129-F193 WeakPolarHBondContact O-CB 3.39Å; L130-F193 HydrophobicContact CB-CD1 3.97Å; L130-F193 HydrophobicContact CB-CE1 3.8Å; L130-F193 HydrophobicContact CD1-CD1 3.98Å; L130-F193 HydrophobicContact CD1-CD2 4.36Å; L130-F193 HydrophobicContact CD1-CE1 3.49Å; L130-F193 VanDerWaalsContact CD1-CE1 3.49Å; L130-F193 HydrophobicContact CD1-CE2 3.9Å; L130-F193 HydrophobicContact CD1-CG 4.38Å; L130-F193 HydrophobicContact CD1-CZ 3.43Å; L130-F193 VanDerWaalsContact CD1-CZ 3.43Å; L130-F193 HydrophobicContact CG-CE1 4.21Å; M191-F193 HydrophobicContact CB-CE2 3.75Å; M191-F193 HydrophobicContact CB-CZ 4.29Å; M191-F193 HydrophobicContact SD-CZ 4.47Å; F193-I205 HydrophobicContact CB-CD1 3.81Å; F193-I205 HydrophobicContact CD1-CD1 4.02Å; F193-I205 HydrophobicContact CD2-CD1 4.16Å; F193-I205 HydrophobicContact CG-CD1 3.73Å; F193-F238 HydrophobicContact CD2-CE2 4.41Å; F193-F238 HydrophobicContact CD2-CZ 4.25Å; F193-F238 HydrophobicContact CE2-CZ 4.03Å; F193-L285 WeakPolarHBondContact O-CA 3.16Å; F193-F286 HydrophobicContact CB-CB 4.07Å; F193-F286 HydrophobicContact CB-CD2 4.14Å; F193-F286 HydrophobicContact CB-CG 4.41Å; F193-F286 HydrophobicContact CD2-CB 4.4Å; F193-F286 PolarHBondContact N-O 2.85Å; F193-F286 PolarHBondContact O-N 3.02Å; F193-V288 HydrophobicContact CE2-CG1 4.09Å
194S92.2Very high86.7Confident13 Ų1366.2 Ų66.29%0.09133%0.328CS..EExtended strand (participates in β ladder)trans-124.2139.8167.354.20000110.4A128 Q129 L131 Q284A128-S194 CarbonylContact C-O 3.58Å; A128-S194 WeakPolarHBondContact CA-O 3.48Å; Q129-S194 PolarHBondContact N-O 3.07Å; Q129-S194 PolarHBondContact O-N 2.78Å; L131-S194 WeakPolarHBondContact CD2-OG 3.3Å; L131-S194 WeakPolarHBondContact CG-OG 3.43Å; S194-Q284 WeakPolarHBondContact CA-O 3.33Å
195Q89.4Confident87Confident8 Ų859.8 Ų59.84%0.03730%0.3CS..EExtended strand (participates in β ladder)trans-129.5130.2170-162176.326.800108.2A128 T198 Q284 F286A128-Q195 HydrophobicContact CB-CB 3.9Å; A128-Q195 HydrophobicContact CB-CG 4.03Å; Q195-T198 HydrophobicContact CG-CG2 3.76Å; Q195-Q284 PolarHBondContact N-O 2.86Å; Q195-Q284 PolarHBondContact O-N 3.48Å; Q195-F286 HydrophobicContact CB-CE2 3.58Å; Q195-F286 HydrophobicContact CB-CZ 4.22Å; Q195-F286 VanDerWaalsContact OE1-CZ 3.25Å
196N85.2Confident87.2Confident116 Ų11658.3 Ų58.362%0.6230%0.295SS*.  trans-73.1167.7169.3-66.7-9.6000109.4T198N196-T198 PolarHBondContact O-N 2.96Å; N196-T198 VanDerWaalsContact O-N 3.08Å
197E70Confident87.4Confident170 Ų17053 Ų5379%0.79427%0.272SS*.  trans-45.4117.2-177.5-69.4-177.7170.200112.8
198T69.1Low87.5Confident37 Ų3752.6 Ų52.623%0.22727%0.27CS..  trans-98.6151.5172.549.70000110.6Q195 N196 E200Q195-T198 HydrophobicContact CG-CG2 3.76Å; N196-T198 PolarHBondContact O-N 2.96Å; N196-T198 VanDerWaalsContact O-N 3.08Å; T198-E200 PolarHBondContact O-N 3.16Å
199Q70.6Confident87.6Confident205 Ų20552.6 Ų52.696%0.95827%0.27SS*.SBendtrans-72-1.5168.8-63.8-178.811.100113.1
200E74.6Confident87.6Confident112 Ų11252.7 Ų52.752%0.52327%0.27SS..  trans-81135.9-179.7-59.8-169.7155.300111.3T198 F202T198-E200 PolarHBondContact O-N 3.16Å; E200-F202 PolarHBondContact O-N 2.73Å
201D79.1Confident87.5Confident154 Ų15452.9 Ų52.982%0.82427%0.274SS*.SBendtrans-66.4-20.3177.3-64.1-34.4000112.8
202F80.6Confident87.4Confident169 Ų16957.1 Ų57.174%0.74129%0.293SS*.SBendtrans-133.3112.1-176.9-60.6-80000111.3E200 A204E200-F202 PolarHBondContact O-N 2.73Å; F202-A204 PolarHBondContact O-N 3.33Å
203S86.2Confident87.5Confident35 Ų3557.4 Ų57.425%0.24529%0.294CS..  trans-75.7108.8173.1-51.10000110.5G240S203-G240 PolarHBondContact O-N 3.03Å
204A91.5Very high87.6Confident35 Ų3559.8 Ų59.829%0.28931%0.31SS..EExtended strand (participates in β ladder)trans-146.7145.2-178.200000112F202 T237 F238F202-A204 PolarHBondContact O-N 3.33Å; A204-T237 HydrophobicContact CB-CG2 3.47Å; A204-T237 VanDerWaalsContact CB-CG2 3.47Å; A204-F238 WeakPolarHBondContact CA-O 3.28Å
205I94.1Very high87.7Confident0 Ų062.1 Ų62.10%032%0.322CS..EExtended strand (participates in β ladder)trans-116.6126.3175.7-65.3174.6000108.2L123 P125 A128 F193 T237 F238 F286L123-I205 HydrophobicContact CD2-CG2 4.37Å; P125-I205 HydrophobicContact CB-CD1 4.5Å; A128-I205 HydrophobicContact CB-CD1 3.82Å; A128-I205 HydrophobicContact CB-CG1 4.42Å; F193-I205 HydrophobicContact CB-CD1 3.81Å; F193-I205 HydrophobicContact CD1-CD1 4.02Å; F193-I205 HydrophobicContact CD2-CD1 4.16Å; F193-I205 HydrophobicContact CG-CD1 3.73Å; I205-T237 WeakPolarHBondContact O-CA 3.47Å; I205-T237 WeakPolarHBondContact O-CG2 3.4Å; I205-F238 HydrophobicContact CB-CD2 4.43Å; I205-F238 HydrophobicContact CB-CE1 3.94Å; I205-F238 HydrophobicContact CB-CE2 3.79Å; I205-F238 HydrophobicContact CB-CZ 3.52Å; I205-F238 HydrophobicContact CD1-CE2 4.1Å; I205-F238 HydrophobicContact CD1-CZ 4.13Å; I205-F238 HydrophobicContact CG1-CE2 4.37Å; I205-F238 HydrophobicContact CG1-CZ 4.37Å; I205-F238 HydrophobicContact CG2-CE1 3.79Å; I205-F238 HydrophobicContact CG2-CE2 4.33Å; I205-F238 HydrophobicContact CG2-CZ 3.55Å; I205-F238 PolarHBondContact N-O 3.28Å; I205-F238 WeakPolarHBondContact O-CD1 3.5Å; I205-F238 PolarHBondContact O-N 3.33Å; I205-F286 HydrophobicContact CD1-CB 4.23Å; I205-F286 HydrophobicContact CD1-CD1 3.89Å; I205-F286 HydrophobicContact CD1-CD2 4.03Å; I205-F286 HydrophobicContact CD1-CE1 4.22Å; I205-F286 HydrophobicContact CD1-CE2 4.39Å; I205-F286 HydrophobicContact CD1-CG 3.79Å; I205-F286 HydrophobicContact CD1-CZ 4.45Å; I205-F286 HydrophobicContact CG1-CD1 3.96Å; I205-F286 HydrophobicContact CG1-CE1 3.94Å; I205-F286 HydrophobicContact CG1-CG 4.37Å; I205-F286 HydrophobicContact CG1-CZ 4.35Å
206S95.1Very high88Confident39 Ų3961.7 Ų61.727%0.27332%0.32SS..EExtended strand (participates in β ladder)trans-86.8153176.7-63.10000111F124 W236 T237F124-S206 PolarHBondContact N-O 3.31Å; S206-W236 CarbonylContact C-O 3.51Å; S206-W236 WeakPolarHBondContact CA-O 3.46Å; S206-T237 PolarHBondContact OG-OG1 3.03Å; S206-T237 VanDerWaalsContact OG-OG1 3.1Å
207Y96.3Very high88.5Confident1 Ų159.4 Ų59.40%0.00431%0.307CS..EExtended strand (participates in β ladder)trans-147.2160.6176.266-83.9000112.1A122 L209 M235 W236 F238 Q265 F290A122-Y207 CarbonylContact O-C 3.55Å; A122-Y207 WeakPolarHBondContact O-CA 3.49Å; A122-Y207 WeakPolarHBondContact O-CB 3.3Å; Y207-L209 HydrophobicContact CD2-CD2 4.34Å; Y207-L209 HydrophobicContact CD2-CG 4.29Å; Y207-L209 HydrophobicContact CE2-CD1 4.49Å; Y207-L209 HydrophobicContact CE2-CG 4.38Å; Y207-M235 WeakPolarHBondContact O-CA 3.47Å; Y207-W236 HydrophobicContact CD1-CB 4.23Å; Y207-W236 HydrophobicContact CD2-CB 4.35Å; Y207-W236 HydrophobicContact CD2-CE3 4.3Å; Y207-W236 HydrophobicContact CE1-CB 3.65Å; Y207-W236 HydrophobicContact CE2-CB 3.75Å; Y207-W236 HydrophobicContact CE2-CD2 4.35Å; Y207-W236 AromaticContact CE2-CE3 3.91Å; Y207-W236 HydrophobicContact CE2-CE3 3.91Å; Y207-W236 HydrophobicContact CE2-CG 4.35Å; Y207-W236 VanDerWaalsContact CZ-CB 3.41Å; Y207-W236 PolarHBondContact N-O 3.33Å; Y207-W236 PolarHBondContact O-N 2.99Å; Y207-F238 AromaticContact CD1-CD1 3.57Å; Y207-F238 HydrophobicContact CD1-CD1 3.57Å; Y207-F238 AromaticContact CD1-CE1 3.94Å; Y207-F238 HydrophobicContact CD1-CE1 3.94Å; Y207-F238 AromaticContact CE1-CD1 3.73Å; Y207-F238 HydrophobicContact CE1-CD1 3.73Å; Y207-F238 HydrophobicContact CE1-CE1 4.49Å; Y207-Q265 VanDerWaalsContact OH-CD 3.28Å; Y207-Q265 PolarHBondContact OH-NE2 2.89Å; Y207-Q265 PolarHBondContact OH-OE1 3.48Å; Y207-F290 HydrophobicContact CD1-CZ 4.42Å; Y207-F290 AromaticContact CD2-CE1 3.79Å; Y207-F290 HydrophobicContact CD2-CE1 3.79Å; Y207-F290 AromaticContact CD2-CZ 3.79Å; Y207-F290 HydrophobicContact CD2-CZ 3.79Å; Y207-F290 HydrophobicContact CE1-CZ 4.47Å; Y207-F290 AromaticContact CE2-CE1 3.53Å; Y207-F290 HydrophobicContact CE2-CE1 3.53Å; Y207-F290 AromaticContact CE2-CZ 3.87Å; Y207-F290 HydrophobicContact CE2-CZ 3.87Å; Y207-F290 HydrophobicContact CG-CZ 4.07Å
208M95.8Very high89.7Confident0 Ų058.7 Ų58.70%030%0.304CS..EExtended strand (participates in β ladder)trans-133.5146.4175.6-179.3-179.562.500109.1A122 F124 M226 C229 E230 Y233 M235A122-M208 HydrophobicContact CB-CB 4.3Å; A122-M208 HydrophobicContact CB-CE 4.05Å; A122-M208 PolarHBondContact N-O 2.83Å; A122-M208 PolarHBondContact O-N 3.22Å; F124-M208 HydrophobicContact CE2-CB 4.07Å; M208-M226 HydrophobicContact CE-CE 3.64Å; M208-C229 HydrophobicContact CE-CB 3.42Å; M208-C229 VanDerWaalsContact CE-CB 3.42Å; M208-C229 HydrophobicContact SD-CB 3.82Å; M208-E230 HydrophobicContact SD-CB 4.35Å; M208-Y233 HydrophobicContact SD-CD2 4.45Å; M208-M235 HydrophobicContact CB-SD 3.64Å; M208-M235 HydrophobicContact CG-SD 4.27Å; M208-M235 HydrophobicContact SD-SD 4.38Å
209L96.3Very high90.9Very high0 Ų058.2 Ų58.20%030%0.302CS..EExtended strand (participates in β ladder)trans-114.3131.1175.8-59176.5000109.6G120 I121 Y207 W236 M248 F263 F290G120-L209 WeakPolarHBondContact O-CA 3.05Å; I121-L209 HydrophobicContact CB-CD2 4.13Å; I121-L209 HydrophobicContact CG1-CD2 3.76Å; I121-L209 HydrophobicContact CG2-CD2 3.98Å; Y207-L209 HydrophobicContact CD2-CD2 4.34Å; Y207-L209 HydrophobicContact CD2-CG 4.29Å; Y207-L209 HydrophobicContact CE2-CD1 4.49Å; Y207-L209 HydrophobicContact CE2-CG 4.38Å; L209-W236 HydrophobicContact CB-CZ3 4.17Å; L209-W236 HydrophobicContact CD1-CZ3 4.14Å; L209-W236 HydrophobicContact CG-CE3 4.5Å; L209-W236 HydrophobicContact CG-CZ3 4.09Å; L209-M248 HydrophobicContact CD1-CB 4.39Å; L209-F263 HydrophobicContact CB-CB 4.16Å; L209-F263 HydrophobicContact CB-CD1 4.05Å; L209-F263 HydrophobicContact CB-CD2 3.65Å; L209-F263 HydrophobicContact CB-CE1 4.32Å; L209-F263 HydrophobicContact CB-CE2 3.99Å; L209-F263 HydrophobicContact CB-CG 3.69Å; L209-F263 HydrophobicContact CB-CZ 4.3Å; L209-F263 HydrophobicContact CD1-CB 3.98Å; L209-F263 HydrophobicContact CD1-CD1 3.89Å; L209-F263 HydrophobicContact CD1-CG 3.99Å; L209-F290 HydrophobicContact CD2-CD1 4.34Å; L209-F290 HydrophobicContact CD2-CE1 4.06Å
210F95.1Very high92Very high1 Ų154 Ų540%0.00430%0.302CS..EExtended strand (participates in β ladder)trans-126.1155.3170.762.5-90.7000111.3P119 G120 A122 V176 K212 L216 F225 M226 Y233P119-F210 WeakPolarHBondContact CA-O 3.03Å; G120-F210 PolarHBondContact N-O 2.87Å; G120-F210 WeakPolarHBondContact O-CD1 3.44Å; G120-F210 PolarHBondContact O-N 3.38Å; A122-F210 HydrophobicContact CB-CE1 4.35Å; V176-F210 HydrophobicContact CG1-CE1 3.66Å; V176-F210 HydrophobicContact CG1-CZ 3.7Å; F210-K212 VanDerWaalsContact CD2-O 3.31Å; F210-K212 WeakPolarHBondContact CD2-O 3.36Å; F210-K212 WeakPolarHBondContact CE2-O 3.2Å; F210-K212 PolarHBondContact O-N 2.79Å; F210-L216 HydrophobicContact CE2-CB 3.95Å; F210-L216 HydrophobicContact CZ-CB 3.85Å; F210-L216 HydrophobicContact CZ-CD2 4.03Å; F210-L216 HydrophobicContact CZ-CG 4.5Å; F210-F225 AromaticContact CD2-CE1 3.9Å; F210-F225 HydrophobicContact CD2-CE1 3.9Å; F210-F225 AromaticContact CD2-CZ 3.84Å; F210-F225 HydrophobicContact CD2-CZ 3.84Å; F210-F225 HydrophobicContact CE1-CE1 4.48Å; F210-F225 AromaticContact CE2-CE1 3.7Å; F210-F225 HydrophobicContact CE2-CE1 3.7Å; F210-F225 AromaticContact CE2-CZ 3.92Å; F210-F225 HydrophobicContact CE2-CZ 3.92Å; F210-F225 HydrophobicContact CG-CE1 4.36Å; F210-F225 HydrophobicContact CZ-CE1 4Å; F210-M226 HydrophobicContact CE1-SD 4.27Å; F210-Y233 HydrophobicContact CB-CD2 3.94Å; F210-Y233 HydrophobicContact CB-CE2 3.56Å
211A92.7Very high93Very high16 Ų1652.3 Ų52.313%0.13230%0.297CS..SBendtrans-61.7-37.2-159.500000115.1V261A211-V261 HydrophobicContact CB-CB 4.29Å; A211-V261 HydrophobicContact CB-CG1 3.84Å; A211-V261 HydrophobicContact CB-CG2 4.37Å
212K94.6Very high93.8Very high88 Ų8848.6 Ų48.638%0.38327%0.273SS..  trans-142.1121.7-173.7-62.6179.8179.3175.70110.4P118 F210 S214 D215P118-K212 CarbonylContact O-C 3.57Å; P118-K212 WeakPolarHBondContact O-CA 3.16Å; F210-K212 VanDerWaalsContact CD2-O 3.31Å; F210-K212 WeakPolarHBondContact CD2-O 3.36Å; F210-K212 WeakPolarHBondContact CE2-O 3.2Å; F210-K212 PolarHBondContact O-N 2.79Å; K212-S214 VanDerWaalsContact C-N 3.25Å; K212-S214 PolarHBondContact O-N 3.34Å; K212-D215 HydrophobicContact CB-CB 4.35Å; K212-D215 WeakPolarHBondContact CD-OD1 3.38Å; K212-D215 PolarHBondContact O-N 3.1Å
