A0A087Y460_POEFO Loading...

Krueppel-like factor 15

AlphaFold DB , UniProt , Accession A0A087Y460, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 478 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
1M30.5Very low32.1Very low236 Ų236159.5 Ų159.5100%1.16383%0.827SS**  094.20-61.9162.5179.700104.7
2N30.6Very low32Very low152 Ų152154.5 Ų154.581%0.81383%0.826SS**  66.6127.289.2-87.842.8000111.4
3T35.9Very low32Very low108 Ų108152.9 Ų152.966%0.66383%0.825SS**  cis-143.5143.416.242.90000114.1
4D36.3Very low31.8Very low142 Ų142159.3 Ų159.376%0.75983%0.832SS**  trans42.1116.4136.1-50.8-60.4000122
5C29.9Very low32.7Very low137 Ų137156.9 Ų156.993%0.92683%0.83SS**  trans-85.2121.6152-710000109.8
6R31.5Very low32.5Very low209 Ų209151.9 Ų151.979%0.78983%0.828SS**  trans-92.8115.4179.9-175.8178.9175.8125.8-0.6111.1H8R6-H8 PolarHBondContact NE-NE2 3.48Å
7I33.2Very low32.3Very low157 Ų157153.4 Ų153.481%0.80583%0.831SS**  trans-74.5138.8169.4-63169.3000108.7
8H30.6Very low32.4Very low144 Ų144152.8 Ų152.867%0.66783%0.832SS**  trans-111.8129.6161.3-95.5-113.3000108.7R6R6-H8 PolarHBondContact NE-NE2 3.48Å
9A31.3Very low32.3Very low89 Ų89152.5 Ų152.574%0.73683%0.83SS**  trans-111.9142.616200000107.2
10E31.8Very low32.2Very low197 Ų197153.1 Ų153.192%0.92183%0.833SS**  trans-105.9122.2175-66.4-177.9111.200108.4
11E31.6Very low32.2Very low184 Ų184151.2 Ų151.286%0.8683%0.83SS**  trans-96.7151.2176.2-66.7-168.3133.400111.1
12A31.4Very low32.9Very low99 Ų99145.7 Ų145.782%0.81881%0.812SS**  trans-78.8142.1178.500000111.8
13V31.1Very low33Very low134 Ų134143 Ų14381%0.81281%0.811SS**  trans-110.1134.1179.21770000110.7
14W29.3Very low32.7Very low242 Ų242143.7 Ų143.792%0.91782%0.82SS**  trans-123.9138.5168.4-83.362.5000109.6
15P45Very low32.3Very low123 Ų123140.2 Ų140.280%0.79982%0.819SS**  trans-107.7154.6179.438.3-32.2000114.6
16G30.8Very low32.4Very low78 Ų78142.5 Ų142.580%0.80482%0.815SS**  trans107.8104.2172.800000113.4
17M28.3Very low32.3Very low177 Ų177138.5 Ų138.587%0.87281%0.814SS**  cis91.794.525.1-164.2-178.7-178.400115.2
18V34.2Very low32.3Very low142 Ų142136.4 Ų136.486%0.86181%0.814SS**  -173.5150.3118.7-87.40000110.6
19D30.6Very low32.3Very low147 Ų147137.2 Ų137.279%0.78682%0.822SS**  trans-82.9157.4-175.2-53.8-94.4000115
20N29.8Very low33Very low165 Ų165138.1 Ų138.188%0.88282%0.821SS**  trans-163144.3135.8-105.6-61.3000112.4
21S32.4Very low32.9Very low113 Ų113136.2 Ų136.279%0.7982%0.816SS**  trans-165.5144.7176.8-83.10000107.6
22P45.8Very low32.8Very low120 Ų120133.2 Ų133.278%0.77982%0.815SS**  -154.7168.783.741.1-23.1000117.1
23A31.7Very low32.6Very low95 Ų95134 Ų13479%0.78581%0.813SS**  trans60.7150146.300000119.8
24S30.7Very low32.5Very low123 Ų123133.4 Ų133.486%0.8682%0.815SS**  cis-168.8148-10.544.60000109.2
25G28Very low32.5Very low70 Ų70130.1 Ų130.172%0.72282%0.815SS**  trans165.3103.5169.400000116.2
26E30.8Very low31.6Very low184 Ų184136.1 Ų136.186%0.8682%0.821SS**  trans10.7139132.8-67.5161.7-138.700118.5
27T30.6Very low31.6Very low125 Ų125136.6 Ų136.677%0.76782%0.818SS**  cis-164.5171.615.510.70000112.7
28S31.6Very low31.5Very low113 Ų113139 Ų13979%0.7982%0.819SS**  trans84123.2156.973.70000120.7
29L30.9Very low31.3Very low162 Ų162137.6 Ų137.685%0.84882%0.815SS**  trans-106.2175157.9-76.5172.6000106.9
30P46Very low31.9Very low108 Ų108136.3 Ų136.370%0.70181%0.814SS**  cis-142.316317.742.9-24.1000119
31L30.8Very low31.9Very low157 Ų157135.8 Ų135.882%0.82281%0.811SS**  trans19.7130.1136.2-53.8170000120.2
32S29.5Very low31.7Very low120 Ų120136.1 Ų136.184%0.83980%0.804SS**  -154.5142113.9600000112
33C25.7Very low30.9Very low116 Ų116139.3 Ų139.378%0.78481%0.811SS**  trans-113.7140.9166.9-60.60000108.5
34S29Very low30.8Very low121 Ų121140.7 Ų140.785%0.84681%0.809SS**  174.8134.4120.4-80.10000114.3
35L30.3Very low30.9Very low174 Ų174139.5 Ų139.591%0.91180%0.801SS**  trans-26.8137.9156-66.8150000116.3
36R26.8Very low30.9Very low248 Ų248142.9 Ų142.994%0.93680%0.802SS**  -150.2142.5127.3-135.1167-174.2149.32.5111.7
37A29.2Very low30.9Very low88 Ų88142.4 Ų142.473%0.72781%0.805SS**  trans-94.8155.8-178.100000111.9
38Y27.8Very low30.8Very low229 Ų229139.7 Ų139.790%0.89880%0.802SS**  trans-139.7142.9159.6-98.1-83.1000110.2
39S28.8Very low30.7Very low112 Ų112140.3 Ų140.378%0.78381%0.806SS**  trans-105.7160.7170.8-68.20000109.9
40P43.3Very low30.7Very low119 Ų119143.4 Ų143.477%0.77381%0.808SS**  trans-95.6155.7-152.536.4-36.5000114.9
41L30.8Very low29.8Very low155 Ų155146.8 Ų146.881%0.81281%0.814SS**  trans-144.9143.7151.2-82.9-175.9000111.4
42D27.2Very low29.7Very low119 Ų119145.4 Ų145.464%0.63681%0.812SS**  trans42.6109.8151-52.9-37.6000121.6
43M28.3Very low29.7Very low188 Ų188146.5 Ų146.593%0.92681%0.807SS**  -135.8138.7129.8-88.8-66.5103.100109.2
44V31.4Very low30Very low124 Ų124146.3 Ų146.375%0.75280%0.804SS**  trans-125.4134.7-178.2-176.30000108.9
45S31.3Very low29.9Very low98 Ų98145.5 Ų145.569%0.68580%0.799SS**  trans161.3137.9139.4-94.80000112.1
46D27.9Very low30.4Very low140 Ų140142.3 Ų142.375%0.74979%0.788SS**  trans47.6129145.7-54.5-46.1000119.6
47L31.8Very low30.5Very low175 Ų175140.3 Ų140.392%0.91679%0.787SS**  cis-152.4169.537.1-71.9165.1000111.6
48G27.3Very low30.6Very low68 Ų68141.3 Ų141.370%0.70179%0.789SS**  trans130.459.7153.800000117.5Y50G48-Y50 PolarHBondContact O-N 3.11Å
