A0A087YC34_POEFO Loading...

Iron-sulfur cluster assembly 2 homolog, mitochondrial

Involved in the maturation of mitochondrial 4Fe-4S proteins functioning late in the iron-sulfur cluster assembly pathway. May be involved in the binding of an intermediate of Fe/S cluster assembly.

AlphaFold DB , UniProt , Accession A0A087YC34, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 176 aa.

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Site Residue pLDDT pLDDT confidence pLDDT10 pLDDT10 confidence SASA SASA [Ų] SASA10 SASA10 [Ų] RSA RSA unformatted RSA10 RSA10 unformatted Surface Surface10 (not used) Disorder (not used) Disorder Sec. str. Secondary structure Isomer Phi (φ) Psi (ψ) Omega (ω) Chi 1 (χ1) Chi 2 (χ2) Chi 3 (χ3) Chi 4 (χ4) Chi 5 (χ5) Tau (τ) Contacts (colored by PAE) Contact details
1M42.1Very low48.4Very low242 Ų242148.5 Ų148.5100%1.19286%0.858SS**  0143.50-69.8166.982.300107.7
2S44.4Very low48.8Very low121 Ų121145.8 Ų145.885%0.84685%0.854SS**  trans78.9129.1-177.4-139.50000116.2
3V51.5Low49.4Very low130 Ų130149.9 Ų149.979%0.78886%0.855SS**  cis-179138.3-35.9146.70000103.4
4F50.3Low50Low197 Ų197146.9 Ų146.986%0.86485%0.847SS**  trans-48.5146.8174-89.6-110.7000114.3
5K54.8Low50.7Low208 Ų208152.3 Ų152.390%0.90485%0.848SS**  trans-162.5111.2144.1-100.4162.7-175.9-1740106
6G41.8Very low50.9Low68 Ų68153 Ų15370%0.70185%0.848SS**  98.191.46200000107.1
7A46.3Very low51.3Low100 Ų100151.8 Ų151.883%0.82684%0.838SS**  79.4118.889.200000114.5
8M49.2Very low51Low185 Ų185149.8 Ų149.891%0.91184%0.836SS**  trans36.7162.2142-83-154.3-153.600122.3
9I50.9Low51.1Low154 Ų154149.9 Ų149.979%0.7983%0.834SS**  trans113.2120.7163.5-61.6163.4000109.7
10T51.3Low51.1Low129 Ų129147 Ų14779%0.79183%0.83SS**  cis-166.5151.811.512.90000110.3
11A49.7Very low50.9Low99 Ų99151.4 Ų151.482%0.81883%0.834SS**  trans-60.2137.2164.500000112.2
12S53.6Low51.2Low116 Ų116144.4 Ų144.481%0.81181%0.814SS**  trans-115.7111.7161.8-167.10000109.1S14S12-S14 PolarHBondContact O-N 2.73Å
13K56.4Low51.5Low200 Ų200143.6 Ų143.687%0.8781%0.808SS**  trans-91.896.5-173.7-162.7173.2-173.7177.50107.9R15K13-R15 PolarHBondContact O-N 3.17Å
14S57.4Low51.6Low107 Ų107143.8 Ų143.875%0.74881%0.81SS**  trans-73.4118.4178.3-56.50000110.2S12 I16S12-S14 PolarHBondContact O-N 2.73Å; S14-I16 PolarHBondContact O-N 3.08Å
15R61Low51.8Low229 Ų229142.9 Ų142.986%0.86481%0.813SS**  trans-69.1118.8-178.7-66.3177.2179.3-178.2-1.2110K13 I17K13-R15 PolarHBondContact O-N 3.17Å; R15-I17 HydrophobicContact CB-CG1 4.43Å; R15-I17 PolarHBondContact O-N 3.05Å
16I53.9Low51.9Low163 Ų163140 Ų14084%0.83681%0.807SS**  trans-79.7111.6166.9-61.2172.5000107S14S14-I16 PolarHBondContact O-N 3.08Å
17I57.5Low52.4Low133 Ų133143.5 Ų143.568%0.68281%0.809SS**  trans-117.993.4168.9-51.4172.8000105.6R15 L19R15-I17 HydrophobicContact CB-CG1 4.43Å; R15-I17 PolarHBondContact O-N 3.05Å; I17-L19 HydrophobicContact CG2-CD1 4.01Å
18S45Very low52.7Low116 Ų116146.6 Ų146.681%0.81181%0.812SS**  trans-10994.8167.8-172.40000107.8
19L53.1Low52.8Low152 Ų152144.7 Ų144.780%0.79681%0.805SS**  trans-81.8139.9171.2-101.5142.1000109.6I17I17-L19 HydrophobicContact CG2-CD1 4.01Å
20A50.8Low52.7Low90 Ų90140.8 Ų140.874%0.74480%0.803SS**  trans-44.4147.1-175.900000115.6
21R47Very low52.3Low241 Ų241139.9 Ų139.991%0.90980%0.797SS**  trans-126.696.8147.5-87-174.3155.991.9-2109.1
22A48.4Very low52Low94 Ų94145.9 Ų145.978%0.77780%0.798SS**  trans-65.4134.4153.700000108.3
23S50.9Low51.2Low105 Ų105149.6 Ų149.673%0.73480%0.803SS**  trans-153.490.9163.2-74.10000108.8
24T54.3Low50.8Low134 Ų134148 Ų14882%0.82280%0.798SS**  trans15.1106.3139.144.10000117.3L26T24-L26 PolarHBondContact O-N 3.45Å
25L53.6Low50.3Low177 Ų177150.3 Ų150.393%0.92780%0.802SS**  trans-71.5107.3155.8-77.9170.4000109.7
26L58.4Low49.2Very low147 Ų147149 Ų14977%0.7780%0.798SS**  trans-146.1118.3157.1-83.7173.6000107.8T24T24-L26 PolarHBondContact O-N 3.45Å
27N51.4Low48.5Very low142 Ų142152.8 Ų152.876%0.75980%0.802SS**  164.398126.5-78.6-19.1000109.6
28N51.7Low47.7Very low166 Ų166154.3 Ų154.389%0.88881%0.81SS**  trans-101.886.4164.1-158.8-1.3000107.3G30N28-G30 PolarHBondContact O-N 3.34Å
29L51.5Low47.8Very low145 Ų145154.5 Ų154.576%0.75981%0.809SS**  trans-90.186.7170.8-84.1162.2000107.7V31L29-V31 PolarHBondContact O-N 3.09Å
30G49.5Very low47.7Very low72 Ų72156.7 Ų156.774%0.74282%0.815SS**  trans-71101.4165.400000109.3N28N28-G30 PolarHBondContact O-N 3.34Å
31V42.3Very low47.4Very low109 Ų109157.5 Ų157.566%0.66182%0.815SS**  trans-143.8125.7167.5-153.20000110.4L29L29-V31 PolarHBondContact O-N 3.09Å
32R44.1Very low47.4Very low225 Ų225151.5 Ų151.585%0.84981%0.81SS**  trans80.8116.1155.7-38.2-171.497.11671.8118.3
33Q37.6Very low47.8Very low195 Ų195155.7 Ų155.791%0.91181%0.814SS**  -148.9100.6118.4-121.7168.615.700110
34E46.6Very low47.7Very low165 Ų165156.1 Ų156.177%0.77181%0.814SS**  trans-93.4115.6166.9-139.3172.1143.400107.1Y36E34-Y36 HydrophobicContact CG-CE2 4.31Å
35L47Very low47.3Very low157 Ų157155.9 Ų155.982%0.82281%0.807SS**  trans-72.9122.2179.3-85.3152.2000111
36Y39.1Very low46.9Very low202 Ų202157 Ų15779%0.79280%0.8SS**  trans-143.996.3158.5-79.1-76.1000112.8E34E34-Y36 HydrophobicContact CG-CE2 4.31Å
37R39.7Very low46.6Very low241 Ų241158.2 Ų158.291%0.90981%0.806SS**  trans25.1117.1131.8-133.4175.2-159.6150.92.8118.8
38L39.7Very low46.4Very low165 Ų165156.2 Ų156.286%0.86481%0.81SS**PPolyproline II helixtrans-87.6146.9160.4-72.1172.6000111
39P47.9Very low46.1Very low121 Ų121151.9 Ų151.979%0.78680%0.804SS**PPolyproline II helixtrans-83.5141.2-179.833-32.4000112.4S41P39-S41 PolarHBondContact O-N 2.8Å
40E50.1Low46.2Very low197 Ų197153.8 Ų153.892%0.92181%0.809SS**PPolyproline II helixtrans-68.1116.9170.6-74.6177.8118.700110.3
41S44.6Very low46.3Very low107 Ų107160.9 Ų160.975%0.74881%0.813SS**  trans-97.1106.5163.470.70000109.5P39P39-S41 PolarHBondContact O-N 2.8Å
42S48.1Very low46.7Very low115 Ų115161.4 Ų161.480%0.80482%0.821SS**  trans-58.8135.7167.137.20000112.3
43Q55.3Low46.7Very low182 Ų182159.5 Ų159.585%0.8582%0.819SS**  trans-132127.1164.7-69.8-170.5-9.400109.5
44P50.1Low47.4Very low114 Ų114155.3 Ų155.374%0.7481%0.811SS**  trans-102.9134.9168.134.4-25.7000113
45L45.2Very low47.5Very low129 Ų129155.4 Ų155.468%0.67582%0.817SS**  59.7118.8125.3-57.3-166.9000122.8
46Y46.2Very low47.8Very low200 Ų200152.6 Ų152.678%0.78482%0.816SS**  trans47.2128.1139.2-44.1-60.7000120.2
47I50.6Low48.4Very low173 Ų173147.3 Ų147.389%0.88781%0.809SS**  -155.4135.1126.6-100.4151.6000110
48A46.7Very low49Very low101 Ų101143.6 Ų143.684%0.83581%0.805SS**  trans-69.4152.7173.600000112.3
49G46.3Very low49.6Very low75 Ų75146.4 Ų146.477%0.77380%0.804SS**  trans177.682.2169.900000113.3
50Q53.4Low49.9Very low184 Ų184148.4 Ų148.486%0.8681%0.809SS**  trans-49.9144.2170.8-62.7167.63.300112.1
51R51.3Low50Low221 Ų221146.8 Ų146.883%0.83480%0.799SS**  trans-159.3113.4133.3-104.8162-162.41795.5110.1F53R51-F53 HydrophobicContact CB-CD2 4.49Å; R51-F53 HydrophobicContact CB-CE2 4.13Å
52C51.2Low50.1Low121 Ų121146.8 Ų146.882%0.81880%0.798SS**  trans-64.3127.4163.9-58.90000108.7
53F44.2Very low50.2Low184 Ų184145.2 Ų145.281%0.80780%0.8SS**  trans-120.4105.1155.8-78-77.8000108R51R51-F53 HydrophobicContact CB-CD2 4.49Å; R51-F53 HydrophobicContact CB-CE2 4.13Å
54S51.8Low49.5Very low107 Ų107142.2 Ų142.275%0.74879%0.786SS**  trans-53.5134.4161.8-330000109.2
55N48.3Very low49.7Very low168 Ų168142.6 Ų142.690%0.89879%0.789SS**  -155137.4126.9-111.215.4000111.6
56A54Low49.4Very low98 Ų98142 Ų14281%0.8180%0.795SS**  trans-69.6171.1-175.900000113.3
57S51.9Low50.1Low91 Ų91137.2 Ų137.264%0.63679%0.789SS**  trans104.794.2156.1-173.80000116.1
58I53.2Low50.3Low163 Ų163134 Ų13484%0.83678%0.782SS**  trans-151.192.5140.2-57.5-65.9000106.2
59R50.5Low51Low223 Ų223136.2 Ų136.284%0.84278%0.775SS**  39114.1100.2-77.1-172.7-177.2-1700.8115.3
60N54.1Low52.4Low164 Ų164136.2 Ų136.288%0.87776%0.757SS**  trans-16.3132.7161.1-63-10.6000116.3
61K53.2Low54.1Low163 Ų163133.2 Ų133.271%0.70974%0.741SS**  trans-12796.3151.6-119.3-166.7-176.9-1510109.4E64K61-E64 HydrophobicContact CD-CG 4.29Å; K61-E64 IonicContact NZ-OE2 2.73Å; K61-E64 PolarHBondContact NZ-OE2 2.82Å
62S47.2Very low56Low106 Ų106122.9 Ų122.974%0.74170%0.703SS**  trans-67.4129.1162.143.50000109.6
63G50.2Low58Low82 Ų82120.9 Ų120.985%0.84568%0.681SS**  trans34.588.4158.200000118.1
64E39.6Very low60.4Low119 Ų119112.7 Ų112.756%0.55665%0.646SS**  trans-124.9135.4167.4-65.9-117.2129.600108.2K61 S66K61-E64 HydrophobicContact CD-CG 4.29Å; K61-E64 IonicContact NZ-OE2 2.73Å; K61-E64 PolarHBondContact NZ-OE2 2.82Å; E64-S66 PolarHBondContact O-N 2.93Å