213F96.1Very high94.4Very high7 Ų742.8 Ų42.83%0.03125%0.254CS..Hα-helixtrans-62-34.8173.9-177.2-100.6000112.2P118 E156 V176 R178 D215 L216 I217P118-F213 PolarHBondContact O-N 3.19Å; E156-F213 HydrophobicContact CG-CE1 3.99Å; E156-F213 HydrophobicContact CG-CZ 4.2Å; V176-F213 HydrophobicContact CB-CE2 4.46Å; V176-F213 HydrophobicContact CG1-CD2 4.03Å; V176-F213 HydrophobicContact CG1-CE2 3.88Å; R178-F213 HydrophobicContact CB-CD1 3.96Å; R178-F213 HydrophobicContact CB-CD2 4.2Å; R178-F213 HydrophobicContact CB-CE1 4.12Å; R178-F213 HydrophobicContact CB-CE2 4.35Å; R178-F213 HydrophobicContact CB-CG 3.99Å; R178-F213 HydrophobicContact CB-CZ 4.31Å; R178-F213 HydrophobicContact CG-CB 4.38Å; R178-F213 HydrophobicContact CG-CD1 4.11Å; R178-F213 HydrophobicContact CG-CG 4.21Å; F213-D215 PolarHBondContact O-N 3.48Å; F213-L216 WeakPolarHBondContact O-CB 3.38Å; F213-L216 PolarHBondContact O-N 3.38Å; F213-L216 VanDerWaalsContact O-N 3.1Å; F213-I217 HydrophobicContact CD1-CG1 3.9Å; F213-I217 HydrophobicContact CE1-CD1 3.7Å; F213-I217 HydrophobicContact CE1-CG1 3.51Å; F213-I217 HydrophobicContact CZ-CD1 3.78Å; F213-I217 HydrophobicContact CZ-CG1 4.08Å; F213-I217 PolarHBondContact O-N 2.88Å
214S95.8Very high94.8Very high49 Ų4945.4 Ų45.434%0.34326%0.262SS..Hα-helixtrans-56.6-36.3176.5560000112.9K212 L216 I217 E218K212-S214 VanDerWaalsContact C-N 3.25Å; K212-S214 PolarHBondContact O-N 3.34Å; S214-L216 PolarHBondContact O-N 2.89Å; S214-I217 PolarHBondContact O-N 3.46Å; S214-E218 WeakPolarHBondContact O-CB 3.12Å; S214-E218 WeakPolarHBondContact O-CG 3.43Å; S214-E218 PolarHBondContact O-N 3.17Å
215D94.6Very high94.9Very high62 Ų6245.8 Ų45.833%0.33226%0.257SS..Hα-helixtrans-62.8-30.8-178.5-63.2-1.2000111.2K212 F213 S219 F225K212-D215 HydrophobicContact CB-CB 4.35Å; K212-D215 WeakPolarHBondContact CD-OD1 3.38Å; K212-D215 PolarHBondContact O-N 3.1Å; F213-D215 PolarHBondContact O-N 3.48Å; D215-S219 VanDerWaalsContact O-CB 3.28Å; D215-S219 WeakPolarHBondContact O-CB 3.31Å; D215-S219 PolarHBondContact O-N 3Å; D215-F225 HydrophobicContact CB-CE2 3.79Å; D215-F225 HydrophobicContact CB-CZ 3.88Å
216L95.5Very high95Very high0 Ų045.8 Ų45.80%026%0.257CS..Hα-helixtrans-72.4-45.2172.5175.768.4000111.5T158 V160 V176 F210 F213 S214 E218 S219 K222 F225 M226T158-L216 HydrophobicContact CG2-CD2 4.41Å; V160-L216 HydrophobicContact CG2-CD1 4.32Å; V160-L216 HydrophobicContact CG2-CD2 4.42Å; V176-L216 HydrophobicContact CB-CD2 3.84Å; V176-L216 HydrophobicContact CG1-CD2 3.76Å; V176-L216 HydrophobicContact CG2-CD2 3.88Å; F210-L216 HydrophobicContact CE2-CB 3.95Å; F210-L216 HydrophobicContact CZ-CB 3.85Å; F210-L216 HydrophobicContact CZ-CD2 4.03Å; F210-L216 HydrophobicContact CZ-CG 4.5Å; F213-L216 WeakPolarHBondContact O-CB 3.38Å; F213-L216 PolarHBondContact O-N 3.38Å; F213-L216 VanDerWaalsContact O-N 3.1Å; S214-L216 PolarHBondContact O-N 2.89Å; L216-E218 VanDerWaalsContact C-N 3.35Å; L216-S219 PolarHBondContact O-N 2.96Å; L216-S219 PolarHBondContact O-OG 3.27Å; L216-K222 HydrophobicContact CD1-CB 3.93Å; L216-K222 HydrophobicContact CD1-CG 4.05Å; L216-F225 HydrophobicContact CB-CD1 4.14Å; L216-F225 HydrophobicContact CB-CE1 3.84Å; L216-F225 HydrophobicContact CB-CZ 4.46Å; L216-F225 HydrophobicContact CD1-CD1 3.56Å; L216-F225 HydrophobicContact CD1-CE1 4.08Å; L216-F225 HydrophobicContact CD1-CG 4.35Å; L216-F225 HydrophobicContact CG-CD1 4.47Å; L216-M226 HydrophobicContact CD1-CG 4.14Å; L216-M226 HydrophobicContact CD1-SD 4.14Å
217I95.8Very high94.9Very high67 Ų6748.3 Ų48.334%0.34426%0.261SS..Hα-helixtrans-65.9-40.5-177.1-60.1-55.5000111.3T158 F213 S214 S219T158-I217 WeakPolarHBondContact OG1-CD1 3.13Å; F213-I217 HydrophobicContact CD1-CG1 3.9Å; F213-I217 HydrophobicContact CE1-CD1 3.7Å; F213-I217 HydrophobicContact CE1-CG1 3.51Å; F213-I217 HydrophobicContact CZ-CD1 3.78Å; F213-I217 HydrophobicContact CZ-CG1 4.08Å; F213-I217 PolarHBondContact O-N 2.88Å; S214-I217 PolarHBondContact O-N 3.46Å; I217-S219 VanDerWaalsContact C-N 3.33Å
218E95.1Very high94.7Very high156 Ų15651.5 Ų51.573%0.72928%0.278SS*.Hα-helixtrans-80.9-12.9179.3-65.6174.2-165.800112.9S214 L216 A220S214-E218 WeakPolarHBondContact O-CB 3.12Å; S214-E218 WeakPolarHBondContact O-CG 3.43Å; S214-E218 PolarHBondContact O-N 3.17Å; L216-E218 VanDerWaalsContact C-N 3.35Å; E218-A220 PolarHBondContact O-N 3.45Å
219S94.6Very high94.5Very high26 Ų2651.7 Ų51.718%0.18228%0.279CS..  trans-65133.5178.571.60000111.9D215 L216 I217 N221D215-S219 VanDerWaalsContact O-CB 3.28Å; D215-S219 WeakPolarHBondContact O-CB 3.31Å; D215-S219 PolarHBondContact O-N 3Å; L216-S219 PolarHBondContact O-N 2.96Å; L216-S219 PolarHBondContact O-OG 3.27Å; I217-S219 VanDerWaalsContact C-N 3.33Å; S219-N221 VanDerWaalsContact C-N 3.26Å; S219-N221 PolarHBondContact O-N 3.04Å
220A92.9Very high94.3Very high117 Ų11752.3 Ų52.397%0.96728%0.282SS*.SBendtrans-65-31.7174.900000112.3E218E218-A220 PolarHBondContact O-N 3.45Å
221N95.1Very high94.1Very high76 Ų7658.8 Ų58.841%0.40631%0.306SS..  trans-132.395.7179.1-173.2-7.6000110.9S219 S223 E224 F225S219-N221 VanDerWaalsContact C-N 3.26Å; S219-N221 PolarHBondContact O-N 3.04Å; N221-S223 VanDerWaalsContact C-N 3.29Å; N221-S223 PolarHBondContact O-N 3.35Å; N221-S223 PolarHBondContact OD1-N 3.21Å; N221-E224 HydrophobicContact CB-CB 4.05Å; N221-E224 WeakPolarHBondContact ND2-CB 3.37Å; N221-E224 PolarHBondContact ND2-OE2 2.82Å; N221-E224 PolarHBondContact O-N 3.4Å; N221-E224 PolarHBondContact OD1-N 3.26Å; N221-F225 PolarHBondContact O-N 3.21Å
222K95.3Very high94Very high76 Ų7664 Ų6433%0.3333%0.332SS..Hα-helixtrans-59.5-38-179.5-63.3-175.9-179.3-174.90112.7T158 V160 L216 F225 M226T158-K222 HydrophobicContact CG2-CD 4.22Å; V160-K222 HydrophobicContact CG1-CB 4.03Å; V160-K222 HydrophobicContact CG2-CB 4.12Å; V160-K222 HydrophobicContact CG2-CD 4.38Å; L216-K222 HydrophobicContact CD1-CB 3.93Å; L216-K222 HydrophobicContact CD1-CG 4.05Å; K222-F225 PolarHBondContact O-N 3.02Å; K222-M226 WeakPolarHBondContact O-CB 3.34Å; K222-M226 VanDerWaalsContact O-CG 3.3Å; K222-M226 WeakPolarHBondContact O-CG 3.48Å; K222-M226 PolarHBondContact O-N 3.18Å
223S93.9Very high93.8Very high48 Ų4862.2 Ų62.234%0.33632%0.324SS..Hα-helixtrans-68.3-38.7-178.7-59.20000112T161 N221 R227T161-S223 PolarHBondContact O-OG 3.2Å; N221-S223 VanDerWaalsContact C-N 3.29Å; N221-S223 PolarHBondContact O-N 3.35Å; N221-S223 PolarHBondContact OD1-N 3.21Å; S223-R227 WeakPolarHBondContact O-CB 3.44Å; S223-R227 PolarHBondContact O-N 2.89Å; S223-R227 VanDerWaalsContact O-N 3.1Å
224E94Very high93.4Very high89 Ų8964.5 Ų64.542%0.41634%0.34SS..Hα-helixtrans-69.3-43.8175177.8160.2-138.500111.7N221 M226 R227 D228N221-E224 HydrophobicContact CB-CB 4.05Å; N221-E224 WeakPolarHBondContact ND2-CB 3.37Å; N221-E224 PolarHBondContact ND2-OE2 2.82Å; N221-E224 PolarHBondContact O-N 3.4Å; N221-E224 PolarHBondContact OD1-N 3.26Å; E224-M226 VanDerWaalsContact C-N 3.33Å; E224-M226 PolarHBondContact O-N 3.4Å; E224-R227 WeakPolarHBondContact O-CB 3.35Å; E224-R227 PolarHBondContact O-N 3.28Å; E224-R227 IonicContact OE1-NH2 3.21Å; E224-R227 PolarHBondContact OE1-NH2 3.36Å; E224-D228 PolarHBondContact O-N 3.34Å
225F95Very high93.3Very high44 Ų4465.5 Ų65.519%0.19334%0.34CS..Hα-helixtrans-55.3-47.5173.9177.5-89.3000111.9F210 D215 L216 N221 K222 R227 D228 C229F210-F225 AromaticContact CD2-CE1 3.9Å; F210-F225 HydrophobicContact CD2-CE1 3.9Å; F210-F225 AromaticContact CD2-CZ 3.84Å; F210-F225 HydrophobicContact CD2-CZ 3.84Å; F210-F225 HydrophobicContact CE1-CE1 4.48Å; F210-F225 AromaticContact CE2-CE1 3.7Å; F210-F225 HydrophobicContact CE2-CE1 3.7Å; F210-F225 AromaticContact CE2-CZ 3.92Å; F210-F225 HydrophobicContact CE2-CZ 3.92Å; F210-F225 HydrophobicContact CG-CE1 4.36Å; F210-F225 HydrophobicContact CZ-CE1 4Å; D215-F225 HydrophobicContact CB-CE2 3.79Å; D215-F225 HydrophobicContact CB-CZ 3.88Å; L216-F225 HydrophobicContact CB-CD1 4.14Å; L216-F225 HydrophobicContact CB-CE1 3.84Å; L216-F225 HydrophobicContact CB-CZ 4.46Å; L216-F225 HydrophobicContact CD1-CD1 3.56Å; L216-F225 HydrophobicContact CD1-CE1 4.08Å; L216-F225 HydrophobicContact CD1-CG 4.35Å; L216-F225 HydrophobicContact CG-CD1 4.47Å; N221-F225 PolarHBondContact O-N 3.21Å; K222-F225 PolarHBondContact O-N 3.02Å; F225-R227 VanDerWaalsContact C-N 3.35Å; F225-R227 PolarHBondContact O-N 2.88Å; F225-D228 PolarHBondContact O-N 3.26Å; F225-C229 WeakPolarHBondContact CE1-SG 3.3Å; F225-C229 WeakPolarHBondContact O-CB 3.38Å; F225-C229 PolarHBondContact O-N 3.17Å; F225-C229 PolarHBondContact O-SG 2.87Å
226M94.8Very high93.3Very high0 Ų065 Ų650%033%0.334CS..Hα-helixtrans-64-38.9178.5-73.8-55.4-63.800112.6A122 V160 Y162 A174 V176 M208 F210 L216 K222 E224 D228 C229 E230A122-M226 HydrophobicContact CB-CE 3.5Å; V160-M226 HydrophobicContact CB-CG 4.11Å; V160-M226 HydrophobicContact CG1-CB 4.43Å; V160-M226 HydrophobicContact CG1-CG 3.8Å; V160-M226 HydrophobicContact CG2-CG 4.39Å; Y162-M226 HydrophobicContact CD1-CB 3.73Å; Y162-M226 HydrophobicContact CD1-CG 4.46Å; Y162-M226 HydrophobicContact CD2-CB 4.33Å; Y162-M226 HydrophobicContact CE1-CB 3.81Å; Y162-M226 HydrophobicContact CE1-CE 4.3Å; Y162-M226 HydrophobicContact CE2-CB 4.4Å; Y162-M226 HydrophobicContact CG-CB 4.02Å; A174-M226 HydrophobicContact CB-CE 4Å; V176-M226 HydrophobicContact CG2-CE 4.06Å; V176-M226 HydrophobicContact CG2-SD 4.08Å; M208-M226 HydrophobicContact CE-CE 3.64Å; F210-M226 HydrophobicContact CE1-SD 4.27Å; L216-M226 HydrophobicContact CD1-CG 4.14Å; L216-M226 HydrophobicContact CD1-SD 4.14Å; K222-M226 WeakPolarHBondContact O-CB 3.34Å; K222-M226 VanDerWaalsContact O-CG 3.3Å; K222-M226 WeakPolarHBondContact O-CG 3.48Å; K222-M226 PolarHBondContact O-N 3.18Å; E224-M226 VanDerWaalsContact C-N 3.33Å; E224-M226 PolarHBondContact O-N 3.4Å; M226-D228 VanDerWaalsContact C-N 3.33Å; M226-D228 PolarHBondContact O-N 3.46Å; M226-C229 PolarHBondContact O-N 3.42Å; M226-E230 PolarHBondContact O-N 3.31Å
227R93.2Very high93.3Very high92 Ų9268.7 Ų68.735%0.34736%0.356SS..Hα-helixtrans-62.6-40.4175.5-174.3-174.667.4-170-5.6111.8Y162 P165 S223 E224 F225 R231Y162-R227 HydrophobicContact CD2-CB 4.05Å; Y162-R227 HydrophobicContact CE2-CB 4.46Å; P165-R227 HydrophobicContact CB-CG 4.01Å; P165-R227 HydrophobicContact CG-CG 4.48Å; S223-R227 WeakPolarHBondContact O-CB 3.44Å; S223-R227 PolarHBondContact O-N 2.89Å; S223-R227 VanDerWaalsContact O-N 3.1Å; E224-R227 WeakPolarHBondContact O-CB 3.35Å; E224-R227 PolarHBondContact O-N 3.28Å; E224-R227 IonicContact OE1-NH2 3.21Å; E224-R227 PolarHBondContact OE1-NH2 3.36Å; F225-R227 VanDerWaalsContact C-N 3.35Å; F225-R227 PolarHBondContact O-N 2.88Å; R227-R231 PolarHBondContact O-N 3.3Å
228D92.6Very high93.2Very high67 Ų6765.7 Ų65.736%0.35834%0.341SS..Hα-helixtrans-73.4-34.4178.5-69.6-9.1000111.6E224 F225 M226 R231 N232E224-D228 PolarHBondContact O-N 3.34Å; F225-D228 PolarHBondContact O-N 3.26Å; M226-D228 VanDerWaalsContact C-N 3.33Å; M226-D228 PolarHBondContact O-N 3.46Å; D228-R231 PolarHBondContact O-N 3.35Å; D228-N232 PolarHBondContact O-N 3.22Å; D228-N232 PolarHBondContact O-ND2 3.03Å
229C92.7Very high93Very high5 Ų561.2 Ų61.23%0.03433%0.327CS..Hα-helixtrans-60.4-47.2171.3-70.80000111.4M208 F225 M226 R231 N232 Y233M208-C229 HydrophobicContact CE-CB 3.42Å; M208-C229 VanDerWaalsContact CE-CB 3.42Å; M208-C229 HydrophobicContact SD-CB 3.82Å; F225-C229 WeakPolarHBondContact CE1-SG 3.3Å; F225-C229 WeakPolarHBondContact O-CB 3.38Å; F225-C229 PolarHBondContact O-N 3.17Å; F225-C229 PolarHBondContact O-SG 2.87Å; M226-C229 PolarHBondContact O-N 3.42Å; C229-R231 PolarHBondContact O-N 3.33Å; C229-N232 PolarHBondContact O-N 3.1Å; C229-Y233 HydrophobicContact CB-CD2 3.74Å; C229-Y233 HydrophobicContact CB-CE2 4.05Å; C229-Y233 WeakPolarHBondContact O-CB 3.49Å; C229-Y233 VanDerWaalsContact O-CD2 3.3Å; C229-Y233 WeakPolarHBondContact O-CD2 3.3Å; C229-Y233 PolarHBondContact O-N 3.47Å
230E92.1Very high92.8Very high12 Ų1260.3 Ų60.36%0.05632%0.322CS..Hα-helixtrans-62.9-25.5178.6-173.6178.6164.300112.8Y162 P165 F166 K172 M208 M226Y162-E230 WeakPolarHBondContact CE2-OE2 3.46Å; Y162-E230 VanDerWaalsContact CZ-OE2 3.28Å; Y162-E230 PolarHBondContact OH-OE2 3.04Å; P165-E230 VanDerWaalsContact CD-OE2 3.3Å; P165-E230 WeakPolarHBondContact CD-OE2 3.5Å; P165-E230 HydrophobicContact CG-CB 3.98Å; P165-E230 HydrophobicContact CG-CG 3.92Å; F166-E230 HydrophobicContact CE2-CG 4.22Å; K172-E230 IonicContact NZ-OE1 3.65Å; K172-E230 PolarHBondContact NZ-OE1 3.29Å; K172-E230 IonicContact NZ-OE2 2.98Å; M208-E230 HydrophobicContact SD-CB 4.35Å; M226-E230 PolarHBondContact O-N 3.31Å
231R90.1Very high92.4Very high137 Ų13755.7 Ų55.752%0.51729%0.285SS..Hα-helixtrans-73.8-33.5173.3-70.6178-179.9-95-6.1113P165 R227 D228 C229P165-R231 HydrophobicContact CB-CG 3.43Å; P165-R231 VanDerWaalsContact CB-CG 3.43Å; P165-R231 VanDerWaalsContact CB-NE 3.3Å; P165-R231 HydrophobicContact CG-CG 3.67Å; R227-R231 PolarHBondContact O-N 3.3Å; D228-R231 PolarHBondContact O-N 3.35Å; C229-R231 PolarHBondContact O-N 3.33Å