49S31.5Very low30.9Very low125 Ų125138.3 Ų138.387%0.87479%0.788SS**  trans-64.8119.7179.5-48.90000113.7
50Y29Very low31.2Very low228 Ų228140 Ų14089%0.89479%0.789SS**  trans-119.2120.5159.4-99.3-88.2000110.7G48 V52G48-Y50 PolarHBondContact O-N 3.11Å; Y50-V52 PolarHBondContact O-N 3.1Å
51Q28.6Very low30.5Very low179 Ų179140.6 Ų140.684%0.83679%0.785SS**  trans-70.9114179.7-76.9-86.210.400110.9
52V28.4Very low30.7Very low128 Ų128139.1 Ų139.178%0.77678%0.782SS**  trans-91.4111.5162.7177.60000107.9Y50 P54Y50-V52 PolarHBondContact O-N 3.1Å; V52-P54 VanDerWaalsContact O-CD 3.24Å; V52-P54 WeakPolarHBondContact O-CD 3.28Å
53I29.8Very low30.7Very low142 Ų142138.2 Ų138.273%0.72879%0.785SS**  trans-71.5117.3175.8-58.2174000108.9S55I53-S55 PolarHBondContact O-N 3.06Å
54P32.3Very low30.7Very low113 Ų113135.3 Ų135.373%0.73478%0.778SS**  trans-89.4102.31748.811000109.1V52 P56V52-P54 VanDerWaalsContact O-CD 3.24Å; V52-P54 WeakPolarHBondContact O-CD 3.28Å; P54-P56 VanDerWaalsContact O-CD 3.31Å; P54-P56 WeakPolarHBondContact O-CD 3.37Å
55S26.7Very low30.6Very low104 Ų104137.1 Ų137.173%0.72778%0.782SS**  trans-72.1117.5172.4-66.40000110.7I53I53-S55 PolarHBondContact O-N 3.06Å
56P39.4Very low30.4Very low107 Ų107138.1 Ų138.170%0.69579%0.79SS**  trans-90.9126.2-176.634-30.5000111.5P54P54-P56 VanDerWaalsContact O-CD 3.31Å; P54-P56 WeakPolarHBondContact O-CD 3.37Å
57F30Very low30.4Very low205 Ų205137.2 Ų137.290%0.89979%0.794SS**  trans-140.592.7162.4-85.2-70.2000110.9
58S30Very low30.9Very low110 Ų110134.8 Ų134.877%0.76979%0.789SS**  trans-84127.9164.7-55.90000109.3D60S58-D60 VanDerWaalsContact C-N 3.27Å; S58-D60 PolarHBondContact O-N 3.16Å
59D35.3Very low31Very low165 Ų165143.7 Ų143.788%0.88280%0.801SS**SBendtrans-77.873.3169.3-90.6-56.1000110.3
60D35.2Very low30.8Very low149 Ų149143.1 Ų143.180%0.79780%0.797SS**  trans-150.3115.6165.9-102.6-43.8000110.8S58S58-D60 VanDerWaalsContact C-N 3.27Å; S58-D60 PolarHBondContact O-N 3.16Å
61D28.5Very low30.5Very low131 Ų131138.8 Ų138.870%0.70180%0.799SS**  trans-142.8110.1171.7-155.3-34000109.3S63D61-S63 PolarHBondContact OD1-N 2.91Å; D61-S63 PolarHBondContact OD1-OG 3.34Å
62V35.3Very low30.4Very low124 Ų124135.4 Ų135.475%0.75280%0.795SS**  trans-120.571.2176-176.50000107.4V64V62-V64 PolarHBondContact O-N 3.36Å
63S26.9Very low30.4Very low100 Ų100134.7 Ų134.770%0.69980%0.796SS**  trans-75.9101.4179.7-1.10000110.4D61D61-S63 PolarHBondContact OD1-N 2.91Å; D61-S63 PolarHBondContact OD1-OG 3.34Å
64V28.9Very low30.8Very low127 Ų127133.8 Ų133.877%0.7780%0.799SS**  trans-112.5130.6165.6178.80000108V62V62-V64 PolarHBondContact O-N 3.36Å
65L29.2Very low30.6Very low161 Ų161137.1 Ų137.184%0.84381%0.805SS**  trans-71136.1-179.1-66.880.3000111.1
66S27.2Very low30.6Very low120 Ų120137.4 Ų137.484%0.83981%0.806SS**  -173.4131.1121.6-80.40000111.8
67S27.8Very low31.1Very low120 Ų120137.5 Ų137.584%0.83981%0.807SS**  trans-104.2172.5169.5-420000108.7
68P41.3Very low30.8Very low124 Ų124135 Ų13581%0.80580%0.799SS**  -109.1166-124.539.3-32.3000114.7
69R29.2Very low30.7Very low255 Ų255136 Ų13696%0.96279%0.794SS**  trans-136.2131.5155.1-74.1-163172.1-149.4-4.3111.7
70S26.9Very low30.2Very low114 Ų114132.9 Ų132.980%0.79779%0.786SS**  trans-82.4148.4172.650.50000112
71C24.6Very low29.8Very low137 Ų137131.8 Ų131.893%0.92679%0.789SS**  trans-154.5160.1143.8-107.60000108.8
72S25.7Very low29.7Very low107 Ų107130.3 Ų130.375%0.74879%0.79SS**  trans-119.7158.6-161.1-50.40000113.8
73S28.8Very low29.2Very low114 Ų114130.7 Ų130.780%0.79780%0.796SS**  trans74.7159.7156.8-49.70000117.3
74P38.4Very low29.1Very low122 Ų122129.3 Ų129.379%0.79280%0.798SS**  cis-133.3173.5-45.337.5-23.3000112.6
75E26.7Very low29Very low184 Ų184128.9 Ų128.986%0.8680%0.801SS**  trans-87.4130.2173.6-67.6176.27200112.8
76S28.3Very low29Very low109 Ų109126.7 Ų126.776%0.76280%0.799SS**  trans56.2172.4132.8-55.10000121.1
77P48Very low29.1Very low110 Ų110125.6 Ų125.671%0.71479%0.791SS**  cis-117.7-175.5-22.234.6-17.4000112
78E24.9Very low29.1Very low153 Ų153125.6 Ų125.672%0.71579%0.791SS**  174.1146.7116.4-93.5-68.768.600115.3
79L26.9Very low28.6Very low130 Ų130123.9 Ų123.968%0.68179%0.787SS**  trans57.295.8150.1-62.9171000123.3
80S25.4Very low28.7Very low100 Ų100120.4 Ų120.470%0.69978%0.782SS**  9216410583.20000123
81S27.8Very low28.9Very low125 Ų125119 Ų11987%0.87477%0.772SS**  trans92.4148.5163.778.80000119
82S25.8Very low29.3Very low101 Ų101120.9 Ų120.971%0.70677%0.767SS**  trans-116.4173.6-152.655.30000114.1
83C24.3Very low29.6Very low131 Ų131123.6 Ų123.689%0.88577%0.773SS**  trans65.2157.6161.982.20000117.1
84G24.1Very low29.7Very low72 Ų72123.2 Ų123.274%0.74277%0.771SS**  cis-154.9-171.83.800000113
85S27.9Very low29.3Very low118 Ų118125.1 Ų125.183%0.82577%0.773SS**  trans-76178.6-164.3-480000116.1
86S28.6Very low29.3Very low115 Ų115124.5 Ų124.580%0.80477%0.774SS**  trans83.5148.4160.179.60000118.4
87S28.6Very low29.5Very low96 Ų96125.6 Ų125.667%0.67177%0.772SS**  cis-173.9153.5-23.550.20000111.2
88S28.2Very low29Very low120 Ų120127 Ų12784%0.83977%0.768SS**  trans66.8152.7155.6-58.70000117.6
89A31Very low29.2Very low88 Ų88126.2 Ų126.273%0.72777%0.768SS**  cis-145.3-168.4-22.800000105.8
90E31.2Very low29.3Very low182 Ų182127.2 Ų127.285%0.8577%0.774SS**  cis-166.6165.632.9-71.5-173.4102.400106.8