65P54.6Low62.5Low122 Ų122109.1 Ų109.179%0.79262%0.619SS**  trans-60.2125.1170.925.9-29.2000107.5
66S39.4Very low64.8Low116 Ų116110.1 Ų110.181%0.81162%0.616SS**  trans-43.9117.5-174.148.80000112.4E64E64-S66 PolarHBondContact O-N 2.93Å
67P60.4Low66.8Low100 Ų100108.7 Ų108.765%0.64960%0.6SS**  trans-103.3106.4-170.235-26.3000111
68S54.7Low68.9Low105 Ų105104.3 Ų104.373%0.73457%0.569SS**SBendtrans-176.5-16.7147.742.80000116.6
69E60.6Low70.9Confident148 Ų14897.6 Ų97.669%0.69254%0.536SS*.SBendtrans-101.5-31.8-165.9-58.4-165169.400115K71E69-K71 PolarHBondContact O-N 3.22Å
70D77.5Confident73Confident76 Ų7693.3 Ų93.341%0.40652%0.523SS..SBendtrans-96.533.5-175.8-64-16.9000113.9R119 F121D70-R119 IonicContact OD2-NH1 3.3Å; D70-R119 PolarHBondContact OD2-NH1 3.26Å; D70-R119 VanDerWaalsContact OD2-NH1 3.09Å; D70-F121 WeakPolarHBondContact O-CE1 3.27Å; D70-F121 WeakPolarHBondContact O-CZ 3.41Å
71K87.3Confident75Confident120 Ų12089.1 Ų89.152%0.52250%0.495SS..PPolyproline II helixtrans-102130.2-173.9-165.7167.2-175.8176.60112.3E69 G140E69-K71 PolarHBondContact O-N 3.22Å; K71-G140 WeakPolarHBondContact O-CA 3.3Å; K71-G140 PolarHBondContact O-N 2.91Å
72V91.9Very high77Confident5 Ų581.4 Ų81.43%0.0346%0.462CS..PPolyproline II helixtrans-102.1134.2165.7-177.80000108.9F121 V130 V138 V143V72-F121 HydrophobicContact CB-CD2 4.27Å; V72-F121 HydrophobicContact CB-CE2 4.35Å; V72-F121 HydrophobicContact CB-CG 4.41Å; V72-F121 HydrophobicContact CG2-CD2 4.3Å; V72-F121 HydrophobicContact CG2-CE2 3.92Å; V72-F121 HydrophobicContact CG2-CZ 4.13Å; V72-V130 HydrophobicContact CG2-CG2 4.45Å; V72-V138 HydrophobicContact CG2-CG2 4.06Å; V72-V143 HydrophobicContact CG1-CG2 3.65Å
73H93.9Very high79.2Confident78 Ų7880 Ų8036%0.36145%0.451SS..EExtended strand (participates in β ladder)trans-101.2141.6-179.9-63.9-76.2000110.9S141 T142 V143H73-S141 PolarHBondContact N-O 3.42Å; H73-T142 HydrophobicContact CB-CG2 4.2Å; H73-T142 CarbonylContact O-C 3.56Å; H73-T142 VanDerWaalsContact O-CA 3.29Å; H73-T142 WeakPolarHBondContact O-CA 3.42Å; H73-V143 PolarHBondContact O-N 3.4Å
74L94.7Very high81.3Confident12 Ų1281.2 Ų81.26%0.06344%0.435CS..EExtended strand (participates in β ladder)trans-108.8137.9170.1-67.4119.4000112.1C78 V79 L82 Q123 I128L74-C78 HydrophobicContact CD2-CB 4.34Å; L74-V79 HydrophobicContact CB-CG2 3.79Å; L74-V79 HydrophobicContact CD2-CG2 4.32Å; L74-L82 HydrophobicContact CD2-CD1 4Å; L74-Q123 HydrophobicContact CD1-CB 3.55Å; L74-Q123 HydrophobicContact CD1-CG 4.47Å; L74-Q123 VanDerWaalsContact N-OE1 3.11Å; L74-Q123 PolarHBondContact O-NE2 3.18Å; L74-Q123 VanDerWaalsContact O-NE2 3.08Å; L74-I128 HydrophobicContact CD1-CD1 4.25Å; L74-I128 HydrophobicContact CD1-CG1 4.42Å; L74-I128 HydrophobicContact CD2-CD1 3.2Å; L74-I128 HydrophobicContact CD2-CG1 3.89Å; L74-I128 HydrophobicContact CG-CD1 3.95Å
75T96Very high83.8Confident32 Ų3278.9 Ų78.920%0.19643%0.426CS..  trans-74.5159.1167.470.60000111.5S77 C78 V79 T142 V143 D144T75-S77 VanDerWaalsContact C-N 3.26Å; T75-S77 PolarHBondContact O-N 2.76Å; T75-C78 PolarHBondContact O-N 3.03Å; T75-C78 WeakPolarHBondContact OG1-CB 3.33Å; T75-C78 PolarHBondContact OG1-N 2.94Å; T75-V79 WeakPolarHBondContact O-CG2 3.25Å; T75-V79 PolarHBondContact O-N 3.5Å; T75-V79 VanDerWaalsContact O-N 3.07Å; T75-T142 HydrophobicContact CG2-CG2 3.64Å; T75-V143 PolarHBondContact N-O 3.29Å; T75-D144 VanDerWaalsContact CB-OD1 3.31Å; T75-D144 WeakPolarHBondContact CB-OD1 3.43Å; T75-D144 HydrophobicContact CG2-CB 3.7Å; T75-D144 WeakPolarHBondContact CG2-OD1 3.11Å; T75-D144 PolarHBondContact OG1-OD1 3.37Å
76K95.5Very high85.6Confident190 Ų19074.4 Ų74.483%0.82640%0.395SS*.Hα-helixtrans-59.9-37.8175.3-63.1-179.3-178.2178.80112V79 K80K76-V79 PolarHBondContact O-N 3.35Å; K76-K80 WeakPolarHBondContact O-CB 3.29Å; K76-K80 PolarHBondContact O-N 3.5Å
77S96Very high88Confident67 Ų6775 Ų7547%0.46939%0.385SS..Hα-helixtrans-64.1-42.9178.2-55.40000111.6T75 K80 R81T75-S77 VanDerWaalsContact C-N 3.26Å; T75-S77 PolarHBondContact O-N 2.76Å; S77-K80 PolarHBondContact O-N 3.37Å; S77-R81 WeakPolarHBondContact O-CB 3.48Å; S77-R81 PolarHBondContact O-N 3.07Å
78C95.8Very high89.2Confident0 Ų080.6 Ų80.60%040%0.399CS..Hα-helixtrans-62.3-51.9175.9-1730000111.3L74 T75 K80 R81 L82 F145L74-C78 HydrophobicContact CD2-CB 4.34Å; T75-C78 PolarHBondContact O-N 3.03Å; T75-C78 WeakPolarHBondContact OG1-CB 3.33Å; T75-C78 PolarHBondContact OG1-N 2.94Å; C78-K80 VanDerWaalsContact C-N 3.32Å; C78-K80 PolarHBondContact O-N 2.79Å; C78-R81 PolarHBondContact O-N 3.26Å; C78-R81 VanDerWaalsContact O-N 3.15Å; C78-L82 WeakPolarHBondContact O-CB 3.3Å; C78-L82 VanDerWaalsContact O-CG 3.3Å; C78-L82 WeakPolarHBondContact O-CG 3.45Å; C78-L82 PolarHBondContact O-N 3.36Å; C78-F145 HydrophobicContact CB-CB 4.29Å
79V95.7Very high90.6Very high21 Ų2177.6 Ų77.613%0.12739%0.385CS..Hα-helixtrans-56.6-46.5178.1172.70000111.4L74 T75 K76 R81 L82 S83 V126L74-V79 HydrophobicContact CB-CG2 3.79Å; L74-V79 HydrophobicContact CD2-CG2 4.32Å; T75-V79 WeakPolarHBondContact O-CG2 3.25Å; T75-V79 PolarHBondContact O-N 3.5Å; T75-V79 VanDerWaalsContact O-N 3.07Å; K76-V79 PolarHBondContact O-N 3.35Å; V79-R81 PolarHBondContact O-N 3.37Å; V79-L82 PolarHBondContact O-N 3.15Å; V79-S83 WeakPolarHBondContact O-CB 3.49Å; V79-S83 PolarHBondContact O-N 3.25Å; V79-S83 PolarHBondContact O-OG 3.27Å; V79-V126 HydrophobicContact CB-CG2 4.36Å; V79-V126 HydrophobicContact CG1-CG2 4.1Å; V79-V126 HydrophobicContact CG2-CG2 4.22Å
80K95.6Very high92.2Very high134 Ų13472.2 Ų72.258%0.58336%0.36SS*.Hα-helixtrans-58.2-49.5177.4-175.5-174.7176.4-167.50110.9K76 S77 C78 L82 S83 E84K76-K80 WeakPolarHBondContact O-CB 3.29Å; K76-K80 PolarHBondContact O-N 3.5Å; S77-K80 PolarHBondContact O-N 3.37Å; C78-K80 VanDerWaalsContact C-N 3.32Å; C78-K80 PolarHBondContact O-N 2.79Å; K80-L82 PolarHBondContact O-N 3.22Å; K80-S83 PolarHBondContact O-N 2.66Å; K80-S83 PolarHBondContact O-OG 2.95Å; K80-E84 VanDerWaalsContact CE-OE1 3.25Å; K80-E84 WeakPolarHBondContact CE-OE1 3.48Å; K80-E84 WeakPolarHBondContact O-CG 3.33Å; K80-E84 PolarHBondContact O-N 3.41Å
81R95.3Very high93Very high76 Ų7670.6 Ų70.629%0.28735%0.348SS..Hα-helixtrans-65.3-42.1-178.4-170.568.2-176133.74112.1S77 C78 V79 S83 E84 I85 F145S77-R81 WeakPolarHBondContact O-CB 3.48Å; S77-R81 PolarHBondContact O-N 3.07Å; C78-R81 PolarHBondContact O-N 3.26Å; C78-R81 VanDerWaalsContact O-N 3.15Å; V79-R81 PolarHBondContact O-N 3.37Å; R81-S83 VanDerWaalsContact C-N 3.29Å; R81-S83 PolarHBondContact O-N 3.37Å; R81-E84 IonicContact CZ-OE2 3.9Å; R81-E84 IonicContact NH1-OE2 2.84Å; R81-E84 PolarHBondContact NH1-OE2 3.47Å; R81-E84 WeakPolarHBondContact O-CB 3.44Å; R81-E84 PolarHBondContact O-N 3.48Å; R81-E84 VanDerWaalsContact O-N 3.08Å; R81-I85 HydrophobicContact CG-CD1 4.49Å; R81-I85 HydrophobicContact CG-CG2 4.29Å; R81-I85 WeakPolarHBondContact O-CG1 3.22Å; R81-I85 PolarHBondContact O-N 2.87Å; R81-F145 HydrophobicContact CB-CB 4.43Å; R81-F145 HydrophobicContact CB-CD1 3.67Å; R81-F145 HydrophobicContact CB-CD2 4.43Å; R81-F145 HydrophobicContact CB-CE1 3.96Å; R81-F145 HydrophobicContact CB-CG 3.92Å; R81-F145 HydrophobicContact CB-CZ 4.46Å; R81-F145 HydrophobicContact CG-CD1 3.7Å; R81-F145 HydrophobicContact CG-CD2 4.04Å; R81-F145 HydrophobicContact CG-CE1 3.49Å; R81-F145 VanDerWaalsContact CG-CE1 3.49Å; R81-F145 HydrophobicContact CG-CE2 3.85Å; R81-F145 HydrophobicContact CG-CG 3.96Å; R81-F145 HydrophobicContact CG-CZ 3.57Å
82L94.9Very high93.4Very high1 Ų165.1 Ų65.11%0.00532%0.324CS..Hα-helixtrans-60.4-40.8176.6-69.9174.5000111.2L74 C78 V79 K80 E84 I85 M86 L92 V126 I128 F154L74-L82 HydrophobicContact CD2-CD1 4Å; C78-L82 WeakPolarHBondContact O-CB 3.3Å; C78-L82 VanDerWaalsContact O-CG 3.3Å; C78-L82 WeakPolarHBondContact O-CG 3.45Å; C78-L82 PolarHBondContact O-N 3.36Å; V79-L82 PolarHBondContact O-N 3.15Å; K80-L82 PolarHBondContact O-N 3.22Å; L82-E84 PolarHBondContact O-N 3.39Å; L82-I85 HydrophobicContact CD2-CD1 4.25Å; L82-I85 PolarHBondContact O-N 3.08Å; L82-M86 HydrophobicContact CB-CG 4.47Å; L82-M86 HydrophobicContact CB-SD 3.65Å; L82-M86 HydrophobicContact CD1-SD 4.45Å; L82-M86 HydrophobicContact CD2-CG 4.24Å; L82-M86 HydrophobicContact CD2-SD 3.37Å; L82-M86 WeakPolarHBondContact CD2-SD 3.38Å; L82-M86 HydrophobicContact CG-SD 3.97Å; L82-M86 WeakPolarHBondContact O-CB 3.39Å; L82-M86 VanDerWaalsContact O-CG 3.29Å; L82-M86 WeakPolarHBondContact O-CG 3.38Å; L82-M86 PolarHBondContact O-N 2.82Å; L82-L92 HydrophobicContact CD1-CD2 4.37Å; L82-L92 HydrophobicContact CD2-CB 4.14Å; L82-L92 HydrophobicContact CD2-CD1 4.49Å; L82-L92 HydrophobicContact CD2-CD2 3.99Å; L82-L92 HydrophobicContact CD2-CG 4.44Å; L82-V126 HydrophobicContact CB-CB 4.01Å; L82-V126 HydrophobicContact CB-CG1 3.79Å; L82-V126 HydrophobicContact CB-CG2 4.06Å; L82-V126 HydrophobicContact CD1-CG2 4.03Å; L82-I128 HydrophobicContact CD1-CD1 4.24Å; L82-I128 HydrophobicContact CD1-CG1 4.32Å; L82-F154 HydrophobicContact CD2-CE1 3.84Å; L82-F154 HydrophobicContact CD2-CZ 3.67Å; L82-F154 HydrophobicContact CG-CE1 4.18Å; L82-F154 HydrophobicContact CG-CZ 4.4Å