232N89.4Confident92.2Very high126 Ų12656.1 Ų56.167%0.67428%0.284SS*.Hα-helixtrans-103.8-28.8-166.5-67.8-25.8000113.4D228 C229D228-N232 PolarHBondContact O-N 3.22Å; D228-N232 PolarHBondContact O-ND2 3.03Å; C229-N232 PolarHBondContact O-N 3.1Å
233Y90.4Very high92.1Very high51 Ų5155.5 Ų55.520%0.228%0.279CS..SBendtrans-105.3152.1-177.2-60.7-71.2000111.7M208 F210 C229 V261M208-Y233 HydrophobicContact SD-CD2 4.45Å; F210-Y233 HydrophobicContact CB-CD2 3.94Å; F210-Y233 HydrophobicContact CB-CE2 3.56Å; C229-Y233 HydrophobicContact CB-CD2 3.74Å; C229-Y233 HydrophobicContact CB-CE2 4.05Å; C229-Y233 WeakPolarHBondContact O-CB 3.49Å; C229-Y233 VanDerWaalsContact O-CD2 3.3Å; C229-Y233 WeakPolarHBondContact O-CD2 3.3Å; C229-Y233 PolarHBondContact O-N 3.47Å; Y233-V261 WeakPolarHBondContact CD1-O 3.34Å; Y233-V261 HydrophobicContact CE1-CB 4.29Å; Y233-V261 WeakPolarHBondContact CE1-O 3.11Å
234S89.1Confident92.2Very high54 Ų5453.5 Ų53.538%0.37827%0.265SS..  trans-75.4147.1175.1-67.30000111.3W236S234-W236 VanDerWaalsContact O-CZ3 3.25Å; S234-W236 WeakPolarHBondContact O-CZ3 3.38Å
235M92.2Very high92.3Very high70 Ų7052.3 Ų52.335%0.34526%0.257SS..EExtended strand (participates in β ladder)trans-101.8140.6173.8-66.3-78.7-56.100109.3F124 Y207 M208F124-M235 HydrophobicContact CD2-CE 3.36Å; F124-M235 HydrophobicContact CD2-SD 4.31Å; F124-M235 HydrophobicContact CE2-CE 3.29Å; F124-M235 HydrophobicContact CE2-SD 3.62Å; F124-M235 HydrophobicContact CG-CE 4.23Å; F124-M235 HydrophobicContact CZ-CE 4.1Å; F124-M235 HydrophobicContact CZ-SD 4.19Å; Y207-M235 WeakPolarHBondContact O-CA 3.47Å; M208-M235 HydrophobicContact CB-SD 3.64Å; M208-M235 HydrophobicContact CG-SD 4.27Å; M208-M235 HydrophobicContact SD-SD 4.38Å
236W95.4Very high92.4Very high53 Ų5350.2 Ų50.220%0.20125%0.248CC..EExtended strand (participates in β ladder)trans-128.5171.3174.3-62.9-79000110.5S206 Y207 L209 S234 F263 Q265S206-W236 CarbonylContact C-O 3.51Å; S206-W236 WeakPolarHBondContact CA-O 3.46Å; Y207-W236 HydrophobicContact CD1-CB 4.23Å; Y207-W236 HydrophobicContact CD2-CB 4.35Å; Y207-W236 HydrophobicContact CD2-CE3 4.3Å; Y207-W236 HydrophobicContact CE1-CB 3.65Å; Y207-W236 HydrophobicContact CE2-CB 3.75Å; Y207-W236 HydrophobicContact CE2-CD2 4.35Å; Y207-W236 AromaticContact CE2-CE3 3.91Å; Y207-W236 HydrophobicContact CE2-CE3 3.91Å; Y207-W236 HydrophobicContact CE2-CG 4.35Å; Y207-W236 VanDerWaalsContact CZ-CB 3.41Å; Y207-W236 PolarHBondContact N-O 3.33Å; Y207-W236 PolarHBondContact O-N 2.99Å; L209-W236 HydrophobicContact CB-CZ3 4.17Å; L209-W236 HydrophobicContact CD1-CZ3 4.14Å; L209-W236 HydrophobicContact CG-CE3 4.5Å; L209-W236 HydrophobicContact CG-CZ3 4.09Å; S234-W236 VanDerWaalsContact O-CZ3 3.25Å; S234-W236 WeakPolarHBondContact O-CZ3 3.38Å; W236-F263 HydrophobicContact CH2-CB 3.86Å; W236-F263 WeakPolarHBondContact CH2-O 3.43Å; W236-F263 WeakPolarHBondContact CZ2-O 3.38Å; W236-F263 HydrophobicContact CZ3-CB 4.36Å; W236-Q265 VanDerWaalsContact CD2-CD 3.41Å; W236-Q265 HydrophobicContact CD2-CG 4.21Å; W236-Q265 HydrophobicContact CG-CG 4.34Å; W236-Q265 HydrophobicContact CZ2-CG 4.25Å
237T94.9Very high92.4Very high77 Ų7754.2 Ų54.247%0.47227%0.265SS..EExtended strand (participates in β ladder)trans-141.8141.3-176.2-50.60000109.8A204 I205 S206A204-T237 HydrophobicContact CB-CG2 3.47Å; A204-T237 VanDerWaalsContact CB-CG2 3.47Å; I205-T237 WeakPolarHBondContact O-CA 3.47Å; I205-T237 WeakPolarHBondContact O-CG2 3.4Å; S206-T237 PolarHBondContact OG-OG1 3.03Å; S206-T237 VanDerWaalsContact OG-OG1 3.1Å
238F94.6Very high92.5Very high3 Ų349.8 Ų49.81%0.01325%0.249CC..EExtended strand (participates in β ladder)trans-118.9147.2168.660.9-90.6000111L123 F193 A204 I205 Y207 T244 F286 V288L123-F238 HydrophobicContact CD2-CE1 3.65Å; L123-F238 HydrophobicContact CD2-CZ 3.92Å; F193-F238 HydrophobicContact CD2-CE2 4.41Å; F193-F238 HydrophobicContact CD2-CZ 4.25Å; F193-F238 HydrophobicContact CE2-CZ 4.03Å; A204-F238 WeakPolarHBondContact CA-O 3.28Å; I205-F238 HydrophobicContact CB-CD2 4.43Å; I205-F238 HydrophobicContact CB-CE1 3.94Å; I205-F238 HydrophobicContact CB-CE2 3.79Å; I205-F238 HydrophobicContact CB-CZ 3.52Å; I205-F238 HydrophobicContact CD1-CE2 4.1Å; I205-F238 HydrophobicContact CD1-CZ 4.13Å; I205-F238 HydrophobicContact CG1-CE2 4.37Å; I205-F238 HydrophobicContact CG1-CZ 4.37Å; I205-F238 HydrophobicContact CG2-CE1 3.79Å; I205-F238 HydrophobicContact CG2-CE2 4.33Å; I205-F238 HydrophobicContact CG2-CZ 3.55Å; I205-F238 PolarHBondContact N-O 3.28Å; I205-F238 WeakPolarHBondContact O-CD1 3.5Å; I205-F238 PolarHBondContact O-N 3.33Å; Y207-F238 AromaticContact CD1-CD1 3.57Å; Y207-F238 HydrophobicContact CD1-CD1 3.57Å; Y207-F238 AromaticContact CD1-CE1 3.94Å; Y207-F238 HydrophobicContact CD1-CE1 3.94Å; Y207-F238 AromaticContact CE1-CD1 3.73Å; Y207-F238 HydrophobicContact CE1-CD1 3.73Å; Y207-F238 HydrophobicContact CE1-CE1 4.49Å; F238-T244 HydrophobicContact CB-CG2 3.95Å; F238-F286 HydrophobicContact CD2-CB 4.32Å; F238-F286 HydrophobicContact CD2-CD1 4.33Å; F238-F286 HydrophobicContact CE2-CB 3.78Å; F238-F286 HydrophobicContact CE2-CD1 4.18Å; F238-F286 HydrophobicContact CE2-CG 4.39Å; F238-V288 HydrophobicContact CD1-CB 4.33Å; F238-V288 HydrophobicContact CD1-CG2 4.13Å; F238-V288 HydrophobicContact CD2-CB 4.25Å; F238-V288 HydrophobicContact CE1-CB 4.24Å; F238-V288 HydrophobicContact CE1-CG1 4.14Å; F238-V288 HydrophobicContact CE1-CG2 4.32Å; F238-V288 HydrophobicContact CE2-CB 4.14Å; F238-V288 HydrophobicContact CE2-CG1 4.26Å; F238-V288 HydrophobicContact CG-CB 4.34Å; F238-V288 HydrophobicContact CG-CG2 4.36Å; F238-V288 HydrophobicContact CZ-CB 4.13Å; F238-V288 HydrophobicContact CZ-CG1 3.88Å
239S91.5Very high92.6Very high63 Ų6346.7 Ų46.744%0.44123%0.232SC..EExtended strand (participates in β ladder)trans-91.2148.1-175.3-53.90000112
240G88.9Confident92.7Very high7 Ų747 Ų477%0.07223%0.233CC..THydrogen-bonded Turntrans-71158.217000000112.4S203 F242 F286S203-G240 PolarHBondContact O-N 3.03Å; G240-F242 VanDerWaalsContact O-CD2 3.28Å; G240-F242 WeakPolarHBondContact O-CD2 3.42Å; G240-F242 PolarHBondContact O-N 3.23Å; G240-F286 VanDerWaalsContact CA-CE1 3.44Å; G240-F286 VanDerWaalsContact N-CD1 3.31Å
241G85.6Confident92.8Very high20 Ų2046.6 Ų46.621%0.20623%0.232CC..THydrogen-bonded Turntrans79.7-0.7179.300000114.3F272 L285G241-F272 WeakPolarHBondContact O-CB 3.14Å; G241-F272 PolarHBondContact O-N 3.43Å; G241-F272 VanDerWaalsContact O-N 3.17Å; G241-L285 PolarHBondContact N-O 3.34Å
242F91Very high92.8Very high85 Ų8543.2 Ų43.237%0.37322%0.221SC..EExtended strand (participates in β ladder)trans-128155.6174.5-57-90.5000110.5G240 V269 V270 K271G240-F242 VanDerWaalsContact O-CD2 3.28Å; G240-F242 WeakPolarHBondContact O-CD2 3.42Å; G240-F242 PolarHBondContact O-N 3.23Å; F242-V269 HydrophobicContact CB-CG1 3.4Å; F242-V269 VanDerWaalsContact CB-CG1 3.4Å; F242-V269 HydrophobicContact CD1-CG1 3.63Å; F242-V269 HydrophobicContact CD2-CG1 4.48Å; F242-V269 HydrophobicContact CG-CG1 3.59Å; F242-V270 CarbonylContact C-O 3.57Å; F242-V270 WeakPolarHBondContact CA-O 3.39Å; F242-K271 HydrophobicContact CD1-CB 4.2Å; F242-K271 HydrophobicContact CE1-CB 4.22Å; F242-K271 HydrophobicContact CE1-CG 4.44Å
243R93.4Very high92.8Very high62 Ų6239 Ų3923%0.23420%0.2CC..EExtended strand (participates in β ladder)trans-91114.8161.7177.9175.8161.8174.3-3.9108.9V270 F287R243-V270 PolarHBondContact N-O 2.9Å; R243-V270 PolarHBondContact O-N 3.44Å; R243-F287 WeakPolarHBondContact CA-O 3.43Å; R243-F287 HydrophobicContact CB-CB 4.03Å; R243-F287 HydrophobicContact CG-CB 4.26Å
244T96.3Very high92.5Very high7 Ų738.1 Ų38.14%0.04320%0.201CC..EExtended strand (participates in β ladder)trans-97118.4176.4-56.60000109.4F238 V246 G268 F287 V288 V289F238-T244 HydrophobicContact CB-CG2 3.95Å; T244-V246 HydrophobicContact CG2-CG2 3.94Å; T244-G268 CarbonylContact C-O 3.6Å; T244-F287 PolarHBondContact N-O 3.38Å; T244-V288 CarbonylContact O-C 3.56Å; T244-V288 VanDerWaalsContact O-CA 3.3Å; T244-V288 WeakPolarHBondContact O-CA 3.23Å; T244-V289 PolarHBondContact O-N 2.96Å
245W95.3Very high91.7Very high63 Ų6337.7 Ų37.724%0.23921%0.205CC..EExtended strand (participates in β ladder)trans-98.5112.4174.6-149.1-51.6000109.2I141 L188 S267 G268 V289 E291I141-W245 HydrophobicContact CD1-CH2 4.41Å; L188-W245 HydrophobicContact CD2-CZ2 3.98Å; W245-S267 CarbonylContact O-C 3.54Å; W245-S267 VanDerWaalsContact O-CA 3.27Å; W245-S267 WeakPolarHBondContact O-CA 3.33Å; W245-G268 PolarHBondContact N-O 2.97Å; W245-G268 PolarHBondContact O-N 3.27Å; W245-V289 HydrophobicContact CD2-CB 4.19Å; W245-V289 HydrophobicContact CD2-CG1 4.17Å; W245-V289 HydrophobicContact CD2-CG2 4.48Å; W245-V289 HydrophobicContact CG-CB 4.1Å; W245-V289 HydrophobicContact CG-CG1 4.28Å; W245-V289 HydrophobicContact CZ2-CG1 4.16Å; W245-E291 PolarHBondContact NE1-OE2 3.3Å
246V96.8Very high90.4Very high0 Ų042.7 Ų42.70%022%0.22CC..EExtended strand (participates in β ladder)trans-103.8109.5-177-174.80000108.6T244 Q265 V288 V289 F290 E291T244-V246 HydrophobicContact CG2-CG2 3.94Å; V246-Q265 HydrophobicContact CG1-CB 4.05Å; V246-V288 HydrophobicContact CG2-CG2 3.96Å; V246-V289 PolarHBondContact N-O 3.26Å; V246-F290 HydrophobicContact CB-CD1 3.7Å; V246-F290 HydrophobicContact CB-CE1 3.91Å; V246-F290 HydrophobicContact CB-CG 4.31Å; V246-F290 HydrophobicContact CG1-CD1 3.76Å; V246-F290 HydrophobicContact CG1-CE1 3.82Å; V246-F290 HydrophobicContact CG2-CD1 4.26Å; V246-F290 HydrophobicContact CG2-CE1 4.01Å; V246-F290 HydrophobicContact CG2-CZ 4.37Å; V246-F290 WeakPolarHBondContact O-CA 3.42Å; V246-E291 PolarHBondContact O-N 3.49Å
247K95.6Very high88.9Confident84 Ų8451 Ų5137%0.36525%0.251SS..EExtended strand (participates in β ladder)trans-93.8113.1171.7-51.2-161.3178.2-135.20108.9Q265 E266 E291 R293K247-Q265 CarbonylContact O-C 3.55Å; K247-Q265 VanDerWaalsContact O-CA 3.31Å; K247-Q265 WeakPolarHBondContact O-CA 3.38Å; K247-E266 HydrophobicContact CB-CB 4.45Å; K247-E266 PolarHBondContact N-O 3.19Å; K247-E266 PolarHBondContact O-N 3.26Å; K247-E291 CarbonylContact C-O 3.59Å; K247-E291 WeakPolarHBondContact CA-O 3.37Å; K247-E291 HydrophobicContact CB-CG 4.37Å; K247-E291 WeakPolarHBondContact CD-OE1 3.45Å; K247-E291 WeakPolarHBondContact CE-OE1 3.33Å; K247-E291 HydrophobicContact CG-CG 3.96Å; K247-E291 WeakPolarHBondContact CG-OE1 3.28Å; K247-E291 IonicContact NZ-OE1 3.7Å; K247-E291 PolarHBondContact NZ-OE1 3.31Å; K247-R293 HydrophobicContact CB-CB 3.88Å; K247-R293 HydrophobicContact CB-CG 4.14Å; K247-R293 HydrophobicContact CD-CG 4.41Å
248M95.3Very high87.7Confident0 Ų051.4 Ų51.40%026%0.257CS..EExtended strand (participates in β ladder)trans-98.8147.6-178.247.7174172.100112P119 P180 L209 F263 R264 F290 E291 W292 R293P119-M248 HydrophobicContact CG-CE 3.92Å; P119-M248 HydrophobicContact CG-SD 3.9Å; P180-M248 HydrophobicContact CG-CE 3.26Å; L209-M248 HydrophobicContact CD1-CB 4.39Å; M248-F263 HydrophobicContact CB-CD1 4.26Å; M248-F263 HydrophobicContact SD-CD1 4.49Å; M248-F263 HydrophobicContact SD-CE1 4.27Å; M248-R264 CarbonylContact C-O 3.53Å; M248-R264 WeakPolarHBondContact CA-O 3.42Å; M248-F290 HydrophobicContact CE-CB 4.37Å; M248-E291 WeakPolarHBondContact CG-O 3.42Å; M248-E291 PolarHBondContact N-O 2.87Å; M248-W292 HydrophobicContact CB-CE3 4.42Å; M248-W292 HydrophobicContact CB-CZ3 4.42Å; M248-W292 HydrophobicContact CE-CD2 3.99Å; M248-W292 HydrophobicContact CE-CG 4.25Å; M248-W292 HydrophobicContact CE-CZ2 4.23Å; M248-W292 HydrophobicContact CG-CD2 4.12Å; M248-W292 HydrophobicContact CG-CE3 3.82Å; M248-W292 HydrophobicContact CG-CZ3 4.09Å; M248-W292 HydrophobicContact SD-CD2 4.29Å; M248-W292 HydrophobicContact SD-CE3 4.27Å; M248-W292 HydrophobicContact SD-CH2 4.17Å; M248-W292 HydrophobicContact SD-CZ2 4.18Å; M248-W292 HydrophobicContact SD-CZ3 4.19Å; M248-R293 PolarHBondContact O-N 3.41Å
249S94.7Very high87.1Confident2 Ų258.1 Ų58.11%0.01429%0.289CS..EExtended strand (participates in β ladder)trans-137.1143.9171.2-179.30000108.7F263 R264 R293 D294S249-F263 WeakPolarHBondContact O-CA 3.39Å; S249-R264 PolarHBondContact N-O 2.92Å; S249-R264 PolarHBondContact O-N 3.49Å; S249-R293 PolarHBondContact OG-NH2 3.4Å; S249-D294 PolarHBondContact OG-OD1 3.29Å