91S31.4Very low29.4Very low85 Ų85127 Ų12759%0.59477%0.772SS**  cis-162.3137.4-17.9-97.80000111.3
92Q33.7Very low29.6Very low176 Ų176129.1 Ų129.182%0.82277%0.768SS**  trans61.6110.4140.5-59.5-179.4-000122.4
93D32.3Very low29.7Very low164 Ų164130.7 Ų130.788%0.87777%0.774SS**  trans-73.1160.2144.5-77.2-69.3000111.7
94S30.6Very low29.9Very low106 Ų106129.2 Ų129.274%0.74176%0.764SS**  trans-153.888.9170.4-780000114.8
95I29.5Very low30.2Very low162 Ų162134.2 Ų134.283%0.83177%0.773SS**  trans18117.7135.8-53163.8000117.9
96L27.4Very low30.1Very low172 Ų172132.2 Ų132.290%0.90177%0.771SS**  -164.5164.6117.9-115168.2000111.9
97D32.3Very low30.1Very low132 Ų132132.9 Ų132.971%0.70678%0.776SS**  trans-135.6172.2-163.9-160.5-26.9000111.1
98H36.2Very low30.1Very low139 Ų139133.2 Ų133.264%0.64479%0.785SS**  trans104.2111.1147.9-91.827.7000123.1
99L29.9Very low30Very low136 Ų136131.2 Ų131.271%0.71278%0.783SS**  trans77.2132.3137.8-58.5171.7000119
100L28.5Very low29.9Very low152 Ų152139.1 Ų139.180%0.79679%0.794SS**  -161.2155.166.1-97.8170000115.7
101S28.5Very low29.7Very low94 Ų94137.2 Ų137.266%0.65780%0.795SS**  trans69.5153.2161.5-51.90000117.2
102Q32.1Very low29.5Very low171 Ų171139 Ų13980%0.79981%0.807SS**  cis-138.4154.415.5-67-86.7-19.800112.4
103T26.9Very low29.1Very low134 Ų134135.1 Ų135.182%0.82281%0.806SS**  trans-142.8161.914868.40000107
104S29.6Very low28.8Very low99 Ų99132 Ų13269%0.69280%0.802SS**  cis-153.5-153.114.365.60000110.7
105L29.1Very low28.6Very low177 Ų177135.1 Ų135.193%0.92781%0.81SS**  trans74.7140.5-178.2-51.6169.2000115
106G26.5Very low28.6Very low76 Ų76135.6 Ų135.678%0.78481%0.809SS**  cis-167.3159.2-4.700000111.1
107S29.3Very low28.8Very low129 Ų129133.4 Ų133.490%0.90280%0.804SS**  trans-88.4137.6-165.456.90000115.9
108A27.9Very low28.6Very low103 Ų103134.5 Ų134.585%0.85181%0.81SS**  trans-147.5127.1153.600000109.9
109G27Very low28.2Very low79 Ų79134.2 Ų134.281%0.81481%0.813SS**  trans-78.8159.4-17700000113.7
110R28.6Very low28Very low253 Ų253132.5 Ų132.596%0.95582%0.819SS**  trans-122.7143.7161.6-80.8-170171.8-171.9-1.9110.5
111V26.2Very low27.8Very low142 Ų142133.8 Ų133.886%0.86182%0.818SS**  trans-83.1141.1-166.8-161.70000110.6A113V111-A113 PolarHBondContact O-N 3.17Å
112S27.2Very low27.6Very low122 Ų122136.9 Ų136.985%0.85382%0.822SS**  trans-65.2121.7165.7-58.90000110.2
113A25.8Very low27.3Very low96 Ų96138.2 Ų138.279%0.79382%0.82SS**  trans-126.6107.3166.100000107.9V111V111-A113 PolarHBondContact O-N 3.17Å
114A26.7Very low27.2Very low98 Ų98136.2 Ų136.281%0.8180%0.804SS**  trans-77.6133.1175.800000110
115L26.2Very low27.1Very low171 Ų171137.5 Ų137.590%0.89581%0.813SS**  trans-133.2118.8163.7-80.1175.3000107.7
116E29.1Very low27.1Very low173 Ų173139.1 Ų139.181%0.80881%0.807SS**  trans-77.7133.8-175.8-59.2-172.9131.700111.7L118E116-L118 PolarHBondContact O-N 2.92Å
117P31.9Very low27.4Very low125 Ų125138.9 Ų138.981%0.81280%0.804SS**  trans-80.6105.816731.3-30.8000110.2N119P117-N119 PolarHBondContact O-N 3.32Å
118L28.1Very low27.5Very low156 Ų156138 Ų13882%0.81779%0.789SS**  trans-57.3117-179.9-74.2167.4000113.3E116E116-L118 PolarHBondContact O-N 2.92Å
119N27.4Very low27.7Very low132 Ų132135.7 Ų135.771%0.70678%0.776SS**  trans39.578.7156.4-78.4-20.4000118P117 F121P117-N119 PolarHBondContact O-N 3.32Å; N119-F121 VanDerWaalsContact C-N 3.35Å; N119-F121 HydrophobicContact CB-CD2 4.36Å; N119-F121 PolarHBondContact O-N 3.25Å
120A26.2Very low28Very low101 Ų101138.2 Ų138.284%0.83578%0.777SS**  trans-72.386156.300000110.7Q122A120-Q122 PolarHBondContact O-N 3.28Å
121F24.6Very low28.2Very low178 Ų178131.5 Ų131.578%0.78177%0.769SS**  trans-70.688.7178.5-117-84.5000112.1N119 W123N119-F121 VanDerWaalsContact C-N 3.35Å; N119-F121 HydrophobicContact CB-CD2 4.36Å; N119-F121 PolarHBondContact O-N 3.25Å; F121-W123 PolarHBondContact O-N 3.5Å
122Q24.5Very low28.5Very low160 Ų160134.4 Ų134.475%0.74877%0.77SS**  trans-78.1108170.8175.2176.1-29.300109.6A120 D124A120-Q122 PolarHBondContact O-N 3.28Å; Q122-D124 PolarHBondContact NE2-OD2 3.38Å; Q122-D124 PolarHBondContact O-N 3.45Å
123W24.6Very low28.7Very low198 Ų198137.4 Ų137.475%0.7577%0.771SS**  trans-93.698.8174.7-146.5-28.7000110.5F121 S125F121-W123 PolarHBondContact O-N 3.5Å; W123-S125 PolarHBondContact O-N 3.27Å
124D24.3Very low28.7Very low93 Ų93141.2 Ų141.250%0.49777%0.772SS.*  trans-64.6123.6169.8-106.7-73.6000110.1Q122 R126Q122-D124 PolarHBondContact NE2-OD2 3.38Å; Q122-D124 PolarHBondContact O-N 3.45Å; D124-R126 VanDerWaalsContact C-N 3.26Å; D124-R126 PolarHBondContact O-N 2.68Å
125S28.1Very low29.1Very low125 Ų125141.9 Ų141.987%0.87477%0.768SS**  trans-83.970176.2-59.70000110.4W123W123-S125 PolarHBondContact O-N 3.27Å
126R30.1Very low29.2Very low212 Ų212140.1 Ų140.180%0.876%0.764SS**  trans-114.2143.5169.8-64.5-174-177.7-156.3-1.3109D124 D128D124-R126 VanDerWaalsContact C-N 3.26Å; D124-R126 PolarHBondContact O-N 2.68Å; R126-D128 PolarHBondContact O-N 3.15Å
127G31.3Very low29.2Very low70 Ų70140.2 Ų140.272%0.72277%0.765SS**  trans-53.1128.7-155.700000116.8G129G127-G129 PolarHBondContact O-N 3.34Å
128D31.8Very low29.1Very low111 Ų111143.4 Ų143.459%0.59477%0.769SS**  trans-56.7126.1150.5-79.6-21.1000108.1R126 K411R126-D128 PolarHBondContact O-N 3.15Å; D128-K411 IonicContact OD2-NZ 3.23Å; D128-K411 PolarHBondContact OD2-NZ 2.73Å