83S93.8Very high93.5Very high75 Ų7565.5 Ų65.552%0.52433%0.325SS..Hα-helixtrans-66.2-21.4176.369.40000114.2V79 K80 R81V79-S83 WeakPolarHBondContact O-CB 3.49Å; V79-S83 PolarHBondContact O-N 3.25Å; V79-S83 PolarHBondContact O-OG 3.27Å; K80-S83 PolarHBondContact O-N 2.66Å; K80-S83 PolarHBondContact O-OG 2.95Å; R81-S83 VanDerWaalsContact C-N 3.29Å; R81-S83 PolarHBondContact O-N 3.37Å
84E93.6Very high93.6Very high108 Ų10861.8 Ų61.851%0.50531%0.308SS..Hα-helixtrans-88.3-34.1177.2-69.8170.5-174.900112.9K80 R81 L82K80-E84 VanDerWaalsContact CE-OE1 3.25Å; K80-E84 WeakPolarHBondContact CE-OE1 3.48Å; K80-E84 WeakPolarHBondContact O-CG 3.33Å; K80-E84 PolarHBondContact O-N 3.41Å; R81-E84 IonicContact CZ-OE2 3.9Å; R81-E84 IonicContact NH1-OE2 2.84Å; R81-E84 PolarHBondContact NH1-OE2 3.47Å; R81-E84 WeakPolarHBondContact O-CB 3.44Å; R81-E84 PolarHBondContact O-N 3.48Å; R81-E84 VanDerWaalsContact O-N 3.08Å; L82-E84 PolarHBondContact O-N 3.39Å
85I93.2Very high93.6Very high71 Ų7163.4 Ų63.436%0.36432%0.316SS..Hα-helixtrans-98.2-24.3-172.971.4-177.5000113.8R81 L82 F154R81-I85 HydrophobicContact CG-CD1 4.49Å; R81-I85 HydrophobicContact CG-CG2 4.29Å; R81-I85 WeakPolarHBondContact O-CG1 3.22Å; R81-I85 PolarHBondContact O-N 2.87Å; L82-I85 HydrophobicContact CD2-CD1 4.25Å; L82-I85 PolarHBondContact O-N 3.08Å; I85-F154 HydrophobicContact CD1-CE2 4.14Å; I85-F154 HydrophobicContact CD1-CZ 3.78Å
86M92.4Very high93.6Very high28 Ų2862.9 Ų62.914%0.13831%0.312CS..PPolyproline II helixtrans-96.9142-172.9-60.2174.966.700111.7L82 E90 Y91L82-M86 HydrophobicContact CB-CG 4.47Å; L82-M86 HydrophobicContact CB-SD 3.65Å; L82-M86 HydrophobicContact CD1-SD 4.45Å; L82-M86 HydrophobicContact CD2-CG 4.24Å; L82-M86 HydrophobicContact CD2-SD 3.37Å; L82-M86 WeakPolarHBondContact CD2-SD 3.38Å; L82-M86 HydrophobicContact CG-SD 3.97Å; L82-M86 WeakPolarHBondContact O-CB 3.39Å; L82-M86 VanDerWaalsContact O-CG 3.29Å; L82-M86 WeakPolarHBondContact O-CG 3.38Å; L82-M86 PolarHBondContact O-N 2.82Å; M86-E90 HydrophobicContact CB-CB 4.41Å; M86-E90 HydrophobicContact CE-CB 3.98Å; M86-E90 WeakPolarHBondContact CE-O 3.31Å; M86-Y91 VanDerWaalsContact CE-C 3.43Å
87E89.1Confident93.5Very high127 Ų12757 Ų5759%0.59329%0.288SS*.PPolyproline II helixtrans-85.5168.3170.8-62.4-175.4161.900111.6G89 E90 R112E87-G89 PolarHBondContact O-N 2.96Å; E87-E90 HydrophobicContact CB-CG 4.38Å; E87-E90 PolarHBondContact N-OE2 2.9Å; E87-E90 PolarHBondContact O-N 3.36Å; E87-R112 IonicContact OE2-NH2 3.03Å; E87-R112 PolarHBondContact OE2-NH2 3.17Å
88K85.4Confident93.4Very high218 Ų21856.9 Ų56.995%0.94830%0.297SS*.THydrogen-bonded Turntrans-63.2126176.3-66.7-176.9-179-179.60110.1
89G85.5Confident93.2Very high43 Ų4358.1 Ų58.144%0.44331%0.31SS..THydrogen-bonded Turntrans88.86.3179.100000114.4E87 Y91E87-G89 PolarHBondContact O-N 2.96Å; G89-Y91 WeakPolarHBondContact O-CE2 3.06Å
90E93.8Very high92.8Very high34 Ų3459.4 Ų59.416%0.15933%0.327CS..  trans-91.8152.2167.7-68.5-178158.900111.1M86 E87 V110 R112M86-E90 HydrophobicContact CB-CB 4.41Å; M86-E90 HydrophobicContact CE-CB 3.98Å; M86-E90 WeakPolarHBondContact CE-O 3.31Å; E87-E90 HydrophobicContact CB-CG 4.38Å; E87-E90 PolarHBondContact N-OE2 2.9Å; E87-E90 PolarHBondContact O-N 3.36Å; E90-V110 HydrophobicContact CB-CG1 3.99Å; E90-V110 HydrophobicContact CG-CG1 4.32Å; E90-R112 HydrophobicContact CG-CG 3.66Å; E90-R112 IonicContact OE1-CZ 2.75Å; E90-R112 VanDerWaalsContact OE1-CZ 3.3Å; E90-R112 IonicContact OE1-NE 2.97Å; E90-R112 PolarHBondContact OE1-NE 2.84Å; E90-R112 IonicContact OE1-NH2 2.97Å; E90-R112 PolarHBondContact OE1-NH2 2.87Å
91Y94.1Very high92.4Very high43 Ų4358.8 Ų58.817%0.16934%0.338CS..EExtended strand (participates in β ladder)trans-134.7142.6178.7-60.7-87.4000110.1M86 G89 R93 V110 D111 K114 V120 G127 I129M86-Y91 VanDerWaalsContact CE-C 3.43Å; G89-Y91 WeakPolarHBondContact O-CE2 3.06Å; Y91-R93 PolarHBondContact O-N 3.45Å; Y91-V110 WeakPolarHBondContact O-CA 3.4Å; Y91-D111 PolarHBondContact N-O 2.94Å; Y91-D111 PolarHBondContact O-N 2.8Å; Y91-K114 HydrophobicContact CD2-CG 4.49Å; Y91-K114 VanDerWaalsContact CE1-NZ 3.27Å; Y91-K114 HydrophobicContact CE2-CD 4.34Å; Y91-K114 VanDerWaalsContact CE2-CE 3.49Å; Y91-K114 HydrophobicContact CE2-CG 4.48Å; Y91-K114 WeakPolarHBondContact OH-CE 3.34Å; Y91-K114 PolarHBondContact OH-NZ 2.56Å; Y91-V120 HydrophobicContact CD1-CG1 4.49Å; Y91-V120 HydrophobicContact CE1-CG1 4.36Å; Y91-G127 WeakPolarHBondContact CA-O 3.15Å; Y91-I129 HydrophobicContact CD1-CD1 4.17Å; Y91-I129 HydrophobicContact CD1-CG1 4.1Å; Y91-I129 HydrophobicContact CD2-CD1 3.85Å; Y91-I129 HydrophobicContact CG-CD1 3.48Å; Y91-I129 VanDerWaalsContact CG-CD1 3.48Å; Y91-I129 HydrophobicContact CG-CG1 3.86Å
92L95.1Very high92Very high4 Ų456.8 Ų56.82%0.02134%0.336CS..EExtended strand (participates in β ladder)trans-82.4112.8169.9-176.374.1000108.4L82 F108 S109 V110 G127 I128 I129 F154L82-L92 HydrophobicContact CD1-CD2 4.37Å; L82-L92 HydrophobicContact CD2-CB 4.14Å; L82-L92 HydrophobicContact CD2-CD1 4.49Å; L82-L92 HydrophobicContact CD2-CD2 3.99Å; L82-L92 HydrophobicContact CD2-CG 4.44Å; L92-F108 HydrophobicContact CD1-CB 4.28Å; L92-F108 HydrophobicContact CD2-CD1 4.32Å; L92-S109 CarbonylContact C-O 3.47Å; L92-V110 HydrophobicContact CD1-CG2 4.29Å; L92-G127 PolarHBondContact N-O 2.89Å; L92-G127 VanDerWaalsContact N-O 3.17Å; L92-I128 HydrophobicContact CB-CG1 4.22Å; L92-I128 HydrophobicContact CD2-CD1 4.01Å; L92-I128 CarbonylContact O-C 3.57Å; L92-I128 VanDerWaalsContact O-CA 3.31Å; L92-I128 WeakPolarHBondContact O-CA 3.5Å; L92-I128 WeakPolarHBondContact O-CG2 3.47Å; L92-I129 PolarHBondContact O-N 2.96Å; L92-F154 HydrophobicContact CD2-CD1 4.42Å
93R95.2Very high91.8Very high13 Ų1358.6 Ų58.65%0.04936%0.355CS..EExtended strand (participates in β ladder)trans-83.6130.6171.6-171.1-177.8-72.7-93.3-7.1110.2Y91 Q95 F108 S109 D111 N113 N115 D118 I129 D131Y91-R93 PolarHBondContact O-N 3.45Å; R93-Q95 HydrophobicContact CG-CG 3.9Å; R93-F108 WeakPolarHBondContact O-CA 3.37Å; R93-S109 PolarHBondContact N-O 2.75Å; R93-S109 PolarHBondContact O-N 2.97Å; R93-D111 WeakPolarHBondContact CD-OD2 3.36Å; R93-D111 IonicContact CZ-OD2 3.84Å; R93-D111 IonicContact NE-OD2 2.83Å; R93-D111 PolarHBondContact NE-OD2 2.87Å; R93-N113 PolarHBondContact NH2-O 2.85Å; R93-N115 PolarHBondContact NH1-ND2 2.97Å; R93-N115 PolarHBondContact NH2-ND2 3.31Å; R93-D118 IonicContact CZ-OD1 3.89Å; R93-D118 IonicContact CZ-OD2 2.75Å; R93-D118 VanDerWaalsContact CZ-OD2 3.3Å; R93-D118 VanDerWaalsContact NH1-CG 3.3Å; R93-D118 IonicContact NH1-OD1 3.97Å; R93-D118 PolarHBondContact NH1-OD1 2.91Å; R93-D118 IonicContact NH1-OD2 3.3Å; R93-D118 PolarHBondContact NH1-OD2 2.63Å; R93-D118 IonicContact NH2-OD2 2.97Å; R93-D118 PolarHBondContact NH2-OD2 3.04Å; R93-I129 CarbonylContact C-O 3.47Å; R93-I129 VanDerWaalsContact CA-O 3.3Å; R93-I129 WeakPolarHBondContact CA-O 3.5Å; R93-D131 WeakPolarHBondContact CD-OD1 3.38Å; R93-D131 WeakPolarHBondContact CG-OD1 3.21Å; R93-D131 IonicContact CZ-OD1 3.57Å; R93-D131 IonicContact NE-OD1 3.86Å; R93-D131 VanDerWaalsContact NH1-CG 3.31Å; R93-D131 IonicContact NH1-OD1 2.64Å; R93-D131 PolarHBondContact NH1-OD1 2.99Å; R93-D131 IonicContact NH1-OD2 3.59Å
94I95Very high91.9Very high1 Ų158.1 Ų58.11%0.00534%0.344CS..EExtended strand (participates in β ladder)trans-110.1121.7172.6-53.3176.9000108.4F108 I128 I129 V130 V138 V143I94-F108 HydrophobicContact CD1-CE1 4.33Å; I94-F108 HydrophobicContact CG1-CD1 4.02Å; I94-F108 HydrophobicContact CG1-CE1 4.04Å; I94-F108 HydrophobicContact CG2-CE1 4.18Å; I94-I128 HydrophobicContact CD1-CD1 4.29Å; I94-I128 HydrophobicContact CD1-CG2 3.64Å; I94-I128 HydrophobicContact CG1-CG2 3.94Å; I94-I129 PolarHBondContact N-O 2.99Å; I94-V130 HydrophobicContact CB-CG2 4.32Å; I94-V130 HydrophobicContact CD1-CG2 4.44Å; I94-V138 HydrophobicContact CG2-CG1 4.35Å; I94-V143 HydrophobicContact CD1-CG1 4.48Å; I94-V143 HydrophobicContact CD1-CG2 3.61Å