250L94Very high86.9Confident11 Ų1157.7 Ų57.76%0.05829%0.289CS..EExtended strand (participates in β ladder)trans-101126.3-173.4-167.566.9000111F116 V261 F263 W292 I297 Q298F116-L250 HydrophobicContact CD1-CB 4.41Å; F116-L250 HydrophobicContact CD1-CD2 4.3Å; F116-L250 HydrophobicContact CE1-CB 3.98Å; F116-L250 HydrophobicContact CE1-CD2 4.5Å; L250-V261 HydrophobicContact CD1-CG1 3.35Å; L250-V261 HydrophobicContact CG-CG1 4.09Å; L250-F263 HydrophobicContact CD1-CD1 4.11Å; L250-F263 HydrophobicContact CD1-CD2 4.11Å; L250-F263 HydrophobicContact CD1-CE1 3.76Å; L250-F263 HydrophobicContact CD1-CE2 3.72Å; L250-F263 HydrophobicContact CD1-CG 4.29Å; L250-F263 HydrophobicContact CD1-CZ 3.54Å; L250-W292 HydrophobicContact CB-CH2 4.27Å; L250-W292 HydrophobicContact CB-CZ3 4Å; L250-I297 HydrophobicContact CD2-CD1 4.39Å; L250-I297 HydrophobicContact CD2-CG1 4.46Å; L250-Q298 PolarHBondContact O-N 3.01Å
251V93.3Very high87Confident3 Ų358.7 Ų58.72%0.01829%0.293CS..EExtended strand (participates in β ladder)trans-110.9125.2173.5-173.20000109V261 E262 R264 Q298 I300V251-V261 WeakPolarHBondContact O-CA 3.37Å; V251-E262 HydrophobicContact CB-CB 4.47Å; V251-E262 PolarHBondContact N-O 2.94Å; V251-E262 PolarHBondContact O-N 3.43Å; V251-R264 HydrophobicContact CG2-CG 3.69Å; V251-Q298 CarbonylContact C-O 3.6Å; V251-Q298 WeakPolarHBondContact CA-O 3.24Å; V251-Q298 HydrophobicContact CB-CB 4.49Å; V251-Q298 HydrophobicContact CG1-CB 4.38Å; V251-Q298 HydrophobicContact CG1-CG 4.35Å; V251-Q298 HydrophobicContact CG2-CB 4.13Å; V251-I300 HydrophobicContact CG1-CD1 3.45Å; V251-I300 VanDerWaalsContact CG1-CD1 3.45Å; V251-I300 HydrophobicContact CG1-CG1 3.89Å
252K91.9Very high87.2Confident67 Ų6762.3 Ų62.329%0.29131%0.305SS..EExtended strand (participates in β ladder)trans-111.6118.8173.8-66-171-179.3-179.80109.2V261 I297 Q298 E299 I300K252-V261 HydrophobicContact CG-CG2 4.4Å; K252-I297 HydrophobicContact CB-CG2 4.42Å; K252-I297 HydrophobicContact CD-CG2 3.88Å; K252-I297 HydrophobicContact CG-CG2 3.86Å; K252-Q298 PolarHBondContact N-O 3.49Å; K252-E299 CarbonylContact O-C 3.47Å; K252-E299 WeakPolarHBondContact O-CA 3.46Å; K252-I300 PolarHBondContact O-N 3.38Å
253T89.2Confident87.4Confident38 Ų3858.4 Ų58.423%0.23329%0.288CS..EExtended strand (participates in β ladder)trans-107.5111.8178.2-58.10000109.1M106 G255 E259 A260 I300M106-T253 HydrophobicContact CE-CG2 4.27Å; T253-G255 PolarHBondContact O-N 3.3Å; T253-E259 WeakPolarHBondContact O-CA 3.41Å; T253-A260 PolarHBondContact N-O 3.35Å; T253-A260 PolarHBondContact O-N 3.45Å; T253-I300 WeakPolarHBondContact CA-O 3.45Å; T253-I300 HydrophobicContact CG2-CB 4.25Å; T253-I300 HydrophobicContact CG2-CG2 4.2Å
254S84.3Confident87.4Confident32 Ų3261.6 Ų61.622%0.22430%0.3CS..EExtended strand (participates in β ladder)trans-79.2103.3174.768.60000109.2M106 I300 R301M106-S254 WeakPolarHBondContact CE-O 3.44Å; S254-I300 PolarHBondContact N-O 2.85Å; S254-I300 PolarHBondContact OG-O 3.46Å; S254-R301 WeakPolarHBondContact OG-CA 3.48Å; S254-R301 WeakPolarHBondContact OG-CB 3.5Å; S254-R301 WeakPolarHBondContact OG-CG 3.43Å
255G72Confident87.2Confident45 Ų4563.3 Ų63.346%0.46431%0.308SS..  trans-91-170.4179.100000113.8T253 R257 S258T253-G255 PolarHBondContact O-N 3.3Å; G255-R257 VanDerWaalsContact C-N 3.27Å; G255-R257 PolarHBondContact O-N 2.88Å; G255-S258 WeakPolarHBondContact CA-O 3.5Å; G255-S258 PolarHBondContact N-O 3.38Å
256R64.1Low87.2Confident175 Ų17565.1 Ų65.166%0.6632%0.318SS*.SBendtrans-59.5-28.8-176.1-172.4178.8177.1-171.30.3114.7N99N99-R256 PolarHBondContact O-NE 3.46Å
257R63.7Low87.1Confident228 Ų22868.8 Ų68.886%0.8634%0.344SS*.SBendtrans-149.1-21.4-175-68.8-172178.1175.9-2.3114.2G255G255-R257 VanDerWaalsContact C-N 3.27Å; G255-R257 PolarHBondContact O-N 2.88Å
258S69.9Low87Confident85 Ų8566.4 Ų66.459%0.59434%0.344SS*.SBendtrans-132.5147.6179.755.10000110.1G255G255-S258 WeakPolarHBondContact CA-O 3.5Å; G255-S258 PolarHBondContact N-O 3.38Å
259E82.9Confident86.9Confident144 Ų14470.6 Ų70.667%0.67337%0.369SS*.EExtended strand (participates in β ladder)trans-78.5121.6163.5-63.5-176.5174.100107.3T253T253-E259 WeakPolarHBondContact O-CA 3.41Å
260A86.7Confident86.8Confident54 Ų5474.9 Ų74.945%0.44640%0.395SS..EExtended strand (participates in β ladder)trans-93140.2168.800000108.2T253T253-A260 PolarHBondContact N-O 3.35Å; T253-A260 PolarHBondContact O-N 3.45Å
261V90.3Very high86.7Confident27 Ų2781.4 Ų81.416%0.16442%0.423CS..EExtended strand (participates in β ladder)trans-118.5136.2176.5-175.90000108A211 Y233 L250 V251 K252A211-V261 HydrophobicContact CB-CB 4.29Å; A211-V261 HydrophobicContact CB-CG1 3.84Å; A211-V261 HydrophobicContact CB-CG2 4.37Å; Y233-V261 WeakPolarHBondContact CD1-O 3.34Å; Y233-V261 HydrophobicContact CE1-CB 4.29Å; Y233-V261 WeakPolarHBondContact CE1-O 3.11Å; L250-V261 HydrophobicContact CD1-CG1 3.35Å; L250-V261 HydrophobicContact CG-CG1 4.09Å; V251-V261 WeakPolarHBondContact O-CA 3.37Å; K252-V261 HydrophobicContact CG-CG2 4.4Å
262E91.6Very high86.5Confident97 Ų9783.1 Ų83.145%0.45343%0.43SS..EExtended strand (participates in β ladder)trans-136.8143.9178.6-172.4177.4-174.600109.2V251V251-E262 HydrophobicContact CB-CB 4.47Å; V251-E262 PolarHBondContact N-O 2.94Å; V251-E262 PolarHBondContact O-N 3.43Å
263F94.1Very high86.3Confident3 Ų385.3 Ų85.31%0.01345%0.445CS..EExtended strand (participates in β ladder)trans-99.1131.4172.5-74.7-100000109.4P119 L209 W236 M248 S249 L250 W292P119-F263 HydrophobicContact CB-CE1 3.94Å; P119-F263 HydrophobicContact CB-CZ 3.74Å; L209-F263 HydrophobicContact CB-CB 4.16Å; L209-F263 HydrophobicContact CB-CD1 4.05Å; L209-F263 HydrophobicContact CB-CD2 3.65Å; L209-F263 HydrophobicContact CB-CE1 4.32Å; L209-F263 HydrophobicContact CB-CE2 3.99Å; L209-F263 HydrophobicContact CB-CG 3.69Å; L209-F263 HydrophobicContact CB-CZ 4.3Å; L209-F263 HydrophobicContact CD1-CB 3.98Å; L209-F263 HydrophobicContact CD1-CD1 3.89Å; L209-F263 HydrophobicContact CD1-CG 3.99Å; W236-F263 HydrophobicContact CH2-CB 3.86Å; W236-F263 WeakPolarHBondContact CH2-O 3.43Å; W236-F263 WeakPolarHBondContact CZ2-O 3.38Å; W236-F263 HydrophobicContact CZ3-CB 4.36Å; M248-F263 HydrophobicContact CB-CD1 4.26Å; M248-F263 HydrophobicContact SD-CD1 4.49Å; M248-F263 HydrophobicContact SD-CE1 4.27Å; S249-F263 WeakPolarHBondContact O-CA 3.39Å; L250-F263 HydrophobicContact CD1-CD1 4.11Å; L250-F263 HydrophobicContact CD1-CD2 4.11Å; L250-F263 HydrophobicContact CD1-CE1 3.76Å; L250-F263 HydrophobicContact CD1-CE2 3.72Å; L250-F263 HydrophobicContact CD1-CG 4.29Å; L250-F263 HydrophobicContact CD1-CZ 3.54Å; F263-W292 HydrophobicContact CD1-CH2 4.46Å; F263-W292 AromaticContact CE1-CH2 3.64Å; F263-W292 HydrophobicContact CE1-CH2 3.64Å; F263-W292 HydrophobicContact CE1-CZ3 4.11Å; F263-W292 HydrophobicContact CZ-CH2 4.44Å
264R93.6Very high86.1Confident129 Ų12986 Ų8649%0.48745%0.447SS..EExtended strand (participates in β ladder)trans-100.9133.5165-67.5-177.671.5-174.84.2107.8M248 S249 V251M248-R264 CarbonylContact C-O 3.53Å; M248-R264 WeakPolarHBondContact CA-O 3.42Å; S249-R264 PolarHBondContact N-O 2.92Å; S249-R264 PolarHBondContact O-N 3.49Å; V251-R264 HydrophobicContact CG2-CG 3.69Å
265Q92.9Very high86.2Confident43 Ų4393.9 Ų93.920%0.20148%0.478CS..EExtended strand (participates in β ladder)trans-125.1145.3-179.863173.150.400112.2Y207 W236 V246 K247Y207-Q265 VanDerWaalsContact OH-CD 3.28Å; Y207-Q265 PolarHBondContact OH-NE2 2.89Å; Y207-Q265 PolarHBondContact OH-OE1 3.48Å; W236-Q265 VanDerWaalsContact CD2-CD 3.41Å; W236-Q265 HydrophobicContact CD2-CG 4.21Å; W236-Q265 HydrophobicContact CG-CG 4.34Å; W236-Q265 HydrophobicContact CZ2-CG 4.25Å; V246-Q265 HydrophobicContact CG1-CB 4.05Å; K247-Q265 CarbonylContact O-C 3.55Å; K247-Q265 VanDerWaalsContact O-CA 3.31Å; K247-Q265 WeakPolarHBondContact O-CA 3.38Å
266E94.8Very high86.9Confident100 Ų10093.1 Ų93.147%0.46746%0.461SS..EExtended strand (participates in β ladder)trans-119.3120.5167.2-70.7173.5-170.100107.7K247 R293K247-E266 HydrophobicContact CB-CB 4.45Å; K247-E266 PolarHBondContact N-O 3.19Å; K247-E266 PolarHBondContact O-N 3.26Å; E266-R293 IonicContact OE1-CZ 2.67Å; E266-R293 IonicContact OE1-NH1 3.24Å; E266-R293 PolarHBondContact OE1-NH1 2.99Å; E266-R293 WeakPolarHBondContact OE2-CD 3.37Å
267S93.7Very high87.9Confident77 Ų7787.3 Ų87.354%0.53845%0.447SS..EExtended strand (participates in β ladder)trans-104.2129.5-179.852.60000111.5W245W245-S267 CarbonylContact O-C 3.54Å; W245-S267 VanDerWaalsContact O-CA 3.27Å; W245-S267 WeakPolarHBondContact O-CA 3.33Å
268G93.9Very high88.9Confident35 Ų3584.5 Ų84.536%0.36144%0.444SS..EExtended strand (participates in β ladder)trans-107.3135.9166.300000109.8T244 W245T244-G268 CarbonylContact C-O 3.6Å; W245-G268 PolarHBondContact N-O 2.97Å; W245-G268 PolarHBondContact O-N 3.27Å
269V94.3Very high89.4Confident88 Ų8884.9 Ų84.953%0.53345%0.446SS..EExtended strand (participates in β ladder)trans-118.8130-177.4-1740000109.5F242F242-V269 HydrophobicContact CB-CG1 3.4Å; F242-V269 VanDerWaalsContact CB-CG1 3.4Å; F242-V269 HydrophobicContact CD1-CG1 3.63Å; F242-V269 HydrophobicContact CD2-CG1 4.48Å; F242-V269 HydrophobicContact CG-CG1 3.59Å
270V91.4Very high89.3Confident92 Ų9282.9 Ų82.956%0.55844%0.437SS*.EExtended strand (participates in β ladder)trans-125.4132.3177.6-176.70000109.1F242 R243 F272F242-V270 CarbonylContact C-O 3.57Å; F242-V270 WeakPolarHBondContact CA-O 3.39Å; R243-V270 PolarHBondContact N-O 2.9Å; R243-V270 PolarHBondContact O-N 3.44Å; V270-F272 PolarHBondContact O-N 3.17Å
271K91.6Very high89Confident147 Ų14784.6 Ų84.664%0.63944%0.435SS*.EExtended strand (participates in β ladder)trans-62.4131.2177.6-176.1177.7177.9-179.30110.6F242F242-K271 HydrophobicContact CD1-CB 4.2Å; F242-K271 HydrophobicContact CE1-CB 4.22Å; F242-K271 HydrophobicContact CE1-CG 4.44Å
272F88.8Confident88.6Confident39 Ų3987.1 Ų87.117%0.17145%0.451CS..  trans-81118.6167.6176.6-116000108.8L144 P147 G241 V270 D274 L285 F287L144-F272 HydrophobicContact CD1-CD2 4.23Å; L144-F272 HydrophobicContact CD1-CE2 3.66Å; P147-F272 HydrophobicContact CB-CZ 4.07Å; P147-F272 HydrophobicContact CG-CZ 4.05Å; G241-F272 WeakPolarHBondContact O-CB 3.14Å; G241-F272 PolarHBondContact O-N 3.43Å; G241-F272 VanDerWaalsContact O-N 3.17Å; V270-F272 PolarHBondContact O-N 3.17Å; F272-D274 HydrophobicContact CD1-CB 3.97Å; F272-D274 HydrophobicContact CE1-CB 3.65Å; F272-D274 PolarHBondContact O-N 2.89Å; F272-L285 HydrophobicContact CE1-CD1 4.31Å; F272-F287 HydrophobicContact CB-CD2 4.26Å; F272-F287 HydrophobicContact CB-CE2 4.08Å; F272-F287 AromaticContact CD1-CE2 3.56Å; F272-F287 HydrophobicContact CD1-CE2 3.56Å; F272-F287 HydrophobicContact CD1-CZ 4.15Å; F272-F287 HydrophobicContact CD2-CD2 4.41Å; F272-F287 AromaticContact CD2-CE2 3.8Å; F272-F287 HydrophobicContact CD2-CE2 3.8Å; F272-F287 HydrophobicContact CD2-CZ 4.09Å; F272-F287 AromaticContact CE1-CE2 3.84Å; F272-F287 HydrophobicContact CE1-CE2 3.84Å; F272-F287 AromaticContact CE1-CZ 3.95Å; F272-F287 HydrophobicContact CE1-CZ 3.95Å; F272-F287 HydrophobicContact CE2-CE2 4.09Å; F272-F287 AromaticContact CE2-CZ 3.92Å; F272-F287 HydrophobicContact CE2-CZ 3.92Å; F272-F287 HydrophobicContact CG-CD2 4.15Å; F272-F287 AromaticContact CG-CE2 3.53Å; F272-F287 HydrophobicContact CG-CE2 3.53Å; F272-F287 HydrophobicContact CG-CZ 4.21Å; F272-F287 HydrophobicContact CZ-CE2 4.1Å; F272-F287 AromaticContact CZ-CZ 3.84Å; F272-F287 HydrophobicContact CZ-CZ 3.84Å
273N87.6Confident88.3Confident113 Ų11384.1 Ų84.160%0.60444%0.439SS*.  trans-85.992.8172.9-67.9-31.6000107.9K275N273-K275 PolarHBondContact O-N 3.46Å
274D86.4Confident88.1Confident52 Ų5287.2 Ų87.228%0.27845%0.454SS..  trans-65.9119.1178.6-160.3-14.6000110.2F272 R276F272-D274 HydrophobicContact CD1-CB 3.97Å; F272-D274 HydrophobicContact CE1-CB 3.65Å; F272-D274 PolarHBondContact O-N 2.89Å; D274-R276 WeakPolarHBondContact OD1-CB 3.29Å; D274-R276 WeakPolarHBondContact OD1-CG 3.28Å; D274-R276 PolarHBondContact OD1-N 3.18Å; D274-R276 IonicContact OD1-NE 2.64Å; D274-R276 PolarHBondContact OD1-NE 3.26Å; D274-R276 IonicContact OD2-CZ 3Å; D274-R276 VanDerWaalsContact OD2-CZ 3.28Å; D274-R276 IonicContact OD2-NE 3.28Å; D274-R276 PolarHBondContact OD2-NE 3.31Å; D274-R276 IonicContact OD2-NH2 3Å; D274-R276 PolarHBondContact OD2-NH2 3.38Å
275K86.7Confident88Confident199 Ų19981.2 Ų81.287%0.86543%0.431SS*.  trans-1052.6178.5-65.4-176.1-179.2179.50112.3N273N273-K275 PolarHBondContact O-N 3.46Å