129G32.1Very low29.1Very low55 Ų55144 Ų14457%0.56777%0.767SS**  trans-74.3175.5165.600000112G127 S131G127-G129 PolarHBondContact O-N 3.34Å; G129-S131 PolarHBondContact O-N 2.9Å
130P33.2Very low29.2Very low131 Ų131145.6 Ų145.685%0.85178%0.776SS**  trans-70.9104.1178.829.1-33.9000111.4K132P130-K132 PolarHBondContact O-N 3.01Å
131S33.8Very low29.3Very low112 Ų112149 Ų14978%0.78377%0.772SS**  trans-62.8114.4164-61.50000109.6G129G129-S131 PolarHBondContact O-N 2.9Å
132K30.8Very low29.4Very low203 Ų203148.4 Ų148.488%0.88378%0.777SS**  trans-69.2135.8162-63.9-179.5178.8-177.50108.6P130P130-K132 PolarHBondContact O-N 3.01Å
133H32.5Very low29.5Very low185 Ų185149.5 Ų149.586%0.85678%0.78SS**  trans-142.4141.1159.7-110.7-90.4000108.1
134E26.7Very low29.6Very low176 Ų176147.8 Ų147.882%0.82278%0.784SS**  trans-74.7162.2174.6-85.1-175.6125.500111.6
135P33.4Very low29.8Very low112 Ų112149.1 Ų149.173%0.72780%0.796SS**  trans-64.5148.7-174.726.6-35.8000112.7
136V29.4Very low29.8Very low135 Ų135155 Ų15582%0.81880%0.799SS**  trans-115135.8154.8176.30000104.8
137E28.5Very low29.7Very low175 Ų175149.3 Ų149.382%0.81879%0.792SS**  trans-50.2142.6-169.1-59.1-65.592.800113.6
138E29.9Very low29.8Very low191 Ų191153.2 Ų153.289%0.89380%0.797SS**  trans-84.8128.6177.5-61.6-176.4130.400110.4
139E28Very low29.8Very low169 Ų169154.1 Ų154.179%0.7981%0.806SS**  trans-112133.2159.5-71.5-164.7156.200109.4F141E139-F141 PolarHBondContact O-N 3.31Å
140D30.4Very low29.8Very low166 Ų166160.5 Ų160.589%0.88882%0.821SS**  trans-68.888-166.7-79.1-60.9000114.4N142D140-N142 PolarHBondContact O-N 3.45Å
141F28Very low29.9Very low173 Ų173160.9 Ų160.976%0.75982%0.821SS**  trans-87.8100.5164.3-84.1-85.1000111.6E139 F143E139-F141 PolarHBondContact O-N 3.31Å; F141-F143 VanDerWaalsContact O-CD2 3.31Å; F141-F143 WeakPolarHBondContact O-CD2 3.42Å; F141-F143 PolarHBondContact O-N 3.47Å
142N27Very low29.7Very low164 Ų164160 Ų16088%0.87782%0.821SS**  trans-58.4111-171.4-154-9.4000113D140 L144D140-N142 PolarHBondContact O-N 3.45Å; N142-L144 PolarHBondContact O-N 3.31Å
143F26.1Very low29.8Very low184 Ų184159.3 Ų159.381%0.80782%0.82SS**  trans-83.4107.8-176.4-94.3-92.8000112.6F141 T145F141-F143 VanDerWaalsContact O-CD2 3.31Å; F141-F143 WeakPolarHBondContact O-CD2 3.42Å; F141-F143 PolarHBondContact O-N 3.47Å; F143-T145 PolarHBondContact O-N 2.76Å; F143-T145 VanDerWaalsContact O-N 3.12Å
144L27.1Very low29.9Very low161 Ų161159.5 Ų159.584%0.84382%0.822SS**  trans-62.2112.2162.1-79.7171.1000110N142 W146N142-L144 PolarHBondContact O-N 3.31Å; L144-W146 PolarHBondContact O-N 3.49Å; L144-W146 VanDerWaalsContact O-N 3.17Å
145T27.7Very low30.1Very low122 Ų122159.2 Ų159.275%0.74883%0.825SS**  trans-74105.7-173.644.50000111.7F143 S147F143-T145 PolarHBondContact O-N 2.76Å; F143-T145 VanDerWaalsContact O-N 3.12Å; T145-S147 PolarHBondContact O-N 2.94Å
146W27.4Very low30.1Very low247 Ų247158.4 Ų158.494%0.93684%0.837SS**  trans-71.469.1166-90.556.4000111.1L144L144-W146 PolarHBondContact O-N 3.49Å; L144-W146 VanDerWaalsContact O-N 3.17Å
147S29.7Very low30Very low93 Ų93155.1 Ų155.165%0.6583%0.831SS**  trans-13052.2179.6-175.30000110.8T145T145-S147 PolarHBondContact O-N 2.94Å
148N32.1Very low29.9Very low153 Ų153152.8 Ų152.882%0.81883%0.833SS**  trans-160.871.2169.2-96.6-29000111.8
149V31.4Very low29.8Very low129 Ų129152.6 Ų152.678%0.78283%0.83SS**  trans-139.954.4163.2-164.80000109.7
150E32.9Very low30Very low190 Ų190152.7 Ų152.789%0.88883%0.83SS**SBendtrans-141.832174.4-157152.9-132.300112.9
151T35.2Very low30.4Very low138 Ų138147.9 Ų147.985%0.84781%0.808SS**  trans-142.875.9171-28.10000111.2
152A28.8Very low31.3Very low95 Ų95143 Ų14379%0.78579%0.792SS**  trans-137.124.3-177.400000114.6
153E34.1Very low32.1Very low187 Ų187141.3 Ų141.387%0.87478%0.783SS**  trans-107.772172.3-70.8-163.3128.700111.9
154Q34.8Very low32.9Very low190 Ų190139.9 Ų139.989%0.88878%0.779SS**SBendtrans-162.3-9.7158.7-127.5151.2100.500118.9
155L29.8Very low33.6Very low169 Ų169136.7 Ų136.789%0.88576%0.759SS**  trans-124121175.2-69.1176.3000111G157L155-G157 PolarHBondContact O-N 2.94Å; L155-G157 VanDerWaalsContact O-N 3.11Å
156G33.2Very low34.3Very low96 Ų96134.4 Ų134.499%0.9974%0.742SS**  trans-76.593.5178.700000111.8
157G28Very low35.2Very low66 Ų66128.5 Ų128.568%0.6872%0.724SS**  trans-146.2116.8172.900000110.9L155 F159L155-G157 PolarHBondContact O-N 2.94Å; L155-G157 VanDerWaalsContact O-N 3.11Å; G157-F159 VanDerWaalsContact C-N 3.33Å; G157-F159 PolarHBondContact O-N 3.34Å
158S26.7Very low36Very low125 Ų125130.2 Ų130.287%0.87472%0.722SS**  trans-81.376-179.8580000111.3H160S158-H160 PolarHBondContact O-N 3.36Å
159F27.5Very low36.2Very low187 Ų187129.2 Ų129.282%0.8271%0.711SS**  trans-82.5107.7167.7-121.4-89.8000109.5G157G157-F159 VanDerWaalsContact C-N 3.33Å; G157-F159 PolarHBondContact O-N 3.34Å
160H32.9Very low37Very low171 Ų171127.5 Ų127.579%0.79270%0.697SS**  trans-12489.3177.9-147.2-59.1000106.4S158 T162S158-H160 PolarHBondContact O-N 3.36Å; H160-T162 PolarHBondContact O-N 2.94Å
161P38.7Very low37.8Very low66 Ų66126 Ų12643%0.42969%0.69SS.*  trans-58.5137.5-176.223.7-33.2000109.9I166P161-I166 HydrophobicContact CB-CD1 4.37Å; P161-I166 HydrophobicContact CB-CG1 4.22Å; P161-I166 HydrophobicContact CG-CD1 4.25Å; P161-I166 HydrophobicContact CG-CG1 4.46Å