95Q94.8Very high91.9Very high46 Ų4656 Ų5622%0.21533%0.334CS..EExtended strand (participates in β ladder)trans-121.9148.9176.9-54.8-175.2-56.600109.9R93 K107 D131 S134R93-Q95 HydrophobicContact CG-CG 3.9Å; Q95-K107 HydrophobicContact CB-CB 4.31Å; Q95-K107 PolarHBondContact N-O 2.97Å; Q95-K107 PolarHBondContact O-N 2.86Å; Q95-D131 WeakPolarHBondContact CG-OD2 3.29Å; Q95-D131 PolarHBondContact NE2-OD2 2.73Å; Q95-S134 WeakPolarHBondContact CA-OG 3.33Å
96V95Very high92Very high21 Ų2153.9 Ų53.913%0.12732%0.321CS..EExtended strand (participates in β ladder)trans-113.3122171178.20000108.1F104 Q105 Y106 S134 F137 V138 F172V96-F104 HydrophobicContact CG1-CB 3.98Å; V96-F104 HydrophobicContact CG1-CD1 3.89Å; V96-F104 HydrophobicContact CG1-CG 4.3Å; V96-Q105 WeakPolarHBondContact CA-O 3.24Å; V96-Y106 HydrophobicContact CG2-CD1 3.94Å; V96-Y106 HydrophobicContact CG2-CE1 4.14Å; V96-S134 PolarHBondContact N-OG 3.34Å; V96-F137 HydrophobicContact CB-CB 4.38Å; V96-F137 HydrophobicContact CB-CD2 4.12Å; V96-F137 HydrophobicContact CB-CG 4.45Å; V96-F137 HydrophobicContact CG1-CB 4.31Å; V96-F137 HydrophobicContact CG1-CD2 4.1Å; V96-F137 HydrophobicContact CG1-CG 4.16Å; V96-F137 HydrophobicContact CG2-CB 3.92Å; V96-V138 HydrophobicContact CG2-CG1 3.96Å; V96-F172 HydrophobicContact CG1-CE1 3.98Å; V96-F172 HydrophobicContact CG1-CZ 3.84Å; V96-F172 HydrophobicContact CG2-CE1 4.47Å; V96-F172 HydrophobicContact CG2-CZ 4.43Å
97E94.4Very high92Very high66 Ų6656.4 Ų56.431%0.30833%0.332SS..EExtended strand (participates in β ladder)trans-111.5147.3176.6-66.6178.5163.400109.8G99 F104 Q105 K107E97-G99 PolarHBondContact O-N 3.35Å; E97-F104 CarbonylContact O-C 2.92Å; E97-F104 WeakPolarHBondContact O-CA 3.3Å; E97-Q105 HydrophobicContact CB-CG 3.92Å; E97-Q105 PolarHBondContact N-O 3.45Å; E97-Q105 PolarHBondContact O-N 3.27Å; E97-Q105 PolarHBondContact OE2-NE2 2.76Å; E97-K107 VanDerWaalsContact CD-CD 3.46Å; E97-K107 HydrophobicContact CG-CD 4.37Å; E97-K107 WeakPolarHBondContact OE1-CD 3.25Å; E97-K107 WeakPolarHBondContact OE1-CE 3.22Å; E97-K107 IonicContact OE1-NZ 2.7Å; E97-K107 PolarHBondContact OE1-NZ 2.83Å
98G93.9Very high92.3Very high65 Ų6553 Ų5367%0.6732%0.315SS*.EExtended strand (participates in β ladder)trans-69125.2168.400000110.4G103G98-G103 CarbonylContact C-O 3.58Å
99G91.1Very high92.7Very high26 Ų2644.4 Ų44.427%0.26828%0.283SS..EExtended strand (participates in β ladder)trans154.9-162.9-178.300000114.4E97 G103 F104E97-G99 PolarHBondContact O-N 3.35Å; G99-G103 PolarHBondContact N-O 2.97Å; G99-G103 CarbonylContact O-C 3.57Å; G99-G103 WeakPolarHBondContact O-CA 3.48Å; G99-G103 PolarHBondContact O-N 2.75Å; G99-G103 VanDerWaalsContact O-O 3.11Å; G99-F104 CarbonylContact O-C 3.57Å; G99-F104 PolarHBondContact O-N 3.38Å; G99-F104 VanDerWaalsContact O-N 3.12Å
100G87.5Confident93.1Very high48 Ų4845.9 Ų45.950%0.49528%0.283SS..THydrogen-bonded Turntrans71.2-174179.900000114.4S102G100-S102 PolarHBondContact O-N 3.03Å
101C86.9Confident93.1Very high120 Ų12047.1 Ų47.181%0.81129%0.29SS*.THydrogen-bonded Turntrans-71.3-19.4-176.4-58.90000113.7
102S86.9Confident93Very high34 Ų3452.1 Ų52.124%0.23831%0.309CS..THydrogen-bonded Turntrans-120.6-1.6-168.1-56.40000114G100 F172 S173G100-S102 PolarHBondContact O-N 3.03Å; S102-F172 CarbonylContact C-O 3.55Å; S102-S173 PolarHBondContact O-OG 3.4Å
103G92.1Very high92.8Very high40 Ų4058 Ų5841%0.41234%0.34SS..EExtended strand (participates in β ladder)trans112.7-37.1174.900000114.3G98 G99G98-G103 CarbonylContact C-O 3.58Å; G99-G103 PolarHBondContact N-O 2.97Å; G99-G103 CarbonylContact O-C 3.57Å; G99-G103 WeakPolarHBondContact O-CA 3.48Å; G99-G103 PolarHBondContact O-N 2.75Å; G99-G103 VanDerWaalsContact O-O 3.11Å
104F94.6Very high92.5Very high64 Ų6461.4 Ų61.428%0.28136%0.356SS..EExtended strand (participates in β ladder)trans-127.5149.2173.4-64.5-87.5000111.9V96 E97 G99 F137 S171 F172 V174V96-F104 HydrophobicContact CG1-CB 3.98Å; V96-F104 HydrophobicContact CG1-CD1 3.89Å; V96-F104 HydrophobicContact CG1-CG 4.3Å; E97-F104 CarbonylContact O-C 2.92Å; E97-F104 WeakPolarHBondContact O-CA 3.3Å; G99-F104 CarbonylContact O-C 3.57Å; G99-F104 PolarHBondContact O-N 3.38Å; G99-F104 VanDerWaalsContact O-N 3.12Å; F104-F137 HydrophobicContact CE1-CE1 4.35Å; F104-F137 HydrophobicContact CE1-CZ 4.23Å; F104-F137 HydrophobicContact CZ-CE1 4.36Å; F104-S171 CarbonylContact O-C 3.51Å; F104-S171 WeakPolarHBondContact O-CA 3.4Å; F104-S171 WeakPolarHBondContact O-CB 3.42Å; F104-F172 HydrophobicContact CB-CD1 4.12Å; F104-F172 HydrophobicContact CB-CE1 3.7Å; F104-F172 HydrophobicContact CB-CE2 4.3Å; F104-F172 HydrophobicContact CB-CZ 3.8Å; F104-F172 HydrophobicContact CG-CZ 4.47Å; F104-F172 PolarHBondContact N-O 3.5Å; F104-F172 PolarHBondContact O-N 3.4Å; F104-V174 HydrophobicContact CD2-CB 4.33Å; F104-V174 HydrophobicContact CD2-CG2 3.39Å; F104-V174 HydrophobicContact CE2-CB 4.05Å; F104-V174 HydrophobicContact CE2-CG2 3.4Å; F104-V174 HydrophobicContact CG-CG2 4.12Å; F104-V174 HydrophobicContact CZ-CG2 4.13Å
105Q94.1Very high92.3Very high64 Ų6465.9 Ų65.930%0.29938%0.38SS..EExtended strand (participates in β ladder)trans-129.2144.4178.166.8-178.739.300111.5V96 E97 S170V96-Q105 WeakPolarHBondContact CA-O 3.24Å; E97-Q105 HydrophobicContact CB-CG 3.92Å; E97-Q105 PolarHBondContact N-O 3.45Å; E97-Q105 PolarHBondContact O-N 3.27Å; E97-Q105 PolarHBondContact OE2-NE2 2.76Å; Q105-S170 WeakPolarHBondContact CA-O 3.41Å
106Y94.5Very high92.1Very high26 Ų2673.3 Ų73.310%0.10241%0.414CS..EExtended strand (participates in β ladder)trans-85.1135.4172-58-70.7000110V96 V138 V156 N159 S170 F172V96-Y106 HydrophobicContact CG2-CD1 3.94Å; V96-Y106 HydrophobicContact CG2-CE1 4.14Å; Y106-V138 HydrophobicContact CD1-CG1 4.36Å; Y106-V138 HydrophobicContact CE1-CG1 3.94Å; Y106-V156 HydrophobicContact CD1-CB 4.42Å; Y106-V156 HydrophobicContact CD1-CG2 3.81Å; Y106-V156 HydrophobicContact CD2-CB 4.23Å; Y106-V156 HydrophobicContact CD2-CG2 4.12Å; Y106-V156 HydrophobicContact CE1-CB 4.08Å; Y106-V156 HydrophobicContact CE1-CG1 4.26Å; Y106-V156 HydrophobicContact CE1-CG2 3.91Å; Y106-V156 HydrophobicContact CE2-CB 3.86Å; Y106-V156 HydrophobicContact CE2-CG2 4.2Å; Y106-V156 HydrophobicContact CG-CB 4.49Å; Y106-V156 HydrophobicContact CG-CG2 3.92Å; Y106-N159 PolarHBondContact OH-ND2 2.7Å; Y106-S170 PolarHBondContact N-O 3.35Å; Y106-S170 VanDerWaalsContact N-O 3.12Å; Y106-F172 HydrophobicContact CD1-CD1 4.47Å; Y106-F172 AromaticContact CD1-CE1 3.93Å; Y106-F172 HydrophobicContact CD1-CE1 3.93Å; Y106-F172 HydrophobicContact CD2-CD1 4.13Å; Y106-F172 HydrophobicContact CD2-CE1 4.38Å; Y106-F172 AromaticContact CE1-CD1 3.81Å; Y106-F172 HydrophobicContact CE1-CD1 3.81Å; Y106-F172 AromaticContact CE1-CE1 3.32Å; Y106-F172 HydrophobicContact CE1-CE1 3.32Å; Y106-F172 AromaticContact CE1-CZ 3.97Å; Y106-F172 HydrophobicContact CE1-CZ 3.97Å; Y106-F172 AromaticContact CE2-CD1 3.41Å; Y106-F172 HydrophobicContact CE2-CD1 3.41Å; Y106-F172 VanDerWaalsContact CE2-CD1 3.41Å; Y106-F172 AromaticContact CE2-CE1 3.84Å; Y106-F172 HydrophobicContact CE2-CE1 3.84Å; Y106-F172 HydrophobicContact CE2-CG 4.25Å; Y106-F172 HydrophobicContact CG-CE1 4.42Å; Y106-F172 AromaticContact CZ-CD1 3.23Å; Y106-F172 AromaticContact CZ-CE1 3.27Å; Y106-F172 AromaticContact CZ-CG 4Å; Y106-F172 VanDerWaalsContact OH-CD1 3.3Å; Y106-F172 WeakPolarHBondContact OH-CD1 3.49Å; Y106-F172 WeakPolarHBondContact OH-CE1 3.15Å
107K94.1Very high91.8Very high81 Ų8179.5 Ų79.535%0.35244%0.442SS..EExtended strand (participates in β ladder)trans-123132.1173.4-176176.7-178.3-172.20109.4Q95 E97Q95-K107 HydrophobicContact CB-CB 4.31Å; Q95-K107 PolarHBondContact N-O 2.97Å; Q95-K107 PolarHBondContact O-N 2.86Å; E97-K107 VanDerWaalsContact CD-CD 3.46Å; E97-K107 HydrophobicContact CG-CD 4.37Å; E97-K107 WeakPolarHBondContact OE1-CD 3.25Å; E97-K107 WeakPolarHBondContact OE1-CE 3.22Å; E97-K107 IonicContact OE1-NZ 2.7Å; E97-K107 PolarHBondContact OE1-NZ 2.83Å
108F94.4Very high91.7Very high55 Ų5577.3 Ų77.324%0.24143%0.432CS..EExtended strand (participates in β ladder)trans-112.9133.8178.9-58.2-78.7000108.5L92 R93 I94 F154 V156L92-F108 HydrophobicContact CD1-CB 4.28Å; L92-F108 HydrophobicContact CD2-CD1 4.32Å; R93-F108 WeakPolarHBondContact O-CA 3.37Å; I94-F108 HydrophobicContact CD1-CE1 4.33Å; I94-F108 HydrophobicContact CG1-CD1 4.02Å; I94-F108 HydrophobicContact CG1-CE1 4.04Å; I94-F108 HydrophobicContact CG2-CE1 4.18Å; F108-F154 HydrophobicContact CD1-CB 4.14Å; F108-F154 HydrophobicContact CD2-CB 4.01Å; F108-F154 HydrophobicContact CE1-CB 4.04Å; F108-F154 HydrophobicContact CE2-CB 3.9Å; F108-F154 WeakPolarHBondContact CE2-O 3.4Å; F108-F154 HydrophobicContact CG-CB 4.12Å; F108-F154 HydrophobicContact CZ-CB 3.9Å; F108-V156 HydrophobicContact CE1-CG2 4.37Å; F108-V156 HydrophobicContact CZ-CG2 3.95Å