276R86.1Confident88Confident29 Ų2979.2 Ų79.211%0.10942%0.422CS..SBendtrans-66.4162.5179.5-63.6178.8-61.3159.93.1110.9P147 D274 E280 Q281 V283 L285P147-R276 HydrophobicContact CG-CG 4.08Å; P147-R276 WeakPolarHBondContact O-CD 3.46Å; D274-R276 WeakPolarHBondContact OD1-CB 3.29Å; D274-R276 WeakPolarHBondContact OD1-CG 3.28Å; D274-R276 PolarHBondContact OD1-N 3.18Å; D274-R276 IonicContact OD1-NE 2.64Å; D274-R276 PolarHBondContact OD1-NE 3.26Å; D274-R276 IonicContact OD2-CZ 3Å; D274-R276 VanDerWaalsContact OD2-CZ 3.28Å; D274-R276 IonicContact OD2-NE 3.28Å; D274-R276 PolarHBondContact OD2-NE 3.31Å; D274-R276 IonicContact OD2-NH2 3Å; D274-R276 PolarHBondContact OD2-NH2 3.38Å; R276-E280 HydrophobicContact CB-CB 4.02Å; R276-E280 PolarHBondContact NH1-O 2.84Å; R276-E280 PolarHBondContact NH2-O 2.94Å; R276-Q281 PolarHBondContact O-NE2 2.93Å; R276-V283 PolarHBondContact NH2-O 2.97Å; R276-L285 VanDerWaalsContact CZ-CD1 3.45Å
277S85.5Confident88Confident52 Ų5274.5 Ų74.536%0.36440%0.4SS..  trans-63.3152.4175630000111.4S279 E280 Q281S277-S279 PolarHBondContact O-N 2.99Å; S277-S279 VanDerWaalsContact O-N 3.1Å; S277-S279 PolarHBondContact OG-OG 3.25Å; S277-E280 PolarHBondContact N-OE2 3.3Å; S277-E280 VanDerWaalsContact N-OE2 3.16Å; S277-E280 PolarHBondContact O-N 2.92Å; S277-E280 WeakPolarHBondContact OG-CG 3.35Å; S277-E280 PolarHBondContact OG-OE2 3.47Å; S277-Q281 WeakPolarHBondContact O-CG 3.3Å; S277-Q281 PolarHBondContact O-N 2.89Å
278E83.2Confident88.1Confident170 Ų17070.9 Ų70.979%0.79437%0.374SS*.THydrogen-bonded Turntrans-56-31-179.5-68.3-176.3172.600112.6E280 Q281E278-E280 VanDerWaalsContact C-N 3.29Å; E278-E280 PolarHBondContact O-N 3.36Å; E278-Q281 PolarHBondContact O-N 3.44Å
279S81.6Confident88.2Confident92 Ų9269.2 Ų69.264%0.64336%0.357SS*.THydrogen-bonded Turntrans-64.3-28.1174.938.90000114.4S277 T282S277-S279 PolarHBondContact O-N 2.99Å; S277-S279 VanDerWaalsContact O-N 3.1Å; S277-S279 PolarHBondContact OG-OG 3.25Å; S279-T282 PolarHBondContact O-OG1 3.46Å
280E80.9Confident88.3Confident102 Ų10265 Ų6548%0.47733%0.332SS..THydrogen-bonded Turntrans-95.5-13.4-178.6-66.5166142.800112.6R276 S277 E278 T282R276-E280 HydrophobicContact CB-CB 4.02Å; R276-E280 PolarHBondContact NH1-O 2.84Å; R276-E280 PolarHBondContact NH2-O 2.94Å; S277-E280 PolarHBondContact N-OE2 3.3Å; S277-E280 VanDerWaalsContact N-OE2 3.16Å; S277-E280 PolarHBondContact O-N 2.92Å; S277-E280 WeakPolarHBondContact OG-CG 3.35Å; S277-E280 PolarHBondContact OG-OE2 3.47Å; E278-E280 VanDerWaalsContact C-N 3.29Å; E278-E280 PolarHBondContact O-N 3.36Å; E280-T282 PolarHBondContact O-N 3.19Å
281Q79.9Confident88.5Confident90 Ų9061.2 Ų61.242%0.42131%0.308SS..THydrogen-bonded Turntrans-76.6-4.7179.2-70.9178.928.500113.6R276 S277 E278 V283R276-Q281 PolarHBondContact O-NE2 2.93Å; S277-Q281 WeakPolarHBondContact O-CG 3.3Å; S277-Q281 PolarHBondContact O-N 2.89Å; E278-Q281 PolarHBondContact O-N 3.44Å; Q281-V283 PolarHBondContact O-N 2.96Å
282T81.4Confident88.7Confident80 Ų8055 Ų5549%0.49128%0.281SS..THydrogen-bonded Turntrans-66.9-24.2172.954.80000112.3S279 E280S279-T282 PolarHBondContact O-OG1 3.46Å; E280-T282 PolarHBondContact O-N 3.19Å
283V86.7Confident88.9Confident34 Ų3456.9 Ų56.921%0.20629%0.286CS..SBendtrans-93.5121.3177.8-177.90000109.9R276 Q281 L285R276-V283 PolarHBondContact NH2-O 2.97Å; Q281-V283 PolarHBondContact O-N 2.96Å; V283-L285 HydrophobicContact CG1-CD2 4.41Å
284Q88.5Confident89Confident68 Ų6852.9 Ų52.932%0.31827%0.265SS..EExtended strand (participates in β ladder)trans-77128.5177.5-172.166.30.700110.2S194 Q195 F286S194-Q284 WeakPolarHBondContact CA-O 3.33Å; Q195-Q284 PolarHBondContact N-O 2.86Å; Q195-Q284 PolarHBondContact O-N 3.48Å; Q284-F286 HydrophobicContact CB-CE2 4.44Å; Q284-F286 HydrophobicContact CG-CE2 4.09Å; Q284-F286 HydrophobicContact CG-CZ 4.25Å
285L91.6Very high89.4Confident4 Ų452.2 Ų52.22%0.02126%0.264CS..EExtended strand (participates in β ladder)trans-104145.5176.7-60-176.4000111.7L131 P147 F193 G241 F272 R276 V283 F287L131-L285 HydrophobicContact CD1-CD2 4.07Å; P147-L285 HydrophobicContact CB-CD1 3.87Å; F193-L285 WeakPolarHBondContact O-CA 3.16Å; G241-L285 PolarHBondContact N-O 3.34Å; F272-L285 HydrophobicContact CE1-CD1 4.31Å; R276-L285 VanDerWaalsContact CZ-CD1 3.45Å; V283-L285 HydrophobicContact CG1-CD2 4.41Å; L285-F287 HydrophobicContact CB-CD2 4.48Å; L285-F287 HydrophobicContact CB-CE2 3.59Å; L285-F287 HydrophobicContact CB-CZ 3.72Å; L285-F287 HydrophobicContact CD1-CE2 4.32Å; L285-F287 HydrophobicContact CD1-CZ 3.73Å; L285-F287 HydrophobicContact CG-CZ 4.39Å
286F93.9Very high89.8Confident0 Ų047.3 Ų47.30%024%0.24CC..EExtended strand (participates in β ladder)trans-123140.5174.1-50.3-113.4000109.6Q192 F193 Q195 I205 F238 G240 Q284Q192-F286 CarbonylContact C-O 3.59Å; Q192-F286 WeakPolarHBondContact CA-O 3.32Å; F193-F286 HydrophobicContact CB-CB 4.07Å; F193-F286 HydrophobicContact CB-CD2 4.14Å; F193-F286 HydrophobicContact CB-CG 4.41Å; F193-F286 HydrophobicContact CD2-CB 4.4Å; F193-F286 PolarHBondContact N-O 2.85Å; F193-F286 PolarHBondContact O-N 3.02Å; Q195-F286 HydrophobicContact CB-CE2 3.58Å; Q195-F286 HydrophobicContact CB-CZ 4.22Å; Q195-F286 VanDerWaalsContact OE1-CZ 3.25Å; I205-F286 HydrophobicContact CD1-CB 4.23Å; I205-F286 HydrophobicContact CD1-CD1 3.89Å; I205-F286 HydrophobicContact CD1-CD2 4.03Å; I205-F286 HydrophobicContact CD1-CE1 4.22Å; I205-F286 HydrophobicContact CD1-CE2 4.39Å; I205-F286 HydrophobicContact CD1-CG 3.79Å; I205-F286 HydrophobicContact CD1-CZ 4.45Å; I205-F286 HydrophobicContact CG1-CD1 3.96Å; I205-F286 HydrophobicContact CG1-CE1 3.94Å; I205-F286 HydrophobicContact CG1-CG 4.37Å; I205-F286 HydrophobicContact CG1-CZ 4.35Å; F238-F286 HydrophobicContact CD2-CB 4.32Å; F238-F286 HydrophobicContact CD2-CD1 4.33Å; F238-F286 HydrophobicContact CE2-CB 3.78Å; F238-F286 HydrophobicContact CE2-CD1 4.18Å; F238-F286 HydrophobicContact CE2-CG 4.39Å; G240-F286 VanDerWaalsContact CA-CE1 3.44Å; G240-F286 VanDerWaalsContact N-CD1 3.31Å; Q284-F286 HydrophobicContact CB-CE2 4.44Å; Q284-F286 HydrophobicContact CG-CE2 4.09Å; Q284-F286 HydrophobicContact CG-CZ 4.25Å
287F94.5Very high90.1Very high2 Ų246.5 Ų46.51%0.00924%0.238CC..EExtended strand (participates in β ladder)trans-133.4125.6-179.1-56.2-82.9000109L144 P147 F190 Q192 R243 T244 F272 L285L144-F287 HydrophobicContact CD1-CD1 4.26Å; L144-F287 HydrophobicContact CD1-CE1 3.71Å; L144-F287 HydrophobicContact CD1-CZ 4.1Å; L144-F287 HydrophobicContact CD2-CE1 4.09Å; P147-F287 HydrophobicContact CB-CZ 4.47Å; F190-F287 HydrophobicContact CE2-CB 4.13Å; F190-F287 HydrophobicContact CE2-CD1 4.18Å; F190-F287 AromaticContact CZ-CD1 3.73Å; F190-F287 HydrophobicContact CZ-CD1 3.73Å; F190-F287 HydrophobicContact CZ-CE1 4.49Å; Q192-F287 HydrophobicContact CB-CD1 4.22Å; Q192-F287 HydrophobicContact CB-CE1 4.37Å; Q192-F287 HydrophobicContact CG-CD1 3.91Å; Q192-F287 HydrophobicContact CG-CE1 3.65Å; R243-F287 WeakPolarHBondContact CA-O 3.43Å; R243-F287 HydrophobicContact CB-CB 4.03Å; R243-F287 HydrophobicContact CG-CB 4.26Å; T244-F287 PolarHBondContact N-O 3.38Å; F272-F287 HydrophobicContact CB-CD2 4.26Å; F272-F287 HydrophobicContact CB-CE2 4.08Å; F272-F287 AromaticContact CD1-CE2 3.56Å; F272-F287 HydrophobicContact CD1-CE2 3.56Å; F272-F287 HydrophobicContact CD1-CZ 4.15Å; F272-F287 HydrophobicContact CD2-CD2 4.41Å; F272-F287 AromaticContact CD2-CE2 3.8Å; F272-F287 HydrophobicContact CD2-CE2 3.8Å; F272-F287 HydrophobicContact CD2-CZ 4.09Å; F272-F287 AromaticContact CE1-CE2 3.84Å; F272-F287 HydrophobicContact CE1-CE2 3.84Å; F272-F287 AromaticContact CE1-CZ 3.95Å; F272-F287 HydrophobicContact CE1-CZ 3.95Å; F272-F287 HydrophobicContact CE2-CE2 4.09Å; F272-F287 AromaticContact CE2-CZ 3.92Å; F272-F287 HydrophobicContact CE2-CZ 3.92Å; F272-F287 HydrophobicContact CG-CD2 4.15Å; F272-F287 AromaticContact CG-CE2 3.53Å; F272-F287 HydrophobicContact CG-CE2 3.53Å; F272-F287 HydrophobicContact CG-CZ 4.21Å; F272-F287 HydrophobicContact CZ-CE2 4.1Å; F272-F287 AromaticContact CZ-CZ 3.84Å; F272-F287 HydrophobicContact CZ-CZ 3.84Å; L285-F287 HydrophobicContact CB-CD2 4.48Å; L285-F287 HydrophobicContact CB-CE2 3.59Å; L285-F287 HydrophobicContact CB-CZ 3.72Å; L285-F287 HydrophobicContact CD1-CE2 4.32Å; L285-F287 HydrophobicContact CD1-CZ 3.73Å; L285-F287 HydrophobicContact CG-CZ 4.39Å
288V96.1Very high90.4Very high0 Ų044.7 Ų44.70%022%0.224CC..EExtended strand (participates in β ladder)trans-134.7139.2177.766.90000110.4M191 F193 F238 T244 V246 F290M191-V288 HydrophobicContact CB-CG1 3.87Å; M191-V288 HydrophobicContact CE-CG1 4.03Å; M191-V288 PolarHBondContact N-O 3.35Å; M191-V288 PolarHBondContact O-N 3.28Å; F193-V288 HydrophobicContact CE2-CG1 4.09Å; F238-V288 HydrophobicContact CD1-CB 4.33Å; F238-V288 HydrophobicContact CD1-CG2 4.13Å; F238-V288 HydrophobicContact CD2-CB 4.25Å; F238-V288 HydrophobicContact CE1-CB 4.24Å; F238-V288 HydrophobicContact CE1-CG1 4.14Å; F238-V288 HydrophobicContact CE1-CG2 4.32Å; F238-V288 HydrophobicContact CE2-CB 4.14Å; F238-V288 HydrophobicContact CE2-CG1 4.26Å; F238-V288 HydrophobicContact CG-CB 4.34Å; F238-V288 HydrophobicContact CG-CG2 4.36Å; F238-V288 HydrophobicContact CZ-CB 4.13Å; F238-V288 HydrophobicContact CZ-CG1 3.88Å; T244-V288 CarbonylContact O-C 3.56Å; T244-V288 VanDerWaalsContact O-CA 3.3Å; T244-V288 WeakPolarHBondContact O-CA 3.23Å; V246-V288 HydrophobicContact CG2-CG2 3.96Å; V288-F290 HydrophobicContact CB-CE2 4.22Å; V288-F290 HydrophobicContact CG1-CD2 4.38Å; V288-F290 HydrophobicContact CG1-CE2 3.8Å; V288-F290 HydrophobicContact CG2-CD2 3.92Å; V288-F290 HydrophobicContact CG2-CE2 3.37Å; V288-F290 HydrophobicContact CG2-CZ 3.82Å
289V96.1Very high90.9Very high0 Ų037.9 Ų37.90%019%0.192CC..EExtended strand (participates in β ladder)trans-119.5128.3173.71790000107.7I141 L188 I189 F190 T244 W245 V246I141-V289 HydrophobicContact CD1-CG1 4.12Å; I141-V289 HydrophobicContact CD1-CG2 3.62Å; L188-V289 HydrophobicContact CB-CG1 4.07Å; L188-V289 HydrophobicContact CD1-CG1 4Å; L188-V289 HydrophobicContact CD2-CG1 4.24Å; L188-V289 HydrophobicContact CG-CG1 4.34Å; I189-V289 CarbonylContact O-C 3.6Å; I189-V289 VanDerWaalsContact O-CA 3.27Å; I189-V289 WeakPolarHBondContact O-CA 3.5Å; F190-V289 HydrophobicContact CD2-CG2 3.62Å; F190-V289 HydrophobicContact CE2-CG2 4.31Å; T244-V289 PolarHBondContact O-N 2.96Å; W245-V289 HydrophobicContact CD2-CB 4.19Å; W245-V289 HydrophobicContact CD2-CG1 4.17Å; W245-V289 HydrophobicContact CD2-CG2 4.48Å; W245-V289 HydrophobicContact CG-CB 4.1Å; W245-V289 HydrophobicContact CG-CG1 4.28Å; W245-V289 HydrophobicContact CZ2-CG1 4.16Å; V246-V289 PolarHBondContact N-O 3.26Å
290F96.5Very high91.3Very high0 Ų035 Ų350%017%0.169CC..EExtended strand (participates in β ladder)trans-110.9131169.1-65.3-98000110.1I121 L188 I189 M191 Y207 L209 V246 M248 V288I121-F290 HydrophobicContact CD1-CB 3.91Å; I121-F290 HydrophobicContact CD1-CD1 4.24Å; I121-F290 HydrophobicContact CD1-CD2 3.86Å; I121-F290 HydrophobicContact CD1-CE2 4.42Å; I121-F290 HydrophobicContact CD1-CG 3.76Å; I121-F290 HydrophobicContact CG2-CD2 4.32Å; I121-F290 HydrophobicContact CG2-CE1 4.14Å; I121-F290 HydrophobicContact CG2-CE2 3.81Å; I121-F290 HydrophobicContact CG2-CZ 3.71Å; L188-F290 VanDerWaalsContact CA-O 3.27Å; L188-F290 WeakPolarHBondContact CA-O 3.38Å; I189-F290 HydrophobicContact CG2-CB 3.65Å; I189-F290 HydrophobicContact CG2-CD2 4.28Å; I189-F290 HydrophobicContact CG2-CG 4.42Å; I189-F290 PolarHBondContact N-O 3.25Å; I189-F290 PolarHBondContact O-N 3.36Å; M191-F290 HydrophobicContact CE-CD2 3.43Å; M191-F290 VanDerWaalsContact CE-CD2 3.43Å; M191-F290 HydrophobicContact CE-CE2 3.46Å; M191-F290 VanDerWaalsContact CE-CE2 3.46Å; Y207-F290 HydrophobicContact CD1-CZ 4.42Å; Y207-F290 AromaticContact CD2-CE1 3.79Å; Y207-F290 HydrophobicContact CD2-CE1 3.79Å; Y207-F290 AromaticContact CD2-CZ 3.79Å; Y207-F290 HydrophobicContact CD2-CZ 3.79Å; Y207-F290 HydrophobicContact CE1-CZ 4.47Å; Y207-F290 AromaticContact CE2-CE1 3.53Å; Y207-F290 HydrophobicContact CE2-CE1 3.53Å; Y207-F290 AromaticContact CE2-CZ 3.87Å; Y207-F290 HydrophobicContact CE2-CZ 3.87Å; Y207-F290 HydrophobicContact CG-CZ 4.07Å; L209-F290 HydrophobicContact CD2-CD1 4.34Å; L209-F290 HydrophobicContact CD2-CE1 4.06Å; V246-F290 HydrophobicContact CB-CD1 3.7Å; V246-F290 HydrophobicContact CB-CE1 3.91Å; V246-F290 HydrophobicContact CB-CG 4.31Å; V246-F290 HydrophobicContact CG1-CD1 3.76Å; V246-F290 HydrophobicContact CG1-CE1 3.82Å; V246-F290 HydrophobicContact CG2-CD1 4.26Å; V246-F290 HydrophobicContact CG2-CE1 4.01Å; V246-F290 HydrophobicContact CG2-CZ 4.37Å; V246-F290 WeakPolarHBondContact O-CA 3.42Å; M248-F290 HydrophobicContact CE-CB 4.37Å; V288-F290 HydrophobicContact CB-CE2 4.22Å; V288-F290 HydrophobicContact CG1-CD2 4.38Å; V288-F290 HydrophobicContact CG1-CE2 3.8Å; V288-F290 HydrophobicContact CG2-CD2 3.92Å; V288-F290 HydrophobicContact CG2-CE2 3.37Å; V288-F290 HydrophobicContact CG2-CZ 3.82Å