162T46.4Very low38.2Very low70 Ų70126.5 Ų126.543%0.42968%0.682SS.*  trans-69.8164.7175.863.40000110.4H160 E164 E165 I166H160-T162 PolarHBondContact O-N 2.94Å; T162-E164 PolarHBondContact O-N 3.09Å; T162-E165 VanDerWaalsContact CB-OE2 3.32Å; T162-E165 WeakPolarHBondContact CB-OE2 3.43Å; T162-E165 WeakPolarHBondContact CG2-OE2 3.24Å; T162-E165 PolarHBondContact N-OE2 3.03Å; T162-E165 WeakPolarHBondContact OG1-CG 3.5Å; T162-E165 PolarHBondContact OG1-N 3.35Å; T162-E165 PolarHBondContact OG1-OE2 3.13Å; T162-I166 WeakPolarHBondContact O-CG1 3.47Å; T162-I166 PolarHBondContact O-N 2.89Å
163L44.2Very low38.9Very low128 Ų128127 Ų12767%0.6767%0.672SS**Hα-helixtrans-65.8-28.4176.8-89163000112.3I166 E167L163-I166 PolarHBondContact O-N 3.46Å; L163-E167 WeakPolarHBondContact O-CG 3.21Å; L163-E167 PolarHBondContact O-N 3.44Å
164E42.7Very low39.3Very low155 Ų155125.1 Ų125.172%0.72467%0.665SS**Hα-helixtrans-71.5-46.1-179.9-66.5167.4162.600110.6T162 I166 E167 E168T162-E164 PolarHBondContact O-N 3.09Å; E164-I166 PolarHBondContact O-N 3.14Å; E164-E167 PolarHBondContact O-N 3.25Å; E164-E167 VanDerWaalsContact O-N 3.11Å; E164-E168 WeakPolarHBondContact O-CB 3.37Å; E164-E168 PolarHBondContact O-N 3.04Å
165E40.7Very low39.7Very low93 Ų93124.6 Ų124.644%0.43566%0.663SS.*Hα-helixtrans-61.2-27173.4-68.4162.211900113.3T162 F169T162-E165 VanDerWaalsContact CB-OE2 3.32Å; T162-E165 WeakPolarHBondContact CB-OE2 3.43Å; T162-E165 WeakPolarHBondContact CG2-OE2 3.24Å; T162-E165 PolarHBondContact N-OE2 3.03Å; T162-E165 WeakPolarHBondContact OG1-CG 3.5Å; T162-E165 PolarHBondContact OG1-N 3.35Å; T162-E165 PolarHBondContact OG1-OE2 3.13Å; E165-F169 WeakPolarHBondContact O-CB 3.45Å; E165-F169 PolarHBondContact O-N 3.02Å
166I44.1Very low39.5Very low75 Ų75123.7 Ų123.739%0.38566%0.656SS.*Hα-helixtrans-81.1-33.7176.2-65.6168.2000111.4P161 T162 L163 E164 L170P161-I166 HydrophobicContact CB-CD1 4.37Å; P161-I166 HydrophobicContact CB-CG1 4.22Å; P161-I166 HydrophobicContact CG-CD1 4.25Å; P161-I166 HydrophobicContact CG-CG1 4.46Å; T162-I166 WeakPolarHBondContact O-CG1 3.47Å; T162-I166 PolarHBondContact O-N 2.89Å; L163-I166 PolarHBondContact O-N 3.46Å; E164-I166 PolarHBondContact O-N 3.14Å; I166-L170 HydrophobicContact CG2-CD1 4.2Å; I166-L170 WeakPolarHBondContact O-CB 3.38Å; I166-L170 WeakPolarHBondContact O-CD1 3.39Å; I166-L170 VanDerWaalsContact O-CG 3.22Å; I166-L170 WeakPolarHBondContact O-CG 3.38Å; I166-L170 PolarHBondContact O-N 3.37Å
167E46Very low39.2Very low122 Ų122125.7 Ų125.757%0.5765%0.648SS**Hα-helixtrans-74.8-41.3176.2-73.1178.4168.700110.6L163 E164 L170 E171L163-E167 WeakPolarHBondContact O-CG 3.21Å; L163-E167 PolarHBondContact O-N 3.44Å; E164-E167 PolarHBondContact O-N 3.25Å; E164-E167 VanDerWaalsContact O-N 3.11Å; E167-L170 PolarHBondContact O-N 2.84Å; E167-L170 VanDerWaalsContact O-N 3.13Å; E167-E171 PolarHBondContact O-N 2.86Å
168E45.6Very low39.2Very low130 Ų130128.1 Ų128.161%0.60765%0.65SS**Hα-helixtrans-57.9-49.8173-172.6170-140.400112.1E164 L170 E171 E172E164-E168 WeakPolarHBondContact O-CB 3.37Å; E164-E168 PolarHBondContact O-N 3.04Å; E168-L170 PolarHBondContact O-N 3.13Å; E168-E171 PolarHBondContact O-N 2.87Å; E168-E171 VanDerWaalsContact O-N 3.11Å; E168-E172 PolarHBondContact O-N 3.48Å
169F36.3Very low39.3Very low132 Ų132128 Ų12858%0.57964%0.644SS**Hα-helixtrans-62.5-27.1176.5-175.2-96.2000113.5E165 N173E165-F169 WeakPolarHBondContact O-CB 3.45Å; E165-F169 PolarHBondContact O-N 3.02Å; F169-N173 PolarHBondContact O-ND2 3.24Å
170L48.4Very low39.3Very low92 Ų92127.6 Ų127.648%0.48264%0.642SS.*Hα-helixtrans-82.4-25.5175.9-75.2171.1000113I166 E167 E168 M174I166-L170 HydrophobicContact CG2-CD1 4.2Å; I166-L170 WeakPolarHBondContact O-CB 3.38Å; I166-L170 WeakPolarHBondContact O-CD1 3.39Å; I166-L170 VanDerWaalsContact O-CG 3.22Å; I166-L170 WeakPolarHBondContact O-CG 3.38Å; I166-L170 PolarHBondContact O-N 3.37Å; E167-L170 PolarHBondContact O-N 2.84Å; E167-L170 VanDerWaalsContact O-N 3.13Å; E168-L170 PolarHBondContact O-N 3.13Å; L170-M174 WeakPolarHBondContact O-CE 3.49Å; L170-M174 WeakPolarHBondContact O-CG 3.49Å
171E49.4Very low39.1Very low158 Ų158128.2 Ų128.274%0.73865%0.645SS**Hα-helixtrans-81.4-39.8175.5-69.1-170.5164.300111.8E167 E168 N173E167-E171 PolarHBondContact O-N 2.86Å; E168-E171 PolarHBondContact O-N 2.87Å; E168-E171 VanDerWaalsContact O-N 3.11Å; E171-N173 VanDerWaalsContact C-N 3.27Å; E171-N173 PolarHBondContact O-N 2.98Å
172E43.1Very low38.7Very low149 Ų149132.7 Ų132.770%0.69666%0.66SS**Hα-helixtrans-62.4-29.8174.4-73-163.2132.100113.6E168E168-E172 PolarHBondContact O-N 3.48Å
173N44.3Very low37.8Very low105 Ų105132.9 Ų132.956%0.56168%0.676SS**THydrogen-bonded Turntrans-100.520.9-172.7-71.5-87.6000114.3F169 E171F169-N173 PolarHBondContact O-ND2 3.24Å; E171-N173 VanDerWaalsContact C-N 3.27Å; E171-N173 PolarHBondContact O-N 2.98Å
174M43.3Very low36.8Very low149 Ų149135.8 Ų135.873%0.73468%0.684SS**  trans-129.324.5179.3-72.6-158.9-61.200115.2L170L170-M174 WeakPolarHBondContact O-CE 3.49Å; L170-M174 WeakPolarHBondContact O-CG 3.49Å
175E41.7Very low36.1Very low178 Ų178136.2 Ų136.283%0.83269%0.691SS**  trans-69.7136.8170.6-77.9-145.9122.400113.4
176M26.9Very low35.5Very low150 Ų150137.8 Ų137.874%0.73971%0.707SS**  trans64.8103.6168-57.9-151.7-6300119.7
177V25.9Very low34.5Very low138 Ų138137.5 Ų137.584%0.83672%0.723SS**  -129.895.1104.9-176.40000109.1V179V177-V179 HydrophobicContact CG1-CG2 4.13Å