109S94.1Very high91.6Very high39 Ų3979.4 Ų79.427%0.27342%0.42SS..EExtended strand (participates in β ladder)trans-140.5154.9176.5-66.80000109.3L92 R93L92-S109 CarbonylContact C-O 3.47Å; R93-S109 PolarHBondContact N-O 2.75Å; R93-S109 PolarHBondContact O-N 2.97Å
110V93.8Very high91.7Very high74 Ų7480.7 Ų80.745%0.44842%0.423SS..EExtended strand (participates in β ladder)trans-109119.4176.9179.50000107.4E90 Y91 L92E90-V110 HydrophobicContact CB-CG1 3.99Å; E90-V110 HydrophobicContact CG-CG1 4.32Å; Y91-V110 WeakPolarHBondContact O-CA 3.4Å; L92-V110 HydrophobicContact CD1-CG2 4.29Å
111D93.1Very high91.9Very high59 Ų5980 Ų8032%0.31641%0.406SS..EExtended strand (participates in β ladder)trans-127.3147.2-178.2-73.7-45.3000110.7Y91 R93Y91-D111 PolarHBondContact N-O 2.94Å; Y91-D111 PolarHBondContact O-N 2.8Å; R93-D111 WeakPolarHBondContact CD-OD2 3.36Å; R93-D111 IonicContact CZ-OD2 3.84Å; R93-D111 IonicContact NE-OD2 2.83Å; R93-D111 PolarHBondContact NE-OD2 2.87Å
112R92.7Very high92Very high149 Ų14980.9 Ų80.956%0.56240%0.398SS*.SBendtrans-92.6-22.9173.4-68.9174.7-176.7-159.7-6.6112.4E87 E90E87-R112 IonicContact OE2-NH2 3.03Å; E87-R112 PolarHBondContact OE2-NH2 3.17Å; E90-R112 HydrophobicContact CG-CG 3.66Å; E90-R112 IonicContact OE1-CZ 2.75Å; E90-R112 VanDerWaalsContact OE1-CZ 3.3Å; E90-R112 IonicContact OE1-NE 2.97Å; E90-R112 PolarHBondContact OE1-NE 2.84Å; E90-R112 IonicContact OE1-NH2 2.97Å; E90-R112 PolarHBondContact OE1-NH2 2.87Å
113N89.8Confident92.1Very high126 Ų12683 Ų8367%0.67440%0.404SS*.PPolyproline II helixtrans-99.5134.8-175.6-63.1-38.3000110.7R93R93-N113 PolarHBondContact NH2-O 2.85Å
114K90.6Very high91.8Very high86 Ų8684.2 Ų84.237%0.37442%0.417SS..PPolyproline II helixtrans-96.5133.6169.5-70.3166.8173177.20108.2Y91 V120 E122 I129Y91-K114 HydrophobicContact CD2-CG 4.49Å; Y91-K114 VanDerWaalsContact CE1-NZ 3.27Å; Y91-K114 HydrophobicContact CE2-CD 4.34Å; Y91-K114 VanDerWaalsContact CE2-CE 3.49Å; Y91-K114 HydrophobicContact CE2-CG 4.48Å; Y91-K114 WeakPolarHBondContact OH-CE 3.34Å; Y91-K114 PolarHBondContact OH-NZ 2.56Å; K114-V120 HydrophobicContact CD-CG2 3.72Å; K114-V120 HydrophobicContact CG-CG2 4.15Å; K114-E122 IonicContact NZ-OE1 3.09Å; K114-I129 HydrophobicContact CB-CD1 4.34Å; K114-I129 HydrophobicContact CD-CD1 4.49Å; K114-I129 HydrophobicContact CG-CD1 3.41Å; K114-I129 VanDerWaalsContact CG-CD1 3.41Å; K114-I129 HydrophobicContact CG-CG1 4.16Å
115N90.9Very high91.5Very high95 Ų9585.4 Ų85.451%0.50845%0.447SS..PPolyproline II helixtrans-86.3162.6167-53.8-39.4000109.6R93 E117 D118R93-N115 PolarHBondContact NH1-ND2 2.97Å; R93-N115 PolarHBondContact NH2-ND2 3.31Å; N115-E117 VanDerWaalsContact C-N 3.28Å; N115-E117 PolarHBondContact O-N 3.01Å; N115-D118 WeakPolarHBondContact CA-OD2 3.31Å; N115-D118 VanDerWaalsContact CB-OD2 3.24Å; N115-D118 WeakPolarHBondContact CB-OD2 3.47Å; N115-D118 PolarHBondContact N-OD2 2.84Å; N115-D118 PolarHBondContact ND2-OD2 3.17Å; N115-D118 PolarHBondContact O-N 3.19Å
116E88.9Confident91.4Very high202 Ų20283 Ų8394%0.94444%0.437SS*.THydrogen-bonded Turntrans-68-28.7-177.9-60.9-175.7172.500113
117E89.3Confident91.2Very high150 Ų15082 Ų8270%0.70144%0.435SS*.THydrogen-bonded Turntrans-86-11.4179.9-60.9177.5-176.900112.5N115 Q132N115-E117 VanDerWaalsContact C-N 3.28Å; N115-E117 PolarHBondContact O-N 3.01Å; E117-Q132 HydrophobicContact CB-CB 4.4Å
118D92.1Very high91.2Very high21 Ų2178.2 Ų78.211%0.11242%0.418CS..PPolyproline II helixtrans-77.7142-176.3-57.8-31.5000111.7R93 N115 I129R93-D118 IonicContact CZ-OD1 3.89Å; R93-D118 IonicContact CZ-OD2 2.75Å; R93-D118 VanDerWaalsContact CZ-OD2 3.3Å; R93-D118 VanDerWaalsContact NH1-CG 3.3Å; R93-D118 IonicContact NH1-OD1 3.97Å; R93-D118 PolarHBondContact NH1-OD1 2.91Å; R93-D118 IonicContact NH1-OD2 3.3Å; R93-D118 PolarHBondContact NH1-OD2 2.63Å; R93-D118 IonicContact NH2-OD2 2.97Å; R93-D118 PolarHBondContact NH2-OD2 3.04Å; N115-D118 WeakPolarHBondContact CA-OD2 3.31Å; N115-D118 VanDerWaalsContact CB-OD2 3.24Å; N115-D118 WeakPolarHBondContact CB-OD2 3.47Å; N115-D118 PolarHBondContact N-OD2 2.84Å; N115-D118 PolarHBondContact ND2-OD2 3.17Å; N115-D118 PolarHBondContact O-N 3.19Å; D118-I129 HydrophobicContact CB-CG2 3.4Å; D118-I129 WeakPolarHBondContact OD2-CG2 3.32Å
119R92.4Very high91.3Very high108 Ų10875.6 Ų75.641%0.40841%0.407SS..EExtended strand (participates in β ladder)trans-91.7128.5169.5-73.4-72.3176.195.10.7110.6D70 F121 I129 V130 L135D70-R119 IonicContact OD2-NH1 3.3Å; D70-R119 PolarHBondContact OD2-NH1 3.26Å; D70-R119 VanDerWaalsContact OD2-NH1 3.09Å; R119-F121 HydrophobicContact CB-CE2 3.82Å; R119-F121 HydrophobicContact CB-CZ 3.97Å; R119-I129 CarbonylContact O-C 3.59Å; R119-I129 WeakPolarHBondContact O-CA 3.48Å; R119-V130 PolarHBondContact N-O 2.64Å; R119-V130 PolarHBondContact O-N 3.25Å; R119-L135 HydrophobicContact CB-CD1 4.41Å; R119-L135 HydrophobicContact CG-CD1 4.47Å; R119-L135 HydrophobicContact CG-CD2 3.79Å
120V92.1Very high91.3Very high54 Ų5473.7 Ų73.733%0.32739%0.394SS..EExtended strand (participates in β ladder)trans-101.7128.5177.8-170.80000110Y91 K114 E122 I128 I129Y91-V120 HydrophobicContact CD1-CG1 4.49Å; Y91-V120 HydrophobicContact CE1-CG1 4.36Å; K114-V120 HydrophobicContact CD-CG2 3.72Å; K114-V120 HydrophobicContact CG-CG2 4.15Å; V120-E122 HydrophobicContact CG1-CG 4.05Å; V120-I128 CarbonylContact C-O 3.58Å; V120-I128 WeakPolarHBondContact CA-O 3.43Å; V120-I129 HydrophobicContact CG2-CG1 4.36Å
121F92.1Very high91.3Very high34 Ų3471.5 Ų71.515%0.14938%0.38CS..EExtended strand (participates in β ladder)trans-118.2118.4174.6-58.3-79.1000109.8D70 V72 R119 I128 V130 L135D70-F121 WeakPolarHBondContact O-CE1 3.27Å; D70-F121 WeakPolarHBondContact O-CZ 3.41Å; V72-F121 HydrophobicContact CB-CD2 4.27Å; V72-F121 HydrophobicContact CB-CE2 4.35Å; V72-F121 HydrophobicContact CB-CG 4.41Å; V72-F121 HydrophobicContact CG2-CD2 4.3Å; V72-F121 HydrophobicContact CG2-CE2 3.92Å; V72-F121 HydrophobicContact CG2-CZ 4.13Å; R119-F121 HydrophobicContact CB-CE2 3.82Å; R119-F121 HydrophobicContact CB-CZ 3.97Å; F121-I128 PolarHBondContact N-O 3.05Å; F121-I128 PolarHBondContact O-N 3.32Å; F121-V130 HydrophobicContact CD2-CG2 3.9Å; F121-V130 HydrophobicContact CE2-CB 4.09Å; F121-V130 HydrophobicContact CE2-CG2 3.74Å; F121-L135 HydrophobicContact CE2-CD1 4.04Å; F121-L135 HydrophobicContact CZ-CD1 3.83Å
122E90.4Very high91.2Very high137 Ų13772.3 Ų72.364%0.6438%0.382SS*.EExtended strand (participates in β ladder)trans-111.5128.4179.5-62.7-175.5173.800110.4K114 V120 V126K114-E122 IonicContact NZ-OE1 3.09Å; V120-E122 HydrophobicContact CG1-CG 4.05Å; E122-V126 WeakPolarHBondContact CA-O 3.36Å
123Q88.9Confident91.2Very high78 Ų7873 Ų7336%0.36439%0.391SS..EExtended strand (participates in β ladder)trans-146.1122.2177.5-165.3-179.3-33.700109.9L74 G125 V126L74-Q123 HydrophobicContact CD1-CB 3.55Å; L74-Q123 HydrophobicContact CD1-CG 4.47Å; L74-Q123 VanDerWaalsContact N-OE1 3.11Å; L74-Q123 PolarHBondContact O-NE2 3.18Å; L74-Q123 VanDerWaalsContact O-NE2 3.08Å; Q123-G125 VanDerWaalsContact C-N 3.3Å; Q123-G125 PolarHBondContact O-N 3.42Å; Q123-V126 PolarHBondContact N-O 3.15Å; Q123-V126 VanDerWaalsContact O-CG2 3.27Å; Q123-V126 WeakPolarHBondContact O-CG2 3.39Å; Q123-V126 PolarHBondContact O-N 2.85Å
124G85.5Confident91.4Very high67 Ų6767.3 Ų67.369%0.69136%0.361SS*.THydrogen-bonded Turntrans6529.7175.200000114.6
125G88Confident91.5Very high88 Ų8863.4 Ų63.491%0.90734%0.344SS*.THydrogen-bonded Turntrans84.93176.500000115.3Q123Q123-G125 VanDerWaalsContact C-N 3.3Å; Q123-G125 PolarHBondContact O-N 3.42Å
126V91.8Very high91.5Very high13 Ų1364.6 Ų64.68%0.07935%0.347CS..EExtended strand (participates in β ladder)trans-112.1149.6170.4-58.40000110.3V79 L82 E122 Q123V79-V126 HydrophobicContact CB-CG2 4.36Å; V79-V126 HydrophobicContact CG1-CG2 4.1Å; V79-V126 HydrophobicContact CG2-CG2 4.22Å; L82-V126 HydrophobicContact CB-CB 4.01Å; L82-V126 HydrophobicContact CB-CG1 3.79Å; L82-V126 HydrophobicContact CB-CG2 4.06Å; L82-V126 HydrophobicContact CD1-CG2 4.03Å; E122-V126 WeakPolarHBondContact CA-O 3.36Å; Q123-V126 PolarHBondContact N-O 3.15Å; Q123-V126 VanDerWaalsContact O-CG2 3.27Å; Q123-V126 WeakPolarHBondContact O-CG2 3.39Å; Q123-V126 PolarHBondContact O-N 2.85Å