291E95.3Very high91.5Very high13 Ų1335.1 Ų35.16%0.06117%0.165CC..EExtended strand (participates in β ladder)trans-142156.617673.8178-163.200110.9L188 W245 V246 K247 M248L188-E291 HydrophobicContact CB-CB 3.96Å; W245-E291 PolarHBondContact NE1-OE2 3.3Å; V246-E291 PolarHBondContact O-N 3.49Å; K247-E291 CarbonylContact C-O 3.59Å; K247-E291 WeakPolarHBondContact CA-O 3.37Å; K247-E291 HydrophobicContact CB-CG 4.37Å; K247-E291 WeakPolarHBondContact CD-OE1 3.45Å; K247-E291 WeakPolarHBondContact CE-OE1 3.33Å; K247-E291 HydrophobicContact CG-CG 3.96Å; K247-E291 WeakPolarHBondContact CG-OE1 3.28Å; K247-E291 IonicContact NZ-OE1 3.7Å; K247-E291 PolarHBondContact NZ-OE1 3.31Å; M248-E291 WeakPolarHBondContact CG-O 3.42Å; M248-E291 PolarHBondContact N-O 2.87Å
292W95.3Very high91.5Very high16 Ų1631.5 Ų31.56%0.06115%0.149CC..EExtended strand (participates in β ladder)trans-76.6130.5168.6-70.6106.7000110.8F116 P119 P180 V183 M248 L250 F263F116-W292 HydrophobicContact CB-CD2 4.42Å; F116-W292 HydrophobicContact CB-CH2 4.24Å; F116-W292 HydrophobicContact CB-CZ2 3.48Å; F116-W292 VanDerWaalsContact CB-CZ2 3.48Å; F116-W292 HydrophobicContact CD1-CD2 4.19Å; F116-W292 AromaticContact CD1-CE2 3.99Å; F116-W292 HydrophobicContact CD1-CE3 4.05Å; F116-W292 AromaticContact CD1-CH2 3.52Å; F116-W292 HydrophobicContact CD1-CH2 3.52Å; F116-W292 AromaticContact CD1-CZ2 3.66Å; F116-W292 HydrophobicContact CD1-CZ2 3.66Å; F116-W292 AromaticContact CD1-CZ3 3.75Å; F116-W292 HydrophobicContact CD1-CZ3 3.75Å; F116-W292 AromaticContact CD2-CD2 3.96Å; F116-W292 HydrophobicContact CD2-CD2 3.96Å; F116-W292 AromaticContact CD2-CE2 3.97Å; F116-W292 HydrophobicContact CD2-CE3 4.42Å; F116-W292 HydrophobicContact CD2-CG 4.16Å; F116-W292 HydrophobicContact CD2-CZ2 4.43Å; F116-W292 HydrophobicContact CE1-CD2 4.44Å; F116-W292 AromaticContact CE1-CE3 3.98Å; F116-W292 HydrophobicContact CE1-CE3 3.98Å; F116-W292 HydrophobicContact CE1-CH2 4.07Å; F116-W292 AromaticContact CE1-CZ3 3.81Å; F116-W292 HydrophobicContact CE1-CZ3 3.81Å; F116-W292 HydrophobicContact CE2-CD2 4.24Å; F116-W292 HydrophobicContact CE2-CE3 4.38Å; F116-W292 HydrophobicContact CE2-CG 4.43Å; F116-W292 AromaticContact CG-CD2 3.94Å; F116-W292 HydrophobicContact CG-CD2 3.94Å; F116-W292 AromaticContact CG-CE2 3.59Å; F116-W292 HydrophobicContact CG-CE3 4.27Å; F116-W292 AromaticContact CG-CH2 3.98Å; F116-W292 HydrophobicContact CG-CH2 3.98Å; F116-W292 AromaticContact CG-CZ2 3.6Å; F116-W292 HydrophobicContact CG-CZ2 3.6Å; F116-W292 HydrophobicContact CG-CZ3 4.31Å; F116-W292 HydrophobicContact CZ-CD2 4.47Å; F116-W292 HydrophobicContact CZ-CE3 4.16Å; F116-W292 HydrophobicContact CZ-CZ3 4.44Å; P119-W292 HydrophobicContact CB-CZ2 4.37Å; P119-W292 HydrophobicContact CG-CH2 4.41Å; P119-W292 HydrophobicContact CG-CZ2 3.77Å; P180-W292 PolarHBondContact O-NE1 3.44Å; V183-W292 HydrophobicContact CB-CB 4.39Å; V183-W292 HydrophobicContact CG1-CB 4.12Å; V183-W292 HydrophobicContact CG2-CB 3.51Å; V183-W292 HydrophobicContact CG2-CG 3.63Å; M248-W292 HydrophobicContact CB-CE3 4.42Å; M248-W292 HydrophobicContact CB-CZ3 4.42Å; M248-W292 HydrophobicContact CE-CD2 3.99Å; M248-W292 HydrophobicContact CE-CG 4.25Å; M248-W292 HydrophobicContact CE-CZ2 4.23Å; M248-W292 HydrophobicContact CG-CD2 4.12Å; M248-W292 HydrophobicContact CG-CE3 3.82Å; M248-W292 HydrophobicContact CG-CZ3 4.09Å; M248-W292 HydrophobicContact SD-CD2 4.29Å; M248-W292 HydrophobicContact SD-CE3 4.27Å; M248-W292 HydrophobicContact SD-CH2 4.17Å; M248-W292 HydrophobicContact SD-CZ2 4.18Å; M248-W292 HydrophobicContact SD-CZ3 4.19Å; L250-W292 HydrophobicContact CB-CH2 4.27Å; L250-W292 HydrophobicContact CB-CZ3 4Å; F263-W292 HydrophobicContact CD1-CH2 4.46Å; F263-W292 AromaticContact CE1-CH2 3.64Å; F263-W292 HydrophobicContact CE1-CH2 3.64Å; F263-W292 HydrophobicContact CE1-CZ3 4.11Å; F263-W292 HydrophobicContact CZ-CH2 4.44Å
293R93.3Very high91.2Very high78 Ų7832.1 Ų32.129%0.29415%0.148SC..SBendtrans-70-44.3179.3-171-175.365.5-173.1-7.2111.9K247 M248 S249 E266K247-R293 HydrophobicContact CB-CB 3.88Å; K247-R293 HydrophobicContact CB-CG 4.14Å; K247-R293 HydrophobicContact CD-CG 4.41Å; M248-R293 PolarHBondContact O-N 3.41Å; S249-R293 PolarHBondContact OG-NH2 3.4Å; E266-R293 IonicContact OE1-CZ 2.67Å; E266-R293 IonicContact OE1-NH1 3.24Å; E266-R293 PolarHBondContact OE1-NH1 2.99Å; E266-R293 WeakPolarHBondContact OE2-CD 3.37Å
294D90.6Very high90.5Very high29 Ų2931.4 Ų31.416%0.15514%0.144CC..  trans-148155.9-172.654.855.2000110.9S249 Y296S249-D294 PolarHBondContact OG-OD1 3.29Å; D294-Y296 HydrophobicContact CB-CD2 4.03Å; D294-Y296 PolarHBondContact O-N 2.83Å; D294-Y296 VanDerWaalsContact O-N 3.16Å; D294-Y296 PolarHBondContact OD1-N 3.33Å; D294-Y296 VanDerWaalsContact OD1-O 3.1Å
295P93.9Very high89.6Confident38 Ų3830.3 Ų30.325%0.24714%0.142CC..SBendtrans-80.219.6178.134.7-36.8000112.4E112 V113 V183E112-P295 CarbonylContact C-O 3.6Å; E112-P295 WeakPolarHBondContact CA-O 3.21Å; E112-P295 HydrophobicContact CG-CB 4.42Å; E112-P295 HydrophobicContact CG-CG 4.49Å; V113-P295 WeakPolarHBondContact CG2-O 3.33Å; V113-P295 PolarHBondContact N-O 3.44Å; V183-P295 HydrophobicContact CG1-CB 4.13Å
296Y94.1Very high88.8Confident96 Ų9631.8 Ų31.838%0.37615%0.154SC..EExtended strand (participates in β ladder)trans-111.7126.5-173.1-59.6-73.4000111.4K111 E112 D294K111-Y296 WeakPolarHBondContact O-CA 3.48Å; E112-Y296 HydrophobicContact CB-CD1 3.91Å; E112-Y296 HydrophobicContact CB-CE1 3.78Å; E112-Y296 HydrophobicContact CG-CD1 4.3Å; E112-Y296 HydrophobicContact CG-CE1 3.96Å; D294-Y296 HydrophobicContact CB-CD2 4.03Å; D294-Y296 PolarHBondContact O-N 2.83Å; D294-Y296 VanDerWaalsContact O-N 3.16Å; D294-Y296 PolarHBondContact OD1-N 3.33Å; D294-Y296 VanDerWaalsContact OD1-O 3.1Å
297I93.1Very high88.2Confident13 Ų1335.3 Ų35.37%0.06717%0.174CC..EExtended strand (participates in β ladder)trans-85123.9163.6-60.8178.3000107.8K111 V113 F116 L250 K252 E299K111-I297 PolarHBondContact N-O 3.16Å; K111-I297 PolarHBondContact O-N 2.99Å; V113-I297 HydrophobicContact CB-CD1 4.49Å; V113-I297 HydrophobicContact CG1-CD1 3.57Å; V113-I297 HydrophobicContact CG1-CG1 3.97Å; V113-I297 HydrophobicContact CG2-CD1 4.17Å; V113-I297 HydrophobicContact CG2-CG1 4Å; F116-I297 HydrophobicContact CD1-CD1 4.44Å; F116-I297 HydrophobicContact CD1-CG1 4.21Å; F116-I297 HydrophobicContact CE1-CD1 4.21Å; F116-I297 HydrophobicContact CE1-CG1 3.51Å; F116-I297 HydrophobicContact CZ-CG1 4.07Å; L250-I297 HydrophobicContact CD2-CD1 4.39Å; L250-I297 HydrophobicContact CD2-CG1 4.46Å; K252-I297 HydrophobicContact CB-CG2 4.42Å; K252-I297 HydrophobicContact CD-CG2 3.88Å; K252-I297 HydrophobicContact CG-CG2 3.86Å; I297-E299 HydrophobicContact CG2-CG 4.25Å; I297-E299 PolarHBondContact O-N 3.2Å
298Q93.1Very high87.7Confident14 Ų1437.1 Ų37.17%0.06519%0.186CC..EExtended strand (participates in β ladder)trans-82.2108.7173.6-174.3-177.6-30.300109V108 S109 Y110 L250 V251 K252 I300V108-Q298 HydrophobicContact CG1-CG 3.55Å; S109-Q298 CarbonylContact O-C 3.57Å; Y110-Q298 HydrophobicContact CD1-CB 4.3Å; Y110-Q298 HydrophobicContact CD1-CG 4.46Å; Y110-Q298 HydrophobicContact CE1-CB 4.06Å; Y110-Q298 HydrophobicContact CE1-CG 3.94Å; L250-Q298 PolarHBondContact O-N 3.01Å; V251-Q298 CarbonylContact C-O 3.6Å; V251-Q298 WeakPolarHBondContact CA-O 3.24Å; V251-Q298 HydrophobicContact CB-CB 4.49Å; V251-Q298 HydrophobicContact CG1-CB 4.38Å; V251-Q298 HydrophobicContact CG1-CG 4.35Å; V251-Q298 HydrophobicContact CG2-CB 4.13Å; K252-Q298 PolarHBondContact N-O 3.49Å; Q298-I300 HydrophobicContact CG-CG1 4.43Å
299E92.1Very high87.3Confident26 Ų2646.8 Ų46.812%0.12122%0.222CC..EExtended strand (participates in β ladder)trans-97.2119175.6-65.5-171.4-170.400110.6S109 K111 K252 I297 R301S109-E299 PolarHBondContact N-O 3.41Å; S109-E299 PolarHBondContact O-N 3.43Å; S109-E299 WeakPolarHBondContact OG-CB 3.44Å; S109-E299 PolarHBondContact OG-O 2.95Å; K111-E299 WeakPolarHBondContact CD-OE1 3.39Å; K252-E299 CarbonylContact O-C 3.47Å; K252-E299 WeakPolarHBondContact O-CA 3.46Å; I297-E299 HydrophobicContact CG2-CG 4.25Å; I297-E299 PolarHBondContact O-N 3.2Å; E299-R301 IonicContact OE2-CZ 2.69Å; E299-R301 VanDerWaalsContact OE2-CZ 3.24Å; E299-R301 IonicContact OE2-NE 2.71Å; E299-R301 PolarHBondContact OE2-NE 2.78Å; E299-R301 IonicContact OE2-NH2 3.81Å; E299-R301 PolarHBondContact OE2-NH2 2.96Å
300I89.7Confident87Confident33 Ų3349.8 Ų49.817%0.16924%0.243CC..EExtended strand (participates in β ladder)trans-103110.7176.6-56-177.7000108M106 S107 V108 V251 K252 T253 S254 Q298M106-I300 HydrophobicContact CB-CG2 3.45Å; M106-I300 VanDerWaalsContact CB-CG2 3.45Å; M106-I300 HydrophobicContact CE-CG2 3.99Å; M106-I300 HydrophobicContact CG-CG2 3.95Å; S107-I300 WeakPolarHBondContact O-CA 3.45Å; V108-I300 HydrophobicContact CG2-CG1 4.42Å; V251-I300 HydrophobicContact CG1-CD1 3.45Å; V251-I300 VanDerWaalsContact CG1-CD1 3.45Å; V251-I300 HydrophobicContact CG1-CG1 3.89Å; K252-I300 PolarHBondContact O-N 3.38Å; T253-I300 WeakPolarHBondContact CA-O 3.45Å; T253-I300 HydrophobicContact CG2-CB 4.25Å; T253-I300 HydrophobicContact CG2-CG2 4.2Å; S254-I300 PolarHBondContact N-O 2.85Å; S254-I300 PolarHBondContact OG-O 3.46Å; Q298-I300 HydrophobicContact CG-CG1 4.43Å
301R85.2Confident86.5Confident103 Ų10350.8 Ų50.839%0.38925%0.25SS..EExtended strand (participates in β ladder)trans-128163.8-179.8-51.1-168.8-179.6-156-3.3110.8M106 S107 S254 E299 A306M106-R301 CarbonylContact C-O 3.42Å; M106-R301 VanDerWaalsContact CA-O 3.3Å; M106-R301 WeakPolarHBondContact CA-O 3.45Å; M106-R301 VanDerWaalsContact CE-C 3.44Å; S107-R301 PolarHBondContact N-O 2.88Å; S107-R301 PolarHBondContact O-N 3.24Å; S254-R301 WeakPolarHBondContact OG-CA 3.48Å; S254-R301 WeakPolarHBondContact OG-CB 3.5Å; S254-R301 WeakPolarHBondContact OG-CG 3.43Å; E299-R301 IonicContact OE2-CZ 2.69Å; E299-R301 VanDerWaalsContact OE2-CZ 3.24Å; E299-R301 IonicContact OE2-NE 2.71Å; E299-R301 PolarHBondContact OE2-NE 2.78Å; E299-R301 IonicContact OE2-NH2 3.81Å; E299-R301 PolarHBondContact OE2-NH2 2.96Å; R301-A306 HydrophobicContact CB-CB 4.16Å
302L80.8Confident86.2Confident15 Ų1552.7 Ų52.78%0.07926%0.26CS..EExtended strand (participates in β ladder)trans-59.2142.4174.6-64.1162.6000110.1N99 P104 M106 V304 T305 A306N99-L302 WeakPolarHBondContact OD1-CD1 3.41Å; P104-L302 HydrophobicContact CB-CD2 3.37Å; P104-L302 HydrophobicContact CG-CD2 3.17Å; M106-L302 HydrophobicContact CE-CG 4.49Å; M106-L302 HydrophobicContact SD-CB 4.38Å; M106-L302 HydrophobicContact SD-CD2 3.47Å; M106-L302 WeakPolarHBondContact SD-CD2 3.1Å; M106-L302 HydrophobicContact SD-CG 3.88Å; L302-V304 PolarHBondContact O-N 3.46Å; L302-V304 VanDerWaalsContact O-N 3.16Å; L302-T305 HydrophobicContact CB-CG2 4.11Å; L302-T305 WeakPolarHBondContact CB-OG1 3.38Å; L302-T305 HydrophobicContact CD1-CG2 4.24Å; L302-T305 PolarHBondContact N-OG1 3.1Å; L302-T305 CarbonylContact O-C 3.59Å; L302-T305 PolarHBondContact O-N 3.09Å; L302-T305 PolarHBondContact O-OG1 3.29Å; L302-T305 VanDerWaalsContact O-OG1 3.07Å; L302-A306 WeakPolarHBondContact O-CB 3.43Å; L302-A306 PolarHBondContact O-N 3.3Å
303I75.7Confident86Confident93 Ų9353.5 Ų53.548%0.47727%0.273SS..Hα-helixtrans-56.5-38.5-175.4-163.7165.5000113.2V105 N307V105-I303 PolarHBondContact O-N 3.36Å; I303-N307 PolarHBondContact O-N 3.47Å
304V71.8Confident85.8Confident18 Ų1855.1 Ų55.111%0.10929%0.286CS..Hα-helixtrans-71.5-33.5178.5173.90000111.7Y91 I94 L98 L302Y91-V304 HydrophobicContact CD2-CG1 4.17Å; Y91-V304 HydrophobicContact CE2-CG1 3.54Å; Y91-V304 PolarHBondContact OH-O 3.04Å; I94-V304 HydrophobicContact CG2-CG1 4.36Å; I94-V304 HydrophobicContact CG2-CG2 4.48Å; L98-V304 HydrophobicContact CD1-CB 3.71Å; L98-V304 HydrophobicContact CD1-CG1 4.37Å; L98-V304 HydrophobicContact CD1-CG2 3.31Å; L302-V304 PolarHBondContact O-N 3.46Å; L302-V304 VanDerWaalsContact O-N 3.16Å
305T69.3Low85.9Confident45 Ų4554.8 Ų54.828%0.27628%0.284SS..Hα-helixtrans-86.5-24.2179.766.20000113L302L302-T305 HydrophobicContact CB-CG2 4.11Å; L302-T305 WeakPolarHBondContact CB-OG1 3.38Å; L302-T305 HydrophobicContact CD1-CG2 4.24Å; L302-T305 PolarHBondContact N-OG1 3.1Å; L302-T305 CarbonylContact O-C 3.59Å; L302-T305 PolarHBondContact O-N 3.09Å; L302-T305 PolarHBondContact O-OG1 3.29Å; L302-T305 VanDerWaalsContact O-OG1 3.07Å