178T29Very low34.4Very low117 Ų117137.4 Ų137.472%0.71873%0.732SS**  trans-98.897.9167.940.30000109.2K180T178-K180 PolarHBondContact O-N 3.25Å; T178-K180 VanDerWaalsContact O-N 3.12Å
179V28.2Very low33.6Very low124 Ų124139.7 Ų139.775%0.75274%0.743SS**  trans-66113172.8179.70000108.6V177 Q181V177-V179 HydrophobicContact CG1-CG2 4.13Å; V179-Q181 PolarHBondContact O-N 2.8Å; V179-Q181 VanDerWaalsContact O-N 3.09Å
180K27.8Very low33.2Very low177 Ų177141.6 Ų141.677%0.7775%0.754SS**  trans-68103.1165.3-81.1-172172.5-171.80108.9T178 E182T178-K180 PolarHBondContact O-N 3.25Å; T178-K180 VanDerWaalsContact O-N 3.12Å; K180-E182 PolarHBondContact O-N 3.2Å
181Q29.1Very low32.2Very low185 Ų185143.5 Ų143.586%0.86477%0.769SS**  trans-88.394.4165.8-164.6169.316.900107.6V179V179-Q181 PolarHBondContact O-N 2.8Å; V179-Q181 VanDerWaalsContact O-N 3.09Å
182E29.7Very low31.1Very low159 Ų159146.4 Ų146.474%0.74378%0.78SS**  trans-69.5147.3173.3-63.9-165.2161.800110.1K180K180-E182 PolarHBondContact O-N 3.2Å
183G27.5Very low30.4Very low74 Ų74142.4 Ų142.476%0.76378%0.779SS**  trans-69.2140.2-157.400000114.7
184F23.8Very low29.7Very low189 Ų189144.6 Ų144.683%0.82979%0.79SS**  trans-123.989.4164-159.9-93.4000108.4V186F184-V186 HydrophobicContact CD1-CG2 3.6Å; F184-V186 HydrophobicContact CE1-CG2 3.69Å
185D27Very low29Very low164 Ų164146.2 Ų146.288%0.87780%0.796SS**  trans-66.6132.1176.2-88.4-69000110.9
186V27.5Very low28.4Very low126 Ų126141.3 Ų141.376%0.76479%0.793SS**  trans-139.5118.1172.5-177.20000110F184F184-V186 HydrophobicContact CD1-CG2 3.6Å; F184-V186 HydrophobicContact CE1-CG2 3.69Å
187G24.2Very low28.5Very low70 Ų70137.7 Ų137.772%0.72279%0.794SS**  trans163.4136.5166.300000113.3
188P44.1Very low28.6Very low119 Ų119139 Ų13977%0.77380%0.795SS**  cis-124-175-20.238-21.3000113
189E28.1Very low28.6Very low179 Ų179141.9 Ų141.984%0.83680%0.801SS**  trans6.4131.7155.8-55.4175132.900118
190E27.2Very low28.5Very low172 Ų172141.4 Ų141.480%0.80480%0.802SS**  -174156.875.7-87.7-163.6126.600114.1
191T28.4Very low28.4Very low131 Ų131138.8 Ų138.880%0.80481%0.805SS**  trans62.1136.5156.356.50000122.4
192F27.1Very low28.4Very low219 Ų219141.6 Ų141.696%0.96181%0.807SS**  trans-87.8148.6160.8-89.8-104.7000110.9
193G27Very low28.3Very low66 Ų66138 Ų13868%0.6880%0.804SS**  trans-176.4113.1166.100000116.5
194L30.5Very low28.5Very low151 Ų151139.3 Ų139.379%0.79180%0.802SS**  trans68.7125.5156.2-49.2179.7000117.1
195E28.4Very low28.6Very low182 Ų182136 Ų13685%0.8580%0.797SS**  65.7133.599.1-58.9-177.4126.600115.4
196G28.3Very low28.7Very low75 Ų75133 Ų13377%0.77379%0.79SS**  cis166.5144.3-5.200000113
197G28.8Very low28.8Very low75 Ų75134.6 Ų134.677%0.77379%0.789SS**  trans65.3-175.6177.100000115.2
198L28.1Very low29Very low164 Ų164137.7 Ų137.786%0.85979%0.788SS**  cis-169.5162.7-28.3-118.9170.3000107.5
199E30.3Very low28.2Very low179 Ų179140.3 Ų140.384%0.83679%0.787SS**  trans63.8125.9171.1-58.1-178135.500116.9
200C25.4Very low28.2Very low113 Ų113139.5 Ų139.576%0.76479%0.788SS**  cis96.410323.7-163.80000115
201C27Very low28.5Very low123 Ų123139.5 Ų139.583%0.83179%0.788SS**  trans60.4155.5164.8-64.60000116.8
202R27.8Very low29.7Very low243 Ų243138.5 Ų138.592%0.91778%0.784SS**  cis-15716326.7-154.1176.6-161.5154.33110.1
203A27.7Very low29.8Very low83 Ų83135.4 Ų135.469%0.68678%0.777SS**  trans-76.5153.717300000112.8
204S31.5Very low30.2Very low102 Ų102136 Ų13671%0.71378%0.775SS**  168.9145.7109.2-85.20000116.2
205T27Very low30.2Very low119 Ų119138.3 Ų138.373%0.7378%0.779SS**  trans59.3128.5141.757.70000123.3
206S28.4Very low30.4Very low103 Ų103138.4 Ų138.472%0.7278%0.779SS**  trans68.5148.713173.50000119.1
207E30.4Very low30.5Very low159 Ų159139 Ų13974%0.74377%0.771SS**  cis-167169.7-9-131.8-165.711500109.4
208L27.6Very low30.7Very low135 Ų135141.8 Ų141.871%0.70777%0.769SS**  trans64.7159.1158.3-61.8158.9000116.8
209K28.1Very low31.2Very low173 Ų173141.4 Ų141.475%0.75276%0.762SS**  cis-172.6148.4-24.8174.6157.4-177.7165.50108.5
210L27.8Very low31.2Very low162 Ų162139 Ų13985%0.84876%0.76SS**  trans164.7129.4134.5-88.5160.7000113.4
211E32.6Very low31.6Very low173 Ų173140 Ų14081%0.80876%0.762SS**  trans-106.5154.5159.8-75.2-99122.500106.6
212P54.7Low32.7Very low110 Ų110139.1 Ų139.171%0.71476%0.755SS**  -143.7-171.775.240.2-19.5000112.7
213D28.7Very low33.1Very low154 Ų154135.5 Ų135.582%0.82475%0.753SS**  cis-157.8171.228.4-141.2-43.2000113.8
214A34.7Very low33.2Very low78 Ų78135.9 Ų135.965%0.64576%0.755SS**  trans-116.2174-156.800000116.9
215K30.8Very low33.2Very low199 Ų199134.3 Ų134.387%0.86576%0.755SS**  trans-172.8121.2144.7-104149.6-167.3170.50116.1
216H32.4Very low33.5Very low185 Ų185135.5 Ų135.586%0.85676%0.762SS**  trans56150.8145.5-86.419.5000121
217S30.3Very low34.1Very low87 Ų87134.7 Ų134.761%0.60876%0.757SS**  cis-168148.4-5.445.50000111.2
218D33.6Very low34.2Very low133 Ų133134 Ų13471%0.71176%0.759SS**  trans52.8146.4145.3-70.621.9000121.2
219Q38.1Very low35.6Very low156 Ų156133 Ų13373%0.72976%0.76SS**  cis-161.6171.62.4-126.6176.368.500111.6
220T29.9Very low36Very low130 Ų130129.4 Ų129.480%0.79876%0.762SS**  trans76.8138.7161.214.20000121.8
221V35.6Very low36.1Very low132 Ų132130.1 Ų130.180%0.876%0.764SS**  trans-151.1138.1178.7161.90000106.9
222P50.3Low36.3Very low106 Ų106126.1 Ų126.169%0.68876%0.76SS**  -158.1138.5117.736-15.4000119.1