127G91.3Very high91.7Very high6 Ų657.4 Ų57.46%0.06231%0.312CS..EExtended strand (participates in β ladder)trans-116.3135.9179.800000112.5Y91 L92Y91-G127 WeakPolarHBondContact CA-O 3.15Å; L92-G127 PolarHBondContact N-O 2.89Å; L92-G127 VanDerWaalsContact N-O 3.17Å
128I94.1Very high91.9Very high1 Ų150.2 Ų50.21%0.00528%0.279CS..EExtended strand (participates in β ladder)trans-111.9142.4169.5-65-159000108.8L74 L82 L92 I94 V120 F121 V130 V143L74-I128 HydrophobicContact CD1-CD1 4.25Å; L74-I128 HydrophobicContact CD1-CG1 4.42Å; L74-I128 HydrophobicContact CD2-CD1 3.2Å; L74-I128 HydrophobicContact CD2-CG1 3.89Å; L74-I128 HydrophobicContact CG-CD1 3.95Å; L82-I128 HydrophobicContact CD1-CD1 4.24Å; L82-I128 HydrophobicContact CD1-CG1 4.32Å; L92-I128 HydrophobicContact CB-CG1 4.22Å; L92-I128 HydrophobicContact CD2-CD1 4.01Å; L92-I128 CarbonylContact O-C 3.57Å; L92-I128 VanDerWaalsContact O-CA 3.31Å; L92-I128 WeakPolarHBondContact O-CA 3.5Å; L92-I128 WeakPolarHBondContact O-CG2 3.47Å; I94-I128 HydrophobicContact CD1-CD1 4.29Å; I94-I128 HydrophobicContact CD1-CG2 3.64Å; I94-I128 HydrophobicContact CG1-CG2 3.94Å; V120-I128 CarbonylContact C-O 3.58Å; V120-I128 WeakPolarHBondContact CA-O 3.43Å; F121-I128 PolarHBondContact N-O 3.05Å; F121-I128 PolarHBondContact O-N 3.32Å; I128-V130 HydrophobicContact CG2-CG2 4.08Å; I128-V143 HydrophobicContact CD1-CG1 4.45Å
129I94.9Very high92Very high0 Ų052.3 Ų52.30%029%0.287CS..EExtended strand (participates in β ladder)trans-114.7137.5173.5-65.4172000108.1Y91 L92 R93 I94 K114 D118 R119 V120Y91-I129 HydrophobicContact CD1-CD1 4.17Å; Y91-I129 HydrophobicContact CD1-CG1 4.1Å; Y91-I129 HydrophobicContact CD2-CD1 3.85Å; Y91-I129 HydrophobicContact CG-CD1 3.48Å; Y91-I129 VanDerWaalsContact CG-CD1 3.48Å; Y91-I129 HydrophobicContact CG-CG1 3.86Å; L92-I129 PolarHBondContact O-N 2.96Å; R93-I129 CarbonylContact C-O 3.47Å; R93-I129 VanDerWaalsContact CA-O 3.3Å; R93-I129 WeakPolarHBondContact CA-O 3.5Å; I94-I129 PolarHBondContact N-O 2.99Å; K114-I129 HydrophobicContact CB-CD1 4.34Å; K114-I129 HydrophobicContact CD-CD1 4.49Å; K114-I129 HydrophobicContact CG-CD1 3.41Å; K114-I129 VanDerWaalsContact CG-CD1 3.41Å; K114-I129 HydrophobicContact CG-CG1 4.16Å; D118-I129 HydrophobicContact CB-CG2 3.4Å; D118-I129 WeakPolarHBondContact OD2-CG2 3.32Å; R119-I129 CarbonylContact O-C 3.59Å; R119-I129 WeakPolarHBondContact O-CA 3.48Å; V120-I129 HydrophobicContact CG2-CG1 4.36Å
130V94.8Very high92Very high0 Ų048.5 Ų48.50%028%0.282CS..EExtended strand (participates in β ladder)trans-130.6126.4174.1-173.80000108.7V72 I94 R119 F121 I128 L135 V138V72-V130 HydrophobicContact CG2-CG2 4.45Å; I94-V130 HydrophobicContact CB-CG2 4.32Å; I94-V130 HydrophobicContact CD1-CG2 4.44Å; R119-V130 PolarHBondContact N-O 2.64Å; R119-V130 PolarHBondContact O-N 3.25Å; F121-V130 HydrophobicContact CD2-CG2 3.9Å; F121-V130 HydrophobicContact CE2-CB 4.09Å; F121-V130 HydrophobicContact CE2-CG2 3.74Å; I128-V130 HydrophobicContact CG2-CG2 4.08Å; V130-L135 HydrophobicContact CB-CD1 4.46Å; V130-L135 HydrophobicContact CG1-CB 4.15Å; V130-L135 HydrophobicContact CG1-CD1 4.22Å; V130-V138 HydrophobicContact CG1-CG2 3.53Å; V130-V138 HydrophobicContact CG2-CG2 4.39Å
131D93.4Very high92.1Very high28 Ų2846 Ų4615%0.1527%0.266CS..  trans-65.2147.6177.9-53.510000109.6R93 Q95 E133 S134 L135R93-D131 WeakPolarHBondContact CD-OD1 3.38Å; R93-D131 WeakPolarHBondContact CG-OD1 3.21Å; R93-D131 IonicContact CZ-OD1 3.57Å; R93-D131 IonicContact NE-OD1 3.86Å; R93-D131 VanDerWaalsContact NH1-CG 3.31Å; R93-D131 IonicContact NH1-OD1 2.64Å; R93-D131 PolarHBondContact NH1-OD1 2.99Å; R93-D131 IonicContact NH1-OD2 3.59Å; Q95-D131 WeakPolarHBondContact CG-OD2 3.29Å; Q95-D131 PolarHBondContact NE2-OD2 2.73Å; D131-E133 VanDerWaalsContact C-N 3.29Å; D131-E133 PolarHBondContact O-N 2.83Å; D131-S134 CarbonylContact O-C 3.51Å; D131-S134 PolarHBondContact O-N 3.38Å; D131-L135 PolarHBondContact O-N 3.15Å
132Q91.5Very high92.1Very high76 Ų7645.8 Ų45.836%0.35527%0.268SS..Hα-helixtrans-56.4-41.4-177-176.358.842.800112.9E117 S134 L135E117-Q132 HydrophobicContact CB-CB 4.4Å; Q132-S134 VanDerWaalsContact C-N 3.34Å; Q132-L135 WeakPolarHBondContact O-CB 3.42Å; Q132-L135 PolarHBondContact O-N 2.8Å
133E91.6Very high92.4Very high164 Ų16439.3 Ų39.377%0.76624%0.238SC*.Hα-helixtrans-65.7-37.7176.4-61.6-176.2170.800112D131 F137D131-E133 VanDerWaalsContact C-N 3.29Å; D131-E133 PolarHBondContact O-N 2.83Å; E133-F137 WeakPolarHBondContact O-CD2 3.38Å; E133-F137 WeakPolarHBondContact O-CE2 3.41Å
134S93.8Very high92.6Very high6 Ų636.9 Ų36.94%0.04223%0.227CC..Hα-helixtrans-75.9-27.5-179.5-65.70000112.2Q95 V96 D131 Q132 E136 F137 V138Q95-S134 WeakPolarHBondContact CA-OG 3.33Å; V96-S134 PolarHBondContact N-OG 3.34Å; D131-S134 CarbonylContact O-C 3.51Å; D131-S134 PolarHBondContact O-N 3.38Å; Q132-S134 VanDerWaalsContact C-N 3.34Å; S134-E136 VanDerWaalsContact C-N 3.28Å; S134-E136 PolarHBondContact O-N 3.18Å; S134-F137 WeakPolarHBondContact O-CB 3.42Å; S134-F137 PolarHBondContact O-N 2.95Å; S134-V138 WeakPolarHBondContact O-CG2 3.41Å; S134-V138 PolarHBondContact O-N 3.08Å
135L93.2Very high93.1Very high4 Ų434.6 Ų34.62%0.02120%0.198CC..Hα-helixtrans-57-41.4-179.1-174.669.8000112R119 F121 V130 D131 Q132 F137 V138 K139R119-L135 HydrophobicContact CB-CD1 4.41Å; R119-L135 HydrophobicContact CG-CD1 4.47Å; R119-L135 HydrophobicContact CG-CD2 3.79Å; F121-L135 HydrophobicContact CE2-CD1 4.04Å; F121-L135 HydrophobicContact CZ-CD1 3.83Å; V130-L135 HydrophobicContact CB-CD1 4.46Å; V130-L135 HydrophobicContact CG1-CB 4.15Å; V130-L135 HydrophobicContact CG1-CD1 4.22Å; D131-L135 PolarHBondContact O-N 3.15Å; Q132-L135 WeakPolarHBondContact O-CB 3.42Å; Q132-L135 PolarHBondContact O-N 2.8Å; L135-F137 PolarHBondContact O-N 2.98Å; L135-V138 PolarHBondContact O-N 2.94Å; L135-V138 VanDerWaalsContact O-N 3.15Å; L135-K139 WeakPolarHBondContact O-CB 3.49Å; L135-K139 PolarHBondContact O-N 2.72Å
136E91.8Very high93.3Very high120 Ų12031.8 Ų31.856%0.56117%0.165SC*.Hα-helixtrans-60.4-28.3179.6-63.8-168.1174.400112.7S134 Q161S134-E136 VanDerWaalsContact C-N 3.28Å; S134-E136 PolarHBondContact O-N 3.18Å; E136-Q161 WeakPolarHBondContact O-CG 3.37Å
137F93Very high93.4Very high50 Ų5037.7 Ų37.722%0.21919%0.191CC..Hα-helixtrans-90.3-22.6179.3-60.1-70.6000113.7V96 F104 E133 S134 L135 N159 F172 V174V96-F137 HydrophobicContact CB-CB 4.38Å; V96-F137 HydrophobicContact CB-CD2 4.12Å; V96-F137 HydrophobicContact CB-CG 4.45Å; V96-F137 HydrophobicContact CG1-CB 4.31Å; V96-F137 HydrophobicContact CG1-CD2 4.1Å; V96-F137 HydrophobicContact CG1-CG 4.16Å; V96-F137 HydrophobicContact CG2-CB 3.92Å; F104-F137 HydrophobicContact CE1-CE1 4.35Å; F104-F137 HydrophobicContact CE1-CZ 4.23Å; F104-F137 HydrophobicContact CZ-CE1 4.36Å; E133-F137 WeakPolarHBondContact O-CD2 3.38Å; E133-F137 WeakPolarHBondContact O-CE2 3.41Å; S134-F137 WeakPolarHBondContact O-CB 3.42Å; S134-F137 PolarHBondContact O-N 2.95Å; L135-F137 PolarHBondContact O-N 2.98Å; F137-N159 PolarHBondContact O-ND2 2.9Å; F137-N159 PolarHBondContact O-OD1 3.1Å; F137-F172 HydrophobicContact CB-CZ 4.04Å; F137-F172 HydrophobicContact CD1-CZ 4.5Å; F137-V174 HydrophobicContact CD1-CG1 4.42Å; F137-V174 HydrophobicContact CD1-CG2 3.55Å; F137-V174 HydrophobicContact CE1-CG1 4.24Å; F137-V174 HydrophobicContact CE1-CG2 3.59Å
138V93.7Very high93.5Very high0 Ų042.9 Ų42.90%021%0.214CC..Hα-helixtrans-111.80.1-176-56.40000113.8V72 I94 V96 Y106 V130 S134 L135 G140 S141V72-V138 HydrophobicContact CG2-CG2 4.06Å; I94-V138 HydrophobicContact CG2-CG1 4.35Å; V96-V138 HydrophobicContact CG2-CG1 3.96Å; Y106-V138 HydrophobicContact CD1-CG1 4.36Å; Y106-V138 HydrophobicContact CE1-CG1 3.94Å; V130-V138 HydrophobicContact CG1-CG2 3.53Å; V130-V138 HydrophobicContact CG2-CG2 4.39Å; S134-V138 WeakPolarHBondContact O-CG2 3.41Å; S134-V138 PolarHBondContact O-N 3.08Å; L135-V138 PolarHBondContact O-N 2.94Å; L135-V138 VanDerWaalsContact O-N 3.15Å; V138-G140 PolarHBondContact O-N 2.92Å; V138-S141 WeakPolarHBondContact O-CB 3.32Å; V138-S141 PolarHBondContact O-N 2.8Å; V138-S141 PolarHBondContact O-OG 3.2Å
139K92.9Very high93.5Very high64 Ų6451.5 Ų51.528%0.27826%0.259SS..THydrogen-bonded Turntrans-57.2130.6177.765.5-179177.7-174.40111.7L135 S141 P160 Q161L135-K139 WeakPolarHBondContact O-CB 3.49Å; L135-K139 PolarHBondContact O-N 2.72Å; K139-S141 PolarHBondContact O-N 2.86Å; K139-P160 WeakPolarHBondContact O-CD 3.23Å; K139-P160 WeakPolarHBondContact O-CG 3.45Å; K139-Q161 HydrophobicContact CD-CG 4.45Å; K139-Q161 HydrophobicContact CG-CG 3.65Å