306A74.6Confident85.8Confident35 Ų3555.3 Ų55.329%0.28929%0.288SS..Hα-helixtrans-71.8-36.1175.600000112R301 L302R301-A306 HydrophobicContact CB-CB 4.16Å; L302-A306 WeakPolarHBondContact O-CB 3.43Å; L302-A306 PolarHBondContact O-N 3.3Å
307N82.3Confident85.8Confident75 Ų7555.5 Ų55.540%0.40130%0.3SS..  trans-131.169.4-179.3-163.3-21000111.5I303 W309 S310 S311I303-N307 PolarHBondContact O-N 3.47Å; N307-W309 PolarHBondContact O-N 3.04Å; N307-S310 PolarHBondContact ND2-OG 2.85Å; N307-S310 PolarHBondContact O-N 2.85Å; N307-S310 WeakPolarHBondContact OD1-CB 3.42Å; N307-S310 PolarHBondContact OD1-N 3.3Å; N307-S310 PolarHBondContact OD1-OG 3.23Å; N307-S311 PolarHBondContact O-N 3.42Å
308P83.8Confident85.8Confident40 Ų4058.4 Ų58.426%0.2632%0.318SS..Hα-helixtrans-61.3-34-17524.6-34.2000112.1Y91 S310 S311 I312Y91-P308 HydrophobicContact CE2-CB 4.28Å; P308-S310 VanDerWaalsContact C-N 3.34Å; P308-S310 PolarHBondContact O-N 3.39Å; P308-S311 PolarHBondContact O-N 3.39Å; P308-I312 WeakPolarHBondContact O-CB 3.27Å; P308-I312 VanDerWaalsContact O-CG1 3.23Å; P308-I312 WeakPolarHBondContact O-CG1 3.27Å; P308-I312 PolarHBondContact O-N 2.92Å
309W87.9Confident85.7Confident203 Ų20360.6 Ų60.677%0.76933%0.327SS*.Hα-helixtrans-62.5-39.6178.7-64115.4000112.8N307 G313N307-W309 PolarHBondContact O-N 3.04Å; W309-G313 PolarHBondContact O-N 3.32Å
310S88Confident85.7Confident62 Ų6266 Ų6643%0.43435%0.354SS..Hα-helixtrans-67.2-42.7176.9-62.80000111.4N307 P308 G313 I314N307-S310 PolarHBondContact ND2-OG 2.85Å; N307-S310 PolarHBondContact O-N 2.85Å; N307-S310 WeakPolarHBondContact OD1-CB 3.42Å; N307-S310 PolarHBondContact OD1-N 3.3Å; N307-S310 PolarHBondContact OD1-OG 3.23Å; P308-S310 VanDerWaalsContact C-N 3.34Å; P308-S310 PolarHBondContact O-N 3.39Å; S310-G313 PolarHBondContact O-N 2.87Å; S310-I314 WeakPolarHBondContact O-CG1 3.18Å; S310-I314 PolarHBondContact O-N 2.98Å
311S86.9Confident86Confident22 Ų2267.1 Ų67.115%0.15437%0.368CS..Hα-helixtrans-64.9-42.2176.2-60.60000112.6N307 P308 G313 I314 L315N307-S311 PolarHBondContact O-N 3.42Å; P308-S311 PolarHBondContact O-N 3.39Å; S311-G313 VanDerWaalsContact C-N 3.34Å; S311-I314 PolarHBondContact O-N 3.34Å; S311-L315 WeakPolarHBondContact O-CG 3.26Å; S311-L315 PolarHBondContact O-N 3.5Å
312I89.2Confident86.3Confident53 Ų5367.6 Ų67.627%0.27238%0.378SS..Hα-helixtrans-61.1-44174-70.9166.2000110.4I87 Y91 P308 I314 L315 C316I87-I312 HydrophobicContact CG2-CG2 4.1Å; Y91-I312 HydrophobicContact CD2-CG1 4.41Å; P308-I312 WeakPolarHBondContact O-CB 3.27Å; P308-I312 VanDerWaalsContact O-CG1 3.23Å; P308-I312 WeakPolarHBondContact O-CG1 3.27Å; P308-I312 PolarHBondContact O-N 2.92Å; I312-I314 VanDerWaalsContact C-N 3.34Å; I312-I314 PolarHBondContact O-N 2.87Å; I312-L315 WeakPolarHBondContact O-CB 3.47Å; I312-L315 PolarHBondContact O-N 3.25Å; I312-L315 VanDerWaalsContact O-N 3.17Å; I312-C316 PolarHBondContact O-N 3.46Å; I312-C316 PolarHBondContact O-SG 3.03Å
313G90.6Very high86.9Confident32 Ų3272.9 Ų72.933%0.3340%0.4SS..Hα-helixtrans-57.8-44.5176.400000112.7W309 S310 S311 C316 V317W309-G313 PolarHBondContact O-N 3.32Å; S310-G313 PolarHBondContact O-N 2.87Å; S311-G313 VanDerWaalsContact C-N 3.34Å; G313-C316 WeakPolarHBondContact O-CB 3.33Å; G313-C316 PolarHBondContact O-N 2.89Å; G313-V317 WeakPolarHBondContact O-CG2 3.33Å; G313-V317 PolarHBondContact O-N 2.88Å; G313-V317 VanDerWaalsContact O-N 3.1Å
314I90.1Very high87.7Confident112 Ų11276.2 Ų76.257%0.57441%0.411SS*.Hα-helixtrans-61.5-45.2175.3-66.9165.3000110.6S310 S311 I312 C316 V317 V318S310-I314 WeakPolarHBondContact O-CG1 3.18Å; S310-I314 PolarHBondContact O-N 2.98Å; S311-I314 PolarHBondContact O-N 3.34Å; I312-I314 VanDerWaalsContact C-N 3.34Å; I312-I314 PolarHBondContact O-N 2.87Å; I314-C316 PolarHBondContact O-N 3.49Å; I314-V317 PolarHBondContact O-N 3.2Å; I314-V318 HydrophobicContact CG2-CG2 4.46Å; I314-V318 WeakPolarHBondContact O-CG2 3.44Å; I314-V318 PolarHBondContact O-N 3.32Å
315L91.8Very high88.8Confident22 Ų2278.1 Ų78.112%0.11543%0.429CS..Hα-helixtrans-60-45.5177.1-71172.3000111.5I87 A90 I94 S311 I312 V317 V318 F319I87-L315 HydrophobicContact CG2-CB 3.95Å; I87-L315 HydrophobicContact CG2-CD1 4.08Å; A90-L315 HydrophobicContact CB-CD1 4.28Å; A90-L315 HydrophobicContact CB-CD2 4.31Å; I94-L315 HydrophobicContact CD1-CD1 4.37Å; I94-L315 HydrophobicContact CD1-CD2 3.91Å; S311-L315 WeakPolarHBondContact O-CG 3.26Å; S311-L315 PolarHBondContact O-N 3.5Å; I312-L315 WeakPolarHBondContact O-CB 3.47Å; I312-L315 PolarHBondContact O-N 3.25Å; I312-L315 VanDerWaalsContact O-N 3.17Å; L315-V317 VanDerWaalsContact C-N 3.29Å; L315-V317 PolarHBondContact O-N 2.93Å; L315-V318 PolarHBondContact O-N 3.47Å; L315-V318 VanDerWaalsContact O-N 3.17Å; L315-F319 VanDerWaalsContact O-CD2 3.28Å; L315-F319 WeakPolarHBondContact O-CD2 3.31Å; L315-F319 PolarHBondContact O-N 3.46Å
316C91.7Very high90Very high49 Ų4978.3 Ų78.333%0.33144%0.435SS..Hα-helixtrans-53.6-46.6175-68.90000112I87 I312 G313 I314 F319 M320I87-C316 VanDerWaalsContact CD1-SG 3.55Å; I312-C316 PolarHBondContact O-N 3.46Å; I312-C316 PolarHBondContact O-SG 3.03Å; G313-C316 WeakPolarHBondContact O-CB 3.33Å; G313-C316 PolarHBondContact O-N 2.89Å; I314-C316 PolarHBondContact O-N 3.49Å; C316-F319 PolarHBondContact O-N 3.31Å; C316-M320 WeakPolarHBondContact O-CB 3.34Å; C316-M320 WeakPolarHBondContact O-CG 3.48Å; C316-M320 PolarHBondContact O-N 3Å
317V93.4Very high90.8Very high101 Ų10181 Ų8161%0.61245%0.445SS*.Hα-helixtrans-63.2-43.8179.3172.40000111G313 I314 L315 M320 A321G313-V317 WeakPolarHBondContact O-CG2 3.33Å; G313-V317 PolarHBondContact O-N 2.88Å; G313-V317 VanDerWaalsContact O-N 3.1Å; I314-V317 PolarHBondContact O-N 3.2Å; L315-V317 VanDerWaalsContact C-N 3.29Å; L315-V317 PolarHBondContact O-N 2.93Å; V317-M320 PolarHBondContact O-N 2.91Å; V317-A321 VanDerWaalsContact O-CB 3.29Å; V317-A321 WeakPolarHBondContact O-CB 3.01Å; V317-A321 PolarHBondContact O-N 3.43Å
318V94.3Very high91.3Very high73 Ų7384.3 Ų84.344%0.44246%0.456SS..Hα-helixtrans-62.8-47.4177.7172.70000111.2I314 L315 M320 A321 L322I314-V318 HydrophobicContact CG2-CG2 4.46Å; I314-V318 WeakPolarHBondContact O-CG2 3.44Å; I314-V318 PolarHBondContact O-N 3.32Å; L315-V318 PolarHBondContact O-N 3.47Å; L315-V318 VanDerWaalsContact O-N 3.17Å; V318-M320 PolarHBondContact O-N 3.47Å; V318-A321 PolarHBondContact O-N 3.24Å; V318-L322 HydrophobicContact CG1-CD1 4.11Å; V318-L322 WeakPolarHBondContact O-CG 3.28Å; V318-L322 PolarHBondContact O-N 3.23Å
319F91.6Very high91.8Very high60 Ų6084.5 Ų84.526%0.26346%0.461SS..Hα-helixtrans-60.3-46.6177.2-87.8-82.5000111.7A86 I87 A90 L315 C316 A321 L322 F323A86-F319 HydrophobicContact CB-CE1 4.38Å; A86-F319 HydrophobicContact CB-CZ 4.32Å; I87-F319 HydrophobicContact CG1-CD2 3.83Å; I87-F319 HydrophobicContact CG1-CE2 4Å; A90-F319 HydrophobicContact CB-CE2 4.34Å; L315-F319 VanDerWaalsContact O-CD2 3.28Å; L315-F319 WeakPolarHBondContact O-CD2 3.31Å; L315-F319 PolarHBondContact O-N 3.46Å; C316-F319 PolarHBondContact O-N 3.31Å; F319-A321 VanDerWaalsContact C-N 3.35Å; F319-A321 PolarHBondContact O-N 2.88Å; F319-L322 PolarHBondContact O-N 2.84Å; F319-F323 HydrophobicContact CD1-CE2 4.44Å; F319-F323 WeakPolarHBondContact O-CD2 3.42Å; F319-F323 PolarHBondContact O-N 3.37Å
320M91.8Very high92Very high141 Ų14181.2 Ų81.270%0.69545%0.452SS*.Hα-helixtrans-61.7-41.6176.9-76.2-67-15800112.4C316 V317 V318 F323 K324C316-M320 WeakPolarHBondContact O-CB 3.34Å; C316-M320 WeakPolarHBondContact O-CG 3.48Å; C316-M320 PolarHBondContact O-N 3Å; V317-M320 PolarHBondContact O-N 2.91Å; V318-M320 PolarHBondContact O-N 3.47Å; M320-F323 PolarHBondContact O-N 3.21Å; M320-K324 WeakPolarHBondContact O-CB 3.37Å; M320-K324 PolarHBondContact O-N 3.42Å
321A94.6Very high92.2Very high56 Ų5683.6 Ų83.646%0.46346%0.459SS..Hα-helixtrans-62.8-42.3176.500000111.7V317 V318 F319 K324 A325V317-A321 VanDerWaalsContact O-CB 3.29Å; V317-A321 WeakPolarHBondContact O-CB 3.01Å; V317-A321 PolarHBondContact O-N 3.43Å; V318-A321 PolarHBondContact O-N 3.24Å; F319-A321 VanDerWaalsContact C-N 3.35Å; F319-A321 PolarHBondContact O-N 2.88Å; A321-K324 PolarHBondContact O-N 2.87Å; A321-A325 VanDerWaalsContact O-CB 3.3Å; A321-A325 WeakPolarHBondContact O-CB 3.45Å; A321-A325 PolarHBondContact O-N 3.24Å
322L93.2Very high92.5Very high112 Ų11284.8 Ų84.859%0.58647%0.466SS*.Hα-helixtrans-62.1-45.4175.7-72.7171.5000111.9V318 F319 K324 A325 A326V318-L322 HydrophobicContact CG1-CD1 4.11Å; V318-L322 WeakPolarHBondContact O-CG 3.28Å; V318-L322 PolarHBondContact O-N 3.23Å; F319-L322 PolarHBondContact O-N 2.84Å; L322-K324 PolarHBondContact O-N 2.71Å; L322-A325 PolarHBondContact O-N 2.88Å; L322-A326 WeakPolarHBondContact O-CB 3.49Å; L322-A326 PolarHBondContact O-N 3.36Å
323F91.4Very high92.7Very high126 Ų12687 Ų8755%0.55348%0.477SS*.Hα-helixtrans-62.7-42.5175.9-80-64.6000112.3F319 M320 A326 N327F319-F323 HydrophobicContact CD1-CE2 4.44Å; F319-F323 WeakPolarHBondContact O-CD2 3.42Å; F319-F323 PolarHBondContact O-N 3.37Å; M320-F323 PolarHBondContact O-N 3.21Å; F323-A326 PolarHBondContact O-N 3.2Å; F323-N327 PolarHBondContact O-N 2.98Å; F323-N327 PolarHBondContact O-ND2 3.5Å
324K93.9Very high92.8Very high164 Ų16492.8 Ų92.871%0.71349%0.493SS*.Hα-helixtrans-64.4-43.6177.4-170.2174.8-178.7177.50111.5M320 A321 L322 N327 F328M320-K324 WeakPolarHBondContact O-CB 3.37Å; M320-K324 PolarHBondContact O-N 3.42Å; A321-K324 PolarHBondContact O-N 2.87Å; L322-K324 PolarHBondContact O-N 2.71Å; K324-N327 PolarHBondContact O-N 2.92Å; K324-F328 PolarHBondContact O-N 3.49Å
325A94.7Very high92.9Very high58 Ų5895 Ų9548%0.47949%0.494SS..Hα-helixtrans-62.7-41.6176.200000111.9A321 L322 N327 F328 A329A321-A325 VanDerWaalsContact O-CB 3.3Å; A321-A325 WeakPolarHBondContact O-CB 3.45Å; A321-A325 PolarHBondContact O-N 3.24Å; L322-A325 PolarHBondContact O-N 2.88Å; A325-N327 PolarHBondContact O-N 2.94Å; A325-F328 PolarHBondContact O-N 3.04Å; A325-A329 WeakPolarHBondContact O-CB 3.4Å; A325-A329 PolarHBondContact O-N 3.35Å
326A93.4Very high93Very high49 Ų4998.4 Ų98.441%0.40551%0.512SS..Hα-helixtrans-62.7-40.8175.900000112.3L322 F323 A329 K330L322-A326 WeakPolarHBondContact O-CB 3.49Å; L322-A326 PolarHBondContact O-N 3.36Å; F323-A326 PolarHBondContact O-N 3.2Å; A326-A329 PolarHBondContact O-N 2.89Å; A326-K330 WeakPolarHBondContact O-CG 3.39Å; A326-K330 PolarHBondContact O-N 3.01Å
327N93Very high93Very high92 Ų92100.1 Ų100.149%0.49252%0.517SS..Hα-helixtrans-66.9-41.4175.3-74.4-26.4000112.1F323 K324 A325 K330 L331F323-N327 PolarHBondContact O-N 2.98Å; F323-N327 PolarHBondContact O-ND2 3.5Å; K324-N327 PolarHBondContact O-N 2.92Å; A325-N327 PolarHBondContact O-N 2.94Å; N327-K330 WeakPolarHBondContact O-CB 3.42Å; N327-K330 PolarHBondContact O-N 3.19Å; N327-L331 PolarHBondContact O-N 3.44Å; N327-L331 VanDerWaalsContact O-N 3.1Å
328F92.1Very high93Very high143 Ų143100.9 Ų100.963%0.62751%0.512SS*.Hα-helixtrans-60.7-45.1173.5-175.5-101.7000111.4K324 A325 K330 L331 T332K324-F328 PolarHBondContact O-N 3.49Å; A325-F328 PolarHBondContact O-N 3.04Å; F328-K330 VanDerWaalsContact C-N 3.32Å; F328-K330 PolarHBondContact O-N 3.47Å; F328-L331 WeakPolarHBondContact O-CB 3.44Å; F328-L331 PolarHBondContact O-N 3.32Å; F328-L331 VanDerWaalsContact O-N 3.09Å; F328-T332 PolarHBondContact O-N 2.88Å; F328-T332 PolarHBondContact O-OG1 3.48Å
329A93.9Very high92.9Very high45 Ų45100.5 Ų100.537%0.37251%0.506SS..Hα-helixtrans-58.9-41.4176.100000112.3A325 A326 L331 T332 I333A325-A329 WeakPolarHBondContact O-CB 3.4Å; A325-A329 PolarHBondContact O-N 3.35Å; A326-A329 PolarHBondContact O-N 2.89Å; A329-L331 VanDerWaalsContact C-N 3.34Å; A329-L331 PolarHBondContact O-N 3.36Å; A329-T332 PolarHBondContact O-N 3.26Å; A329-I333 VanDerWaalsContact O-CG1 3.26Å; A329-I333 WeakPolarHBondContact O-CG1 3.29Å; A329-I333 PolarHBondContact O-N 3.42Å
330K93.3Very high92.9Very high133 Ų133106.3 Ų106.358%0.57853%0.526SS*.Hα-helixtrans-60-42.9173.9-74.4177.2-179.1176.70112.2A326 N327 F328 I333 K334A326-K330 WeakPolarHBondContact O-CG 3.39Å; A326-K330 PolarHBondContact O-N 3.01Å; N327-K330 WeakPolarHBondContact O-CB 3.42Å; N327-K330 PolarHBondContact O-N 3.19Å; F328-K330 VanDerWaalsContact C-N 3.32Å; F328-K330 PolarHBondContact O-N 3.47Å; K330-I333 PolarHBondContact O-N 2.95Å; K330-K334 WeakPolarHBondContact O-CG 3.4Å; K330-K334 PolarHBondContact O-N 2.83Å