223I34.2Very low35.4Very low167 Ų167125 Ų12586%0.85676%0.76SS**  63.7141.9126.9-58.4168.4000118.3
224A31.4Very low35.7Very low90 Ų90125.2 Ų125.274%0.74476%0.76SS**  cis-129.5-176.217.100000111.9
225G31.3Very low36.9Very low69 Ų69126.4 Ų126.471%0.71176%0.762SS**  cis92.7134.817.900000112
226T32.6Very low37Very low144 Ų144123.3 Ų123.388%0.88376%0.759SS**  cis-148.7178.712570000113.2
227S41.1Very low37Very low86 Ų86119.3 Ų119.360%0.60175%0.752SS**  trans-79.6170.9171.543.50000113
228D33.3Very low37Very low146 Ų146125.5 Ų125.578%0.78177%0.768SS**  176.917871.1-97.1-60.8000113.7
229P57.2Low36.9Very low113 Ų113124 Ų12473%0.73477%0.774SS**  trans-124.4175.4-171.443.7-32.4000118.6
230A35.1Very low36.4Very low97 Ų97122.2 Ų122.280%0.80278%0.779SS**  trans82138147.800000123.9
231M30.9Very low36.2Very low178 Ų178120.7 Ų120.788%0.87777%0.773SS**  trans-163.7124.7157.7-90.5-69.3-172.300106.2
232A37Very low36Very low89 Ų89120.8 Ų120.874%0.73677%0.774SS**  74134.175.600000115.5
233A34.5Very low35.1Very low86 Ų86122.7 Ų122.771%0.71178%0.778SS**  cis-170.2150.8-9.800000114.9
234L34.8Very low35.6Very low158 Ų158120.1 Ų120.183%0.82777%0.772SS**  trans68.8167.2147.4-73.3172.9000121.7
235P60.9Low35.5Very low104 Ų104121.8 Ų121.868%0.67577%0.773SS**  cis-138.2146.6-11.225.4-1.6000119.3
236V33.5Very low35.4Very low133 Ų133126.4 Ų126.481%0.80678%0.776SS**  trans68.9148.1131.6179.80000119.5
237S31.3Very low35Very low101 Ų101127 Ų12771%0.70677%0.769SS**  cis-152.8144.112.228.20000115.5
238K30.4Very low34.4Very low217 Ų217128 Ų12894%0.94378%0.776SS**  trans39.7160.1139.2-72.8-176.4175179.10123.6
239A30.6Very low34.3Very low102 Ų102127.5 Ų127.584%0.84378%0.778SS**  trans-134.8165.5-170.600000113.8
240S28.5Very low33Very low119 Ų119127 Ų12783%0.83278%0.783SS**  trans177.2158.7136-161.60000114.1
241S26Very low32.6Very low97 Ų97125.8 Ų125.868%0.67878%0.78SS**  trans85.6109.3141.3-1540000123.3
242V30.5Very low32.6Very low135 Ų135122.1 Ų122.182%0.81878%0.778SS**  trans72.2140.7130.5174.60000121.5
243N31.2Very low32.4Very low146 Ų146127.7 Ų127.778%0.78179%0.786SS**  trans-94.6150174-147.33.1000109
244P45.6Very low32.4Very low112 Ų112132.9 Ų132.973%0.72779%0.792SS**  -155.4-165.871.843.6-22.3000116.2
245T29.3Very low32.2Very low125 Ų125131.7 Ų131.777%0.76779%0.792SS**  trans-55.6147.5172.551.30000117.1
246H28.6Very low30.5Very low166 Ų166131.5 Ų131.577%0.76979%0.793SS**  -156.7172.5121.9-144.9-93.7000113.5
247E23.8Very low30.3Very low157 Ų157130.7 Ų130.773%0.73479%0.788SS**  trans-77169.5-174.1-56.6177101.800116.6
248S29.5Very low30.1Very low106 Ų106132.9 Ų132.974%0.74179%0.792SS**  trans-54.5167.3163.354.90000116
249V31Very low30.4Very low137 Ų137131.6 Ų131.683%0.8379%0.787SS**  -170.2142.2128.11350000114
250A29Very low30.9Very low102 Ų102132.1 Ų132.184%0.84378%0.781SS**  trans58.8142.5160.600000122.2
251G26.8Very low31.1Very low72 Ų72131.3 Ų131.374%0.74278%0.776SS**  cis163.5-174.9-9.900000117.2
252A30.9Very low31.3Very low101 Ų101134.7 Ų134.784%0.83579%0.786SS**  trans68.9140.4175.900000116
253K34Very low31.4Very low205 Ų205136.6 Ų136.689%0.89179%0.786SS**  cis-131.8167.77.5-69178.2178.7174.40112.2
254K35Very low31.2Very low196 Ų196136.4 Ų136.485%0.85279%0.785SS**  trans-79168168.2-52.5176-176.9178.50109.3
255T28.9Very low30.6Very low133 Ų133141.6 Ų141.682%0.81679%0.789SS**  cis-157.7171.637.644.70000114.5
256S26.1Very low30.8Very low99 Ų99140.8 Ų140.869%0.69279%0.789SS**  trans-44165.8163.5-142.60000114.9
257T29.2Very low30.8Very low116 Ų116139.2 Ų139.271%0.71279%0.791SS**  -172.1152.855.1-34.20000114.7
258N27.5Very low31.2Very low148 Ų148136.7 Ų136.779%0.79179%0.791SS**  trans18.6131.3156.8-67.4-23.3000124.9
259K37Very low31.2Very low189 Ų189136.7 Ų136.782%0.82279%0.791SS**  32.2123.7128.8-155.5-167.4-177.4-173.60120.4
260P41.6Very low31.3Very low113 Ų113136 Ų13673%0.73479%0.792SS**  -136169.4110.843.6-33.6000110.8
261S31Very low31.4Very low103 Ų103134.4 Ų134.472%0.7279%0.786SS**  cis75.1111.629.7-146.80000115.1
262L30Very low31.8Very low168 Ų168137.7 Ų137.788%0.8879%0.792SS**  trans-158137.1168.9-108.3167000111.1
263E33.3Very low32.1Very low175 Ų175138.6 Ų138.682%0.81879%0.789SS**  trans-112.8-175.8161.1-64.6-174.5102.200108.3
264D27.7Very low31.9Very low142 Ų142135 Ų13576%0.75978%0.784SS**  trans65.3151.2173.3-80.5-29.2000117.9
265R33.1Very low31.6Very low220 Ų220133 Ų13383%0.8378%0.781SS**  cis-158.1154.2-28.3-164.3161.6173.4164.7-4.3110.8
266S32.3Very low31.7Very low109 Ų109133 Ų13376%0.76278%0.78SS**  trans-42136.9-178.8-36.90000119.1
267T29.2Very low31.8Very low133 Ų133134.9 Ų134.982%0.81678%0.778SS**  trans-150.2119.6140.541.40000113.6
268S31.1Very low32Very low104 Ų104137.7 Ų137.773%0.72779%0.787SS**  trans22.3130144.461.70000123.1
269S31.4Very low32.3Very low105 Ų105137.8 Ų137.873%0.73478%0.783SS**  130140112.171.80000118.2
270S31.8Very low32.1Very low122 Ų122134.6 Ų134.685%0.85378%0.781SS**  trans69154.6156.278.20000120.8
271G30.5Very low31.5Very low69 Ų69137.5 Ų137.571%0.71179%0.789SS**  trans87.880.5144.900000118.8
272T36.2Very low31.5Very low142 Ų142143.1 Ų143.187%0.87179%0.794SS**PPolyproline II helixtrans-54138.8164.947.80000114.5
273P36.7Very low31.5Very low119 Ų119142 Ų14277%0.77379%0.794SS**PPolyproline II helixtrans-100.2159.5147.734.8-30000112.4