140G92.4Very high93.4Very high29 Ų2959.1 Ų59.130%0.29930%0.298SS..THydrogen-bonded Turntrans75.8-1.3-176.300000115.1K71 V138K71-G140 WeakPolarHBondContact O-CA 3.3Å; K71-G140 PolarHBondContact O-N 2.91Å; V138-G140 PolarHBondContact O-N 2.92Å
141S94.1Very high93.2Very high1 Ų164.3 Ų64.31%0.00732%0.318CS..  trans-77162.4-178.9740000112.7H73 V138 K139 V156H73-S141 PolarHBondContact N-O 3.42Å; V138-S141 WeakPolarHBondContact O-CB 3.32Å; V138-S141 PolarHBondContact O-N 2.8Å; V138-S141 PolarHBondContact O-OG 3.2Å; K139-S141 PolarHBondContact O-N 2.86Å; S141-V156 VanDerWaalsContact CB-CG1 3.49Å; S141-V156 WeakPolarHBondContact OG-CG1 3.47Å
142T93.9Very high93.2Very high30 Ų3066 Ų6618%0.18433%0.332CS..EExtended strand (participates in β ladder)trans-115116.7175.3-56.10000110.3H73 T75 L157H73-T142 HydrophobicContact CB-CG2 4.2Å; H73-T142 CarbonylContact O-C 3.56Å; H73-T142 VanDerWaalsContact O-CA 3.29Å; H73-T142 WeakPolarHBondContact O-CA 3.42Å; T75-T142 HydrophobicContact CG2-CG2 3.64Å; T142-L157 PolarHBondContact N-O 2.77Å; T142-L157 PolarHBondContact O-N 3.47Å
143V95Very high93.2Very high0 Ų064.2 Ų64.20%033%0.326CS..EExtended strand (participates in β ladder)trans-84.3126.8175.6-1740000109.4V72 H73 T75 I94 I128V72-V143 HydrophobicContact CG1-CG2 3.65Å; H73-V143 PolarHBondContact O-N 3.4Å; T75-V143 PolarHBondContact N-O 3.29Å; I94-V143 HydrophobicContact CD1-CG1 4.48Å; I94-V143 HydrophobicContact CD1-CG2 3.61Å; I128-V143 HydrophobicContact CD1-CG1 4.45Å
144D94.7Very high93.3Very high27 Ų2758 Ų5814%0.14430%0.296CS..EExtended strand (participates in β ladder)trans-126.6161.5-179.6-170.837.7000111.3T75 F154 Q155 L157T75-D144 VanDerWaalsContact CB-OD1 3.31Å; T75-D144 WeakPolarHBondContact CB-OD1 3.43Å; T75-D144 HydrophobicContact CG2-CB 3.7Å; T75-D144 WeakPolarHBondContact CG2-OD1 3.11Å; T75-D144 PolarHBondContact OG1-OD1 3.37Å; D144-F154 WeakPolarHBondContact O-CA 3.45Å; D144-Q155 HydrophobicContact CB-CG 4.02Å; D144-Q155 PolarHBondContact N-O 3.2Å; D144-Q155 PolarHBondContact O-N 3.12Å; D144-Q155 PolarHBondContact OD2-NE2 2.97Å; D144-L157 HydrophobicContact CB-CD1 3.69Å; D144-L157 HydrophobicContact CB-CG 4.13Å
145F95.1Very high93.3Very high20 Ų2059.6 Ų59.69%0.08830%0.304CS..EExtended strand (participates in β ladder)trans-122.5116.6173.8176.9-101.9000109.1C78 R81 Q147 F154C78-F145 HydrophobicContact CB-CB 4.29Å; R81-F145 HydrophobicContact CB-CB 4.43Å; R81-F145 HydrophobicContact CB-CD1 3.67Å; R81-F145 HydrophobicContact CB-CD2 4.43Å; R81-F145 HydrophobicContact CB-CE1 3.96Å; R81-F145 HydrophobicContact CB-CG 3.92Å; R81-F145 HydrophobicContact CB-CZ 4.46Å; R81-F145 HydrophobicContact CG-CD1 3.7Å; R81-F145 HydrophobicContact CG-CD2 4.04Å; R81-F145 HydrophobicContact CG-CE1 3.49Å; R81-F145 VanDerWaalsContact CG-CE1 3.49Å; R81-F145 HydrophobicContact CG-CE2 3.85Å; R81-F145 HydrophobicContact CG-CG 3.96Å; R81-F145 HydrophobicContact CG-CZ 3.57Å; F145-Q147 HydrophobicContact CE1-CB 3.84Å; F145-Q147 HydrophobicContact CZ-CB 4.41Å; F145-F154 HydrophobicContact CB-CD1 4.01Å; F145-F154 HydrophobicContact CB-CE1 3.99Å; F145-F154 AromaticContact CD2-CD1 3.71Å; F145-F154 HydrophobicContact CD2-CD1 3.71Å; F145-F154 HydrophobicContact CD2-CD2 4.37Å; F145-F154 AromaticContact CD2-CE1 3.55Å; F145-F154 HydrophobicContact CD2-CE1 3.55Å; F145-F154 HydrophobicContact CD2-CE2 4.23Å; F145-F154 HydrophobicContact CD2-CG 4.12Å; F145-F154 AromaticContact CD2-CZ 3.83Å; F145-F154 HydrophobicContact CD2-CZ 3.83Å; F145-F154 HydrophobicContact CE2-CE1 4.42Å; F145-F154 HydrophobicContact CE2-CE2 4.43Å; F145-F154 HydrophobicContact CE2-CZ 4.26Å; F145-F154 HydrophobicContact CG-CD1 4.32Å; F145-F154 HydrophobicContact CG-CE1 4.09Å
146S93.2Very high93.3Very high28 Ų2860 Ų6020%0.19631%0.306CS..EExtended strand (participates in β ladder)trans-100.9127.4175.7-173.80000109.9S152 T153S146-S152 WeakPolarHBondContact O-CA 3.08Å; S146-T153 PolarHBondContact N-O 2.87Å; S146-T153 PolarHBondContact O-N 2.84Å
147Q93.1Very high93.3Very high137 Ų13757.6 Ų57.664%0.6430%0.297SS*.EExtended strand (participates in β ladder)trans-118.4105.9173.9-178.5168.918.700109.1F145F145-Q147 HydrophobicContact CE1-CB 3.84Å; F145-Q147 HydrophobicContact CZ-CB 4.41Å
148E92.3Very high93.2Very high116 Ų11663.9 Ų63.954%0.54232%0.324SS..  trans-99.8170.5171.3-63175.2-163.900109.9I150 R151E148-I150 PolarHBondContact O-N 2.89Å; E148-R151 CarbonylContact C-O 3.54Å; E148-R151 WeakPolarHBondContact CA-O 3.45Å; E148-R151 PolarHBondContact N-O 3.32Å; E148-R151 PolarHBondContact O-N 3.05Å; E148-R151 VanDerWaalsContact O-O 3.12Å
149L94.8Very high93.2Very high182 Ų18264.8 Ų64.895%0.95333%0.329SS*.SBendtrans-58.6-34.4-177.5-154.891.5000113
150I93.4Very high93.2Very high160 Ų16065 Ų6582%0.82134%0.337SS*.SBendtrans-111.3-10.2-174.761.6164.6000113.6E148E148-I150 PolarHBondContact O-N 2.89Å
151R90.4Very high93.1Very high109 Ų10966.3 Ų66.341%0.41134%0.335SS..  trans-146.8137.9-171.7-176.3174.5176.5166.1-4.2111E148 T153E148-R151 CarbonylContact C-O 3.54Å; E148-R151 WeakPolarHBondContact CA-O 3.45Å; E148-R151 PolarHBondContact N-O 3.32Å; E148-R151 PolarHBondContact O-N 3.05Å; E148-R151 VanDerWaalsContact O-O 3.12Å; R151-T153 PolarHBondContact NH2-OG1 3.03Å
152S92.7Very high93Very high64 Ų6467.6 Ų67.645%0.44835%0.346SS..EExtended strand (participates in β ladder)trans-125.6123.9169.4-68.90000107.9S146S146-S152 WeakPolarHBondContact O-CA 3.08Å
153T92.7Very high92.9Very high37 Ų3770.4 Ų70.423%0.22736%0.36CS..EExtended strand (participates in β ladder)trans-150.5144.3-172.6-155.40000111.2S146 R151S146-T153 PolarHBondContact N-O 2.87Å; S146-T153 PolarHBondContact O-N 2.84Å; R151-T153 PolarHBondContact NH2-OG1 3.03Å
154F93.9Very high92.6Very high33 Ų3376.4 Ų76.415%0.14539%0.387CS..EExtended strand (participates in β ladder)trans-79.8139.7166.2-65.4-76.9000109L82 I85 L92 F108 D144 F145L82-F154 HydrophobicContact CD2-CE1 3.84Å; L82-F154 HydrophobicContact CD2-CZ 3.67Å; L82-F154 HydrophobicContact CG-CE1 4.18Å; L82-F154 HydrophobicContact CG-CZ 4.4Å; I85-F154 HydrophobicContact CD1-CE2 4.14Å; I85-F154 HydrophobicContact CD1-CZ 3.78Å; L92-F154 HydrophobicContact CD2-CD1 4.42Å; F108-F154 HydrophobicContact CD1-CB 4.14Å; F108-F154 HydrophobicContact CD2-CB 4.01Å; F108-F154 HydrophobicContact CE1-CB 4.04Å; F108-F154 HydrophobicContact CE2-CB 3.9Å; F108-F154 WeakPolarHBondContact CE2-O 3.4Å; F108-F154 HydrophobicContact CG-CB 4.12Å; F108-F154 HydrophobicContact CZ-CB 3.9Å; D144-F154 WeakPolarHBondContact O-CA 3.45Å; F145-F154 HydrophobicContact CB-CD1 4.01Å; F145-F154 HydrophobicContact CB-CE1 3.99Å; F145-F154 AromaticContact CD2-CD1 3.71Å; F145-F154 HydrophobicContact CD2-CD1 3.71Å; F145-F154 HydrophobicContact CD2-CD2 4.37Å; F145-F154 AromaticContact CD2-CE1 3.55Å; F145-F154 HydrophobicContact CD2-CE1 3.55Å; F145-F154 HydrophobicContact CD2-CE2 4.23Å; F145-F154 HydrophobicContact CD2-CG 4.12Å; F145-F154 AromaticContact CD2-CZ 3.83Å; F145-F154 HydrophobicContact CD2-CZ 3.83Å; F145-F154 HydrophobicContact CE2-CE1 4.42Å; F145-F154 HydrophobicContact CE2-CE2 4.43Å; F145-F154 HydrophobicContact CE2-CZ 4.26Å; F145-F154 HydrophobicContact CG-CD1 4.32Å; F145-F154 HydrophobicContact CG-CE1 4.09Å
155Q93.2Very high92.2Very high41 Ų4178 Ų7819%0.19241%0.411CS..EExtended strand (participates in β ladder)trans-139.2143.6-177.260.6-174.726.300109.8D144 L157D144-Q155 HydrophobicContact CB-CG 4.02Å; D144-Q155 PolarHBondContact N-O 3.2Å; D144-Q155 PolarHBondContact O-N 3.12Å; D144-Q155 PolarHBondContact OD2-NE2 2.97Å; Q155-L157 HydrophobicContact CG-CD2 4.25Å; Q155-L157 HydrophobicContact CG-CG 4.3Å
156V93.8Very high91.8Very high13 Ų1378.4 Ų78.48%0.07942%0.415CS..EExtended strand (participates in β ladder)trans-98.6119.6174.8-175.40000108.3Y106 F108 S141 N159Y106-V156 HydrophobicContact CD1-CB 4.42Å; Y106-V156 HydrophobicContact CD1-CG2 3.81Å; Y106-V156 HydrophobicContact CD2-CB 4.23Å; Y106-V156 HydrophobicContact CD2-CG2 4.12Å; Y106-V156 HydrophobicContact CE1-CB 4.08Å; Y106-V156 HydrophobicContact CE1-CG1 4.26Å; Y106-V156 HydrophobicContact CE1-CG2 3.91Å; Y106-V156 HydrophobicContact CE2-CB 3.86Å; Y106-V156 HydrophobicContact CE2-CG2 4.2Å; Y106-V156 HydrophobicContact CG-CB 4.49Å; Y106-V156 HydrophobicContact CG-CG2 3.92Å; F108-V156 HydrophobicContact CE1-CG2 4.37Å; F108-V156 HydrophobicContact CZ-CG2 3.95Å; S141-V156 VanDerWaalsContact CB-CG1 3.49Å; S141-V156 WeakPolarHBondContact OG-CG1 3.47Å; V156-N159 HydrophobicContact CG1-CB 4.33Å