331L91.9Very high93Very high112 Ų112106.1 Ų106.159%0.58652%0.522SS*.Hα-helixtrans-65.7-43.6176.9-69.2174000111.5N327 F328 A329 I333 K334 W335N327-L331 PolarHBondContact O-N 3.44Å; N327-L331 VanDerWaalsContact O-N 3.1Å; F328-L331 WeakPolarHBondContact O-CB 3.44Å; F328-L331 PolarHBondContact O-N 3.32Å; F328-L331 VanDerWaalsContact O-N 3.09Å; A329-L331 VanDerWaalsContact C-N 3.34Å; A329-L331 PolarHBondContact O-N 3.36Å; L331-I333 PolarHBondContact O-N 3.46Å; L331-K334 PolarHBondContact O-N 2.95Å; L331-W335 WeakPolarHBondContact O-CB 3.47Å; L331-W335 PolarHBondContact O-N 3.4Å
332T92.3Very high92.7Very high48 Ų48111 Ų11129%0.29453%0.528SS..Hα-helixtrans-60.6-43.8176.3-56.50000111.5F328 A329 W335 I336F328-T332 PolarHBondContact O-N 2.88Å; F328-T332 PolarHBondContact O-OG1 3.48Å; A329-T332 PolarHBondContact O-N 3.26Å; T332-W335 PolarHBondContact O-N 3.46Å; T332-I336 HydrophobicContact CG2-CD1 3.9Å; T332-I336 HydrophobicContact CG2-CG1 4.45Å; T332-I336 VanDerWaalsContact O-CG1 3.27Å; T332-I336 WeakPolarHBondContact O-CG1 3.4Å; T332-I336 PolarHBondContact O-N 2.94Å
333I93.6Very high92.4Very high99 Ų99111.7 Ų111.751%0.50853%0.528SS..Hα-helixtrans-61.4-47175.5-69.5164.8000110.8A329 K330 L331 W335 I336 I337A329-I333 VanDerWaalsContact O-CG1 3.26Å; A329-I333 WeakPolarHBondContact O-CG1 3.29Å; A329-I333 PolarHBondContact O-N 3.42Å; K330-I333 PolarHBondContact O-N 2.95Å; L331-I333 PolarHBondContact O-N 3.46Å; I333-W335 VanDerWaalsContact C-N 3.27Å; I333-W335 PolarHBondContact O-N 2.95Å; I333-I336 PolarHBondContact O-N 2.85Å; I333-I337 HydrophobicContact CG2-CD1 3.8Å; I333-I337 HydrophobicContact CG2-CG1 4.47Å; I333-I337 VanDerWaalsContact O-CG1 3.29Å; I333-I337 WeakPolarHBondContact O-CG1 3.36Å; I333-I337 PolarHBondContact O-N 3.08Å
334K93.4Very high92.2Very high153 Ų153110.9 Ų110.967%0.66553%0.529SS*.Hα-helixtrans-58.3-41.8175.9-77.1-175.4177.2-172.40111.5K330 L331 I337 K338K330-K334 WeakPolarHBondContact O-CG 3.4Å; K330-K334 PolarHBondContact O-N 2.83Å; L331-K334 PolarHBondContact O-N 2.95Å; K334-I337 PolarHBondContact O-N 3.4Å; K334-K338 WeakPolarHBondContact O-CB 3.29Å; K334-K338 PolarHBondContact O-N 3.35Å
335W91.9Very high91.8Very high159 Ų159110.1 Ų110.160%0.60253%0.526SS*.Hα-helixtrans-66.8-44.3178.9-171.677.9000112.4L331 T332 I333 I337 K338 M339L331-W335 WeakPolarHBondContact O-CB 3.47Å; L331-W335 PolarHBondContact O-N 3.4Å; T332-W335 PolarHBondContact O-N 3.46Å; I333-W335 VanDerWaalsContact C-N 3.27Å; I333-W335 PolarHBondContact O-N 2.95Å; W335-I337 VanDerWaalsContact C-N 3.35Å; W335-I337 PolarHBondContact O-N 3.01Å; W335-K338 WeakPolarHBondContact O-CB 3.21Å; W335-K338 PolarHBondContact O-N 3.48Å; W335-M339 HydrophobicContact CD2-CE 3.93Å; W335-M339 HydrophobicContact CE3-CE 3.5Å; W335-M339 VanDerWaalsContact CE3-CE 3.5Å; W335-M339 HydrophobicContact CH2-CE 3.02Å; W335-M339 HydrophobicContact CZ2-CE 3.45Å; W335-M339 VanDerWaalsContact CZ2-CE 3.45Å; W335-M339 HydrophobicContact CZ3-CE 3.04Å; W335-M339 WeakPolarHBondContact O-CB 3.47Å; W335-M339 PolarHBondContact O-N 3.39Å
336I93.5Very high91.4Very high93 Ų93112.7 Ų112.748%0.47753%0.527SS..Hα-helixtrans-59.3-45.2174.6-70.4166.8000110.8T332 I333 K338 M339 R340T332-I336 HydrophobicContact CG2-CD1 3.9Å; T332-I336 HydrophobicContact CG2-CG1 4.45Å; T332-I336 VanDerWaalsContact O-CG1 3.27Å; T332-I336 WeakPolarHBondContact O-CG1 3.4Å; T332-I336 PolarHBondContact O-N 2.94Å; I333-I336 PolarHBondContact O-N 2.85Å; I336-K338 VanDerWaalsContact C-N 3.35Å; I336-K338 PolarHBondContact O-N 3.32Å; I336-M339 PolarHBondContact O-N 3.21Å; I336-R340 WeakPolarHBondContact O-CB 3.31Å; I336-R340 PolarHBondContact O-N 3.06Å
337I92.3Very high90.9Very high86 Ų86116.7 Ų116.744%0.44154%0.535SS..Hα-helixtrans-61.4-45176.6-67.6166.5000110.5I333 K334 W335 M339 R340 K341I333-I337 HydrophobicContact CG2-CD1 3.8Å; I333-I337 HydrophobicContact CG2-CG1 4.47Å; I333-I337 VanDerWaalsContact O-CG1 3.29Å; I333-I337 WeakPolarHBondContact O-CG1 3.36Å; I333-I337 PolarHBondContact O-N 3.08Å; K334-I337 PolarHBondContact O-N 3.4Å; W335-I337 VanDerWaalsContact C-N 3.35Å; W335-I337 PolarHBondContact O-N 3.01Å; I337-M339 VanDerWaalsContact C-N 3.34Å; I337-M339 PolarHBondContact O-N 3.33Å; I337-R340 PolarHBondContact O-N 3.28Å; I337-K341 HydrophobicContact CG2-CD 4.39Å; I337-K341 WeakPolarHBondContact O-CG 3.09Å; I337-K341 PolarHBondContact O-N 2.91Å
338K93.4Very high90.1Very high116 Ų116114.5 Ų114.550%0.50453%0.531SS..Hα-helixtrans-61.4-43.3178-172.8174.5-177174.80111.3K334 W335 I336 K341 R342K334-K338 WeakPolarHBondContact O-CB 3.29Å; K334-K338 PolarHBondContact O-N 3.35Å; W335-K338 WeakPolarHBondContact O-CB 3.21Å; W335-K338 PolarHBondContact O-N 3.48Å; I336-K338 VanDerWaalsContact C-N 3.35Å; I336-K338 PolarHBondContact O-N 3.32Å; K338-K341 PolarHBondContact O-N 3.5Å; K338-R342 WeakPolarHBondContact O-CG 3.32Å; K338-R342 PolarHBondContact O-N 2.95Å
339M91.9Very high89.4Confident65 Ų65117 Ų11732%0.3254%0.536SS..Hα-helixtrans-66.7-43.7178.3-160.3-160.4-57.700111.6W335 I336 I337 K341 R342 H343W335-M339 HydrophobicContact CD2-CE 3.93Å; W335-M339 HydrophobicContact CE3-CE 3.5Å; W335-M339 VanDerWaalsContact CE3-CE 3.5Å; W335-M339 HydrophobicContact CH2-CE 3.02Å; W335-M339 HydrophobicContact CZ2-CE 3.45Å; W335-M339 VanDerWaalsContact CZ2-CE 3.45Å; W335-M339 HydrophobicContact CZ3-CE 3.04Å; W335-M339 WeakPolarHBondContact O-CB 3.47Å; W335-M339 PolarHBondContact O-N 3.39Å; I336-M339 PolarHBondContact O-N 3.21Å; I337-M339 VanDerWaalsContact C-N 3.34Å; I337-M339 PolarHBondContact O-N 3.33Å; M339-K341 VanDerWaalsContact C-N 3.33Å; M339-K341 PolarHBondContact O-N 3.26Å; M339-R342 WeakPolarHBondContact O-CB 3.28Å; M339-R342 PolarHBondContact O-N 3.49Å; M339-R342 VanDerWaalsContact O-N 3.08Å; M339-H343 PolarHBondContact O-CD2 3.03Å; M339-H343 PolarHBondContact O-N 2.78Å
340R91.8Very high88.5Confident182 Ų182119.5 Ų119.569%0.68754%0.54SS*.Hα-helixtrans-59.6-42.7175-171.3177.9-178.7-173.60.6111.8I336 I337 R342 H343 L344I336-R340 WeakPolarHBondContact O-CB 3.31Å; I336-R340 PolarHBondContact O-N 3.06Å; I337-R340 PolarHBondContact O-N 3.28Å; R340-R342 VanDerWaalsContact C-N 3.34Å; R340-R342 PolarHBondContact O-N 2.88Å; R340-H343 PolarHBondContact O-N 2.94Å; R340-L344 HydrophobicContact CG-CD1 4.37Å; R340-L344 WeakPolarHBondContact O-CG 3.43Å; R340-L344 PolarHBondContact O-N 2.89Å
341K92.3Very high87.5Confident138 Ų138118.6 Ų118.660%0.654%0.54SS*.Hα-helixtrans-61.6-39.8173.8-75.3-178179-174.90111.9I337 K338 M339 K345I337-K341 HydrophobicContact CG2-CD 4.39Å; I337-K341 WeakPolarHBondContact O-CG 3.09Å; I337-K341 PolarHBondContact O-N 2.91Å; K338-K341 PolarHBondContact O-N 3.5Å; M339-K341 VanDerWaalsContact C-N 3.33Å; M339-K341 PolarHBondContact O-N 3.26Å; K341-K345 WeakPolarHBondContact O-CG 3.41Å; K341-K345 PolarHBondContact O-N 3.23Å; K341-K345 VanDerWaalsContact O-N 3.1Å
342R89Confident86.2Confident158 Ų158119.3 Ų119.360%0.59655%0.545SS*.Hα-helixtrans-65.3-45.6175.6-74175.8176.3-176.8-5.6112.1K338 M339 R340 L344 K345 H346K338-R342 WeakPolarHBondContact O-CG 3.32Å; K338-R342 PolarHBondContact O-N 2.95Å; M339-R342 WeakPolarHBondContact O-CB 3.28Å; M339-R342 PolarHBondContact O-N 3.49Å; M339-R342 VanDerWaalsContact O-N 3.08Å; R340-R342 VanDerWaalsContact C-N 3.34Å; R340-R342 PolarHBondContact O-N 2.88Å; R342-L344 PolarHBondContact O-N 2.92Å; R342-K345 PolarHBondContact O-N 3.41Å; R342-H346 PolarHBondContact O-N 2.89Å
343H87.9Confident84.7Confident126 Ų126121.4 Ų121.458%0.58356%0.561SS**Hα-helixtrans-60.7-42.8176.1-84-71.9000112.7M339 R340 K345 H346 K347M339-H343 PolarHBondContact O-CD2 3.03Å; M339-H343 PolarHBondContact O-N 2.78Å; R340-H343 PolarHBondContact O-N 2.94Å; H343-K345 PolarHBondContact O-N 2.89Å; H343-H346 PolarHBondContact O-N 2.86Å; H343-K347 WeakPolarHBondContact O-CB 3.25Å; H343-K347 PolarHBondContact O-N 3.34Å
344L87.3Confident82.9Confident109 Ų109123.6 Ų123.657%0.57157%0.573SS**Hα-helixtrans-63-41.4176.2-74167.7000112.1R340 R342 K347 A348R340-L344 HydrophobicContact CG-CD1 4.37Å; R340-L344 WeakPolarHBondContact O-CG 3.43Å; R340-L344 PolarHBondContact O-N 2.89Å; R342-L344 PolarHBondContact O-N 2.92Å; L344-K347 PolarHBondContact O-N 3.5Å; L344-A348 WeakPolarHBondContact O-CB 3.45Å; L344-A348 PolarHBondContact O-N 3.23Å
345K85.6Confident80.8Confident149 Ų149124 Ų12465%0.64860%0.595SS**Hα-helixtrans-63.9-39.6174.4-76-174.6177.6-170.10112.4K341 R342 H343 R349K341-K345 WeakPolarHBondContact O-CG 3.41Å; K341-K345 PolarHBondContact O-N 3.23Å; K341-K345 VanDerWaalsContact O-N 3.1Å; R342-K345 PolarHBondContact O-N 3.41Å; H343-K345 PolarHBondContact O-N 2.89Å; K345-R349 WeakPolarHBondContact O-CG 3.43Å; K345-R349 PolarHBondContact O-N 3.38Å; K345-R349 VanDerWaalsContact O-N 3.12Å
346H84.7Confident80.2Confident111 Ų111122.3 Ų122.351%0.51460%0.595SS.*Hα-helixtrans-64.2-48.7176.8-164.7-87.9000111.5R342 H343 A348 R349 E350R342-H346 PolarHBondContact O-N 2.89Å; H343-H346 PolarHBondContact O-N 2.86Å; H346-A348 VanDerWaalsContact C-N 3.3Å; H346-A348 PolarHBondContact O-N 3.39Å; H346-R349 WeakPolarHBondContact O-CB 3.4Å; H346-R349 PolarHBondContact O-N 3.16Å; H346-E350 IonicContact CE1-OE1 3.38Å; H346-E350 PolarHBondContact CE1-OE1 3.5Å; H346-E350 IonicContact ND1-OE1 3.8Å; H346-E350 PolarHBondContact ND1-OE1 3.1Å; H346-E350 IonicContact ND1-OE2 2.71Å; H346-E350 PolarHBondContact O-N 3.31Å
347K82.8Confident79.5Confident133 Ų133123.8 Ų123.858%0.57860%0.601SS**Hα-helixtrans-60.4-38.1178.1-170174.7-177.8176.80112.7H343 L344 L351H343-K347 WeakPolarHBondContact O-CB 3.25Å; H343-K347 PolarHBondContact O-N 3.34Å; L344-K347 PolarHBondContact O-N 3.5Å; K347-L351 HydrophobicContact CG-CD1 4.29Å; K347-L351 WeakPolarHBondContact O-CD1 3.47Å; K347-L351 WeakPolarHBondContact O-CG 3.43Å; K347-L351 PolarHBondContact O-N 3.35Å
348A77.9Confident78.8Confident47 Ų47125.9 Ų125.939%0.38861%0.61SS.*Hα-helixtrans-67.8-34.6175.200000112.7L344 H346 N352L344-A348 WeakPolarHBondContact O-CB 3.45Å; L344-A348 PolarHBondContact O-N 3.23Å; H346-A348 VanDerWaalsContact C-N 3.3Å; H346-A348 PolarHBondContact O-N 3.39Å; A348-N352 VanDerWaalsContact O-CG 3.29Å; A348-N352 PolarHBondContact O-N 3.31Å; A348-N352 PolarHBondContact O-ND2 3.12Å
349R76.1Confident77.9Confident195 Ų195126.5 Ų126.574%0.73662%0.616SS**Hα-helixtrans-68.2-42175.2-75.6177177.2-175.9-3.4112.1K345 H346 L351 N352 S353K345-R349 WeakPolarHBondContact O-CG 3.43Å; K345-R349 PolarHBondContact O-N 3.38Å; K345-R349 VanDerWaalsContact O-N 3.12Å; H346-R349 WeakPolarHBondContact O-CB 3.4Å; H346-R349 PolarHBondContact O-N 3.16Å; R349-L351 PolarHBondContact O-N 3.22Å; R349-N352 PolarHBondContact O-N 3.03Å; R349-S353 PolarHBondContact O-N 3.48Å; R349-S353 PolarHBondContact O-OG 3.18Å
350E76.6Confident77.1Confident98 Ų98130.4 Ų130.446%0.45864%0.635SS.*Hα-helixtrans-64.1-37.9177.1-70.4174.5153.500112.7H346 S353 I354H346-E350 IonicContact CE1-OE1 3.38Å; H346-E350 PolarHBondContact CE1-OE1 3.5Å; H346-E350 IonicContact ND1-OE1 3.8Å; H346-E350 PolarHBondContact ND1-OE1 3.1Å; H346-E350 IonicContact ND1-OE2 2.71Å; H346-E350 PolarHBondContact O-N 3.31Å; E350-S353 PolarHBondContact O-N 3.03Å; E350-S353 PolarHBondContact O-OG 3.49Å; E350-I354 WeakPolarHBondContact O-CD1 3.46Å; E350-I354 WeakPolarHBondContact O-CG1 3.43Å
351L72.3Confident76.1Confident113 Ų113126.9 Ų126.959%0.59263%0.631SS**Hα-helixtrans-69.2-34.5176.8-76.5161.9000112.7K347 R349 S353K347-L351 HydrophobicContact CG-CD1 4.29Å; K347-L351 WeakPolarHBondContact O-CD1 3.47Å; K347-L351 WeakPolarHBondContact O-CG 3.43Å; K347-L351 PolarHBondContact O-N 3.35Å; R349-L351 PolarHBondContact O-N 3.22Å; L351-S353 VanDerWaalsContact C-N 3.35Å
352N64.6Low74.9Confident128 Ų128126.1 Ų126.168%0.68463%0.633SS**Hα-helixtrans-77.8-17.1178.8-71.7-14.8000113.6A348 R349 I354A348-N352 VanDerWaalsContact O-CG 3.29Å; A348-N352 PolarHBondContact O-N 3.31Å; A348-N352 PolarHBondContact O-ND2 3.12Å; R349-N352 PolarHBondContact O-N 3.03Å; N352-I354 VanDerWaalsContact C-N 3.35Å
353S59.3Low73.8Confident91 Ų91123.7 Ų123.764%0.63664%0.636SS**THydrogen-bonded Turntrans-86.6-1.2176.552.50000114.5R349 E350 L351R349-S353 PolarHBondContact O-N 3.48Å; R349-S353 PolarHBondContact O-OG 3.18Å; E350-S353 PolarHBondContact O-N 3.03Å; E350-S353 PolarHBondContact O-OG 3.49Å; L351-S353 VanDerWaalsContact C-N 3.35Å
354I56.8Low72.7Confident146 Ų146123.5 Ų123.575%0.74964%0.641SS**  trans-110.9-5.9-177.1-61.9169.5000111.8E350 N352E350-I354 WeakPolarHBondContact O-CD1 3.46Å; E350-I354 WeakPolarHBondContact O-CG1 3.43Å; N352-I354 VanDerWaalsContact C-N 3.35Å
355S48.1Very low71.3Confident162 Ų162124.8 Ų124.8100%1.13365%0.647SS**  trans-98.10169.1-175.40000110.7

Retrieved 355 of 355 residues in 94.6 ms (Link to these results)