157L91.6Very high91.5Very high69 Ų6983.3 Ų83.336%0.36145%0.449SS..EExtended strand (participates in β ladder)trans-110157.1179.9-57.9-178.7000110.7T142 D144 Q155 N159T142-L157 PolarHBondContact N-O 2.77Å; T142-L157 PolarHBondContact O-N 3.47Å; D144-L157 HydrophobicContact CB-CD1 3.69Å; D144-L157 HydrophobicContact CB-CG 4.13Å; Q155-L157 HydrophobicContact CG-CD2 4.25Å; Q155-L157 HydrophobicContact CG-CG 4.3Å; L157-N159 PolarHBondContact O-N 2.84Å; L157-N159 VanDerWaalsContact O-N 3.15Å
158K91.1Very high91Very high182 Ų18279.8 Ų79.879%0.79144%0.439SS*.SBendtrans50.141173.3-58.3-177.7178.4-178.70113.1P160K158-P160 VanDerWaalsContact O-CD 3.25Å; K158-P160 WeakPolarHBondContact O-CD 3.19Å
159N92.8Very high90.6Very high18 Ų1875.6 Ų75.610%0.09643%0.427CS..  trans-75.1114.3177.4-177.4-0000110Y106 F137 V156 L157 Q161 A162Y106-N159 PolarHBondContact OH-ND2 2.7Å; F137-N159 PolarHBondContact O-ND2 2.9Å; F137-N159 PolarHBondContact O-OD1 3.1Å; V156-N159 HydrophobicContact CG1-CB 4.33Å; L157-N159 PolarHBondContact O-N 2.84Å; L157-N159 VanDerWaalsContact O-N 3.15Å; N159-Q161 PolarHBondContact O-N 3.45Å; N159-Q161 WeakPolarHBondContact OD1-CB 3.09Å; N159-Q161 PolarHBondContact OD1-N 2.69Å; N159-A162 HydrophobicContact CB-CB 4Å; N159-A162 PolarHBondContact O-N 3.05Å
160P92.3Very high90.4Very high70 Ų7068.8 Ų68.846%0.45540%0.395SS..THydrogen-bonded Turntrans-71.3-15.3179.130.4-35.7000113.8K139 K158K139-P160 WeakPolarHBondContact O-CD 3.23Å; K139-P160 WeakPolarHBondContact O-CG 3.45Å; K158-P160 VanDerWaalsContact O-CD 3.25Å; K158-P160 WeakPolarHBondContact O-CD 3.19Å
161Q91.8Very high90.3Very high56 Ų5661.8 Ų61.826%0.26236%0.36SS..THydrogen-bonded Turntrans-87.4-16.2178.8-51.1-55.3-55.100112.7E136 K139 N159 K175E136-Q161 WeakPolarHBondContact O-CG 3.37Å; K139-Q161 HydrophobicContact CD-CG 4.45Å; K139-Q161 HydrophobicContact CG-CG 3.65Å; N159-Q161 PolarHBondContact O-N 3.45Å; N159-Q161 WeakPolarHBondContact OD1-CB 3.09Å; N159-Q161 PolarHBondContact OD1-N 2.69Å; Q161-K175 PolarHBondContact O-N 2.86Å; Q161-K175 VanDerWaalsContact O-N 3.08Å
162A92.2Very high90.5Very high27 Ų2756.7 Ų56.722%0.22334%0.341CS..EExtended strand (participates in β ladder)trans-87131.9176.600000110.2N159 F172 S173N159-A162 HydrophobicContact CB-CB 4Å; N159-A162 PolarHBondContact O-N 3.05Å; A162-F172 HydrophobicContact CB-CB 4.04Å; A162-F172 HydrophobicContact CB-CD2 3.6Å; A162-F172 HydrophobicContact CB-CE2 4.43Å; A162-F172 HydrophobicContact CB-CG 4.12Å; A162-S173 WeakPolarHBondContact CA-O 3.41Å
163D91.3Very high90.6Very high90 Ų9055.4 Ų55.448%0.48133%0.332SS..EExtended strand (participates in β ladder)trans-83.9-50.1172.6-168.341.1000110.4S173 K175D163-S173 PolarHBondContact N-O 3.44Å; D163-K175 HydrophobicContact CB-CB 4.17Å
164H88.4Confident90.5Very high126 Ų12655.6 Ų55.658%0.58333%0.333SS*.EExtended strand (participates in β ladder)trans-135.2138.5179.8-63.9-31.6000111.4F172 S173H164-F172 CarbonylContact O-C 3.47Å; H164-F172 VanDerWaalsContact O-CA 3.23Å; H164-F172 WeakPolarHBondContact O-CA 3.5Å; H164-F172 WeakPolarHBondContact O-CB 3.42Å; H164-S173 PolarHBondContact O-N 3.42Å
165G87Confident90.3Very high61 Ų6160.8 Ų60.863%0.62936%0.355SS*.EExtended strand (participates in β ladder)trans-107.4148.8175.700000112.2
166C86.9Confident89.5Confident28 Ų2868.5 Ų68.519%0.18941%0.405CS..  trans-70.6149.9169.6-175.10000110.5C168 G169 S171C166-C168 PolarHBondContact O-N 3.5Å; C166-C168 VanDerWaalsContact O-N 3.1Å; C166-C168 PolarHBondContact SG-SG 3.12Å; C166-G169 PolarHBondContact O-N 3.19Å; C166-S171 WeakPolarHBondContact CB-O 3.45Å; C166-S171 PolarHBondContact N-O 3.2Å
167S85.8Confident89.3Confident130 Ų13071.3 Ų71.391%0.90942%0.421SS*.THydrogen-bonded Turntrans-57.8-27.2-178.757.80000113.9
168C82.8Confident89.2Confident63 Ų6371.4 Ų71.443%0.42642%0.424SS..THydrogen-bonded Turntrans-88.11.8177.167.30000114.2C166 S170C166-C168 PolarHBondContact O-N 3.5Å; C166-C168 VanDerWaalsContact O-N 3.1Å; C166-C168 PolarHBondContact SG-SG 3.12Å; C168-S170 PolarHBondContact O-N 3.3Å; C168-S170 PolarHBondContact O-OG 2.78Å
169G84.5Confident89.1Confident28 Ų2865.2 Ų65.229%0.28940%0.404SS..SBendtrans66.56.8177.200000115.7C166C166-G169 PolarHBondContact O-N 3.19Å
170S89.4Confident88.8Confident40 Ų4068 Ų6828%0.2842%0.422SS..SBendtrans-94.1-14.6-174.9-49.50000113.4Q105 Y106 C168Q105-S170 WeakPolarHBondContact CA-O 3.41Å; Y106-S170 PolarHBondContact N-O 3.35Å; Y106-S170 VanDerWaalsContact N-O 3.12Å; C168-S170 PolarHBondContact O-N 3.3Å; C168-S170 PolarHBondContact O-OG 2.78Å
171S92.5Very high88.6Confident12 Ų1267.9 Ų67.98%0.08442%0.42CS..EExtended strand (participates in β ladder)trans-140.9155.2-177.4-53.60000111.6F104 C166F104-S171 CarbonylContact O-C 3.51Å; F104-S171 WeakPolarHBondContact O-CA 3.4Å; F104-S171 WeakPolarHBondContact O-CB 3.42Å; C166-S171 WeakPolarHBondContact CB-O 3.45Å; C166-S171 PolarHBondContact N-O 3.2Å
172F94.4Very high88.4Confident3 Ų368.7 Ų68.71%0.01343%0.43CS..EExtended strand (participates in β ladder)trans-151.5165.1-179.869.4-75.7000111.9V96 S102 F104 Y106 F137 A162 H164 V174V96-F172 HydrophobicContact CG1-CE1 3.98Å; V96-F172 HydrophobicContact CG1-CZ 3.84Å; V96-F172 HydrophobicContact CG2-CE1 4.47Å; V96-F172 HydrophobicContact CG2-CZ 4.43Å; S102-F172 CarbonylContact C-O 3.55Å; F104-F172 HydrophobicContact CB-CD1 4.12Å; F104-F172 HydrophobicContact CB-CE1 3.7Å; F104-F172 HydrophobicContact CB-CE2 4.3Å; F104-F172 HydrophobicContact CB-CZ 3.8Å; F104-F172 HydrophobicContact CG-CZ 4.47Å; F104-F172 PolarHBondContact N-O 3.5Å; F104-F172 PolarHBondContact O-N 3.4Å; Y106-F172 HydrophobicContact CD1-CD1 4.47Å; Y106-F172 AromaticContact CD1-CE1 3.93Å; Y106-F172 HydrophobicContact CD1-CE1 3.93Å; Y106-F172 HydrophobicContact CD2-CD1 4.13Å; Y106-F172 HydrophobicContact CD2-CE1 4.38Å; Y106-F172 AromaticContact CE1-CD1 3.81Å; Y106-F172 HydrophobicContact CE1-CD1 3.81Å; Y106-F172 AromaticContact CE1-CE1 3.32Å; Y106-F172 HydrophobicContact CE1-CE1 3.32Å; Y106-F172 AromaticContact CE1-CZ 3.97Å; Y106-F172 HydrophobicContact CE1-CZ 3.97Å; Y106-F172 AromaticContact CE2-CD1 3.41Å; Y106-F172 HydrophobicContact CE2-CD1 3.41Å; Y106-F172 VanDerWaalsContact CE2-CD1 3.41Å; Y106-F172 AromaticContact CE2-CE1 3.84Å; Y106-F172 HydrophobicContact CE2-CE1 3.84Å; Y106-F172 HydrophobicContact CE2-CG 4.25Å; Y106-F172 HydrophobicContact CG-CE1 4.42Å; Y106-F172 AromaticContact CZ-CD1 3.23Å; Y106-F172 AromaticContact CZ-CE1 3.27Å; Y106-F172 AromaticContact CZ-CG 4Å; Y106-F172 VanDerWaalsContact OH-CD1 3.3Å; Y106-F172 WeakPolarHBondContact OH-CD1 3.49Å; Y106-F172 WeakPolarHBondContact OH-CE1 3.15Å; F137-F172 HydrophobicContact CB-CZ 4.04Å; F137-F172 HydrophobicContact CD1-CZ 4.5Å; A162-F172 HydrophobicContact CB-CB 4.04Å; A162-F172 HydrophobicContact CB-CD2 3.6Å; A162-F172 HydrophobicContact CB-CE2 4.43Å; A162-F172 HydrophobicContact CB-CG 4.12Å; H164-F172 CarbonylContact O-C 3.47Å; H164-F172 VanDerWaalsContact O-CA 3.23Å; H164-F172 WeakPolarHBondContact O-CA 3.5Å; H164-F172 WeakPolarHBondContact O-CB 3.42Å; F172-V174 HydrophobicContact CD2-CG2 4.33Å; F172-V174 HydrophobicContact CE2-CG2 3.69Å; F172-V174 HydrophobicContact CZ-CG2 4.46Å
173S93.8Very high88.1Confident37 Ų3771.6 Ų71.626%0.25945%0.445SS..EExtended strand (participates in β ladder)trans-106.8139.1169.8-560000109.4S102 A162 D163 H164S102-S173 PolarHBondContact O-OG 3.4Å; A162-S173 WeakPolarHBondContact CA-O 3.41Å; D163-S173 PolarHBondContact N-O 3.44Å; H164-S173 PolarHBondContact O-N 3.42Å
174V92.1Very high87.9Confident40 Ų4070.2 Ų70.224%0.24244%0.442CS..EExtended strand (participates in β ladder)trans-81.7140.6179.9175.50000109.5F104 F137 F172 V176F104-V174 HydrophobicContact CD2-CB 4.33Å; F104-V174 HydrophobicContact CD2-CG2 3.39Å; F104-V174 HydrophobicContact CE2-CB 4.05Å; F104-V174 HydrophobicContact CE2-CG2 3.4Å; F104-V174 HydrophobicContact CG-CG2 4.12Å; F104-V174 HydrophobicContact CZ-CG2 4.13Å; F137-V174 HydrophobicContact CD1-CG1 4.42Å; F137-V174 HydrophobicContact CD1-CG2 3.55Å; F137-V174 HydrophobicContact CE1-CG1 4.24Å; F137-V174 HydrophobicContact CE1-CG2 3.59Å; F172-V174 HydrophobicContact CD2-CG2 4.33Å; F172-V174 HydrophobicContact CE2-CG2 3.69Å; F172-V174 HydrophobicContact CZ-CG2 4.46Å; V174-V176 PolarHBondContact O-N 3.35Å
175K88.2Confident87.9Confident142 Ų14265.6 Ų65.662%0.61743%0.431SS*.  trans-72.2117.1172.6-170.1176-178.2177.30109.6Q161 D163Q161-K175 PolarHBondContact O-N 2.86Å; Q161-K175 VanDerWaalsContact O-N 3.08Å; D163-K175 HydrophobicContact CB-CB 4.17Å
176V77Confident87.9Confident203 Ų20366 Ų66100%1.2341%0.413SS*.  trans-91.40177.1-164.40000110.4V174V174-V176 PolarHBondContact O-N 3.35Å

Retrieved 176 of 176 residues in 224.1 ms (Link to these results)