274V29.4Very low31.4Very low131 Ų131143 Ų14379%0.79480%0.796SS**PPolyproline II helixtrans-71.1139.8-169.2175.60000113.5V276V274-V276 HydrophobicContact CG1-CG2 4.04Å
275I30.1Very low31.6Very low154 Ų154143.8 Ų143.879%0.7980%0.795SS**PPolyproline II helixtrans-97.8130.5163.4-59.9173.4000108.9
276V29.7Very low31.6Very low132 Ų132139.2 Ų139.280%0.878%0.783SS**  trans-120.1129.1162176.50000108.5V274V274-V276 HydrophobicContact CG1-CG2 4.04Å
277Q28.3Very low32.1Very low139 Ų139140 Ų14065%0.6579%0.785SS**  trans-87.7156.7179.1-63.6178.2-29.100111.8
278I33.2Very low32.3Very low174 Ų174138.6 Ų138.689%0.89278%0.777SS**  trans-119.4137.7146.2-62.5-179.2000106.8
279Q33.8Very low32.3Very low151 Ų151141.2 Ų141.271%0.70678%0.782SS**  trans-97.4154.4-167.4-66.4-172.912.400113.5
280P33.6Very low32.4Very low121 Ų121141.5 Ų141.579%0.78678%0.779SS**  trans-77.4153.9170.333.5-35.7000112.3
281I28.7Very low33Very low174 Ų174141.8 Ų141.889%0.89278%0.778SS**  trans-104.1136.2174.9-62.3-179.8000110.3
282R31.6Very low33.1Very low221 Ų221145.1 Ų145.183%0.83478%0.784SS**  trans-83.3156.6-173.4-73.2168.5152.1166.7-9.4114
283V29.8Very low33.1Very low144 Ų144144.2 Ų144.287%0.87378%0.779SS**  trans-128.6110.6143.6-173.70000111.1
284K30.5Very low33.1Very low197 Ų197144.4 Ų144.486%0.85778%0.78SS**  trans20.3111.5159.6-64.1179.7178.3178.70122.1
285Q33.1Very low33.2Very low159 Ų159142.8 Ų142.874%0.74378%0.781SS**  trans-64.6163.2137.4-102.3175.4-71.600111.3
286E32.7Very low33.6Very low124 Ų124139.7 Ų139.758%0.57978%0.778SS**  cis-154.4-143.8-10.3-150.8-171.1104.300107.8T288E286-T288 WeakPolarHBondContact OE1-CB 3.21Å; E286-T288 PolarHBondContact OE1-N 2.89Å; E286-T288 PolarHBondContact OE1-OG1 3.26Å
287P42.5Very low34.3Very low124 Ų124139 Ų13981%0.80578%0.776SS**  cis-122.7166.914.842.6-27000117.3
288T34.6Very low34.7Very low104 Ų104138.8 Ų138.864%0.63879%0.787SS**  trans-84.5144.1179.2-65.30000115.7E286E286-T288 WeakPolarHBondContact OE1-CB 3.21Å; E286-T288 PolarHBondContact OE1-N 2.89Å; E286-T288 PolarHBondContact OE1-OG1 3.26Å
289L30.1Very low34.7Very low159 Ų159136 Ų13683%0.83278%0.782SS**  trans-144.7119.1153-80-176.5000113.4
290T33.2Very low35Very low112 Ų112137.6 Ų137.669%0.68779%0.79SS**  trans33.1141150.453.50000123.3
291P44.4Very low34.9Very low128 Ų128137.9 Ų137.983%0.83179%0.792SS**  trans-79.8154-18035-37000114.3
292V32.1Very low35.2Very low138 Ų138132.4 Ų132.484%0.83678%0.779SS**  trans-133.5141.4172.2-177.10000110.7
293T37Very low35.5Very low123 Ų123128.5 Ų128.576%0.75578%0.782SS**PPolyproline II helixtrans-56.5144.1-177.8-46.60000113.7A295T293-A295 PolarHBondContact O-N 3.04Å
294P37.6Very low35.5Very low123 Ų123128.7 Ų128.780%0.79978%0.783SS**PPolyproline II helixtrans-62.9129.1172.326.3-35.3000112
295A31.5Very low35.7Very low98 Ų98123.8 Ų123.881%0.8177%0.774SS**PPolyproline II helixtrans-85.8161.1176.300000112.5T293T293-A295 PolarHBondContact O-N 3.04Å
296A38.5Very low35.7Very low89 Ų89123 Ų12374%0.73678%0.775SS**PPolyproline II helixtrans-67.5156.7-177.500000113.6
297P43.8Very low35.7Very low118 Ų118124.6 Ų124.677%0.76679%0.786SS**PPolyproline II helixtrans-65148.517727.7-36.1000112.3
298P36Very low35.2Very low133 Ų133128.4 Ų128.486%0.86479%0.789SS**PPolyproline II helixtrans-66.6136.7179.727.3-34.3000112.1
299S33.6Very low35.1Very low115 Ų115129.6 Ų129.680%0.80479%0.79SS**PPolyproline II helixtrans-74.1162.8177.246.50000113
300Q39.3Very low35.3Very low185 Ų185126.2 Ų126.286%0.86479%0.786SS**PPolyproline II helixtrans-63145.6-178.4-62.8-179.5-1000112.9
301P32Very low35.4Very low127 Ų127129.1 Ų129.183%0.82579%0.791SS**PPolyproline II helixtrans-71.3129.2161.530.6-32.1000110.4
302G35.1Very low35Very low60 Ų60130.3 Ų130.362%0.61979%0.79SS**  trans-75.5-179172.200000113.5V304G302-V304 PolarHBondContact O-N 2.77Å
303P38.1Very low35.2Very low138 Ų138128.8 Ų128.890%0.89678%0.777SS**PPolyproline II helixtrans-70130.9-175.329-34.9000112.4
304V30.1Very low35.5Very low149 Ų149126.9 Ų126.990%0.90377%0.765SS**PPolyproline II helixtrans-84.5125.1166.8-82.10000110.5G302G302-V304 PolarHBondContact O-N 2.77Å
305S34.1Very low35.2Very low94 Ų94126.1 Ų126.166%0.65775%0.754SS**PPolyproline II helixtrans-98.4164.3169.767.40000111.8
306D33.4Very low35.7Very low142 Ų142126.8 Ų126.876%0.75974%0.743SS**  trans65.658.6157.3-49.1-48.3000119.1K308D306-K308 PolarHBondContact O-N 3.48Å
307I32.7Very low35.7Very low158 Ų158132 Ų13281%0.8175%0.752SS**  trans-79108154.4-59.4178.6000109.2I309I307-I309 HydrophobicContact CG2-CG1 4.3Å; I307-I309 PolarHBondContact O-N 3.3Å
308K33Very low36.1Very low203 Ų203129.4 Ų129.488%0.88375%0.746SS**  trans-74.4102.9168.7-72.6-178.3179.5175.20110.2D306 A310D306-K308 PolarHBondContact O-N 3.48Å; K308-A310 PolarHBondContact O-N 3.39Å
309I32.2Very low36.3Very low129 Ų129129 Ų12966%0.66273%0.733SS**  trans-75.9118174.7-58.9175.4000109.4I307I307-I309 HydrophobicContact CG2-CG1 4.3Å; I307-I309 PolarHBondContact O-N 3.3Å
310A32.9Very low36.3Very low89 Ų89128.1 Ų128.174%0.73672%0.723SS**  trans-75.5134.916800000110.2K308 L312K308-A310 PolarHBondContact O-N 3.39Å; A310-L312 PolarHBondContact O-N 3.26Å
311Q35.2Very low36.3Very low172 Ų172124.8 Ų124.880%0.80471%0.705SS**  trans-79.4111.9179.1-72.5175.9-31.800110.8
312L36.5Very low36.4Very low153 Ų153122.3 Ų122.380%0.80170%0.696SS**  trans-79.5115.7166-82.9162.9000109.4A310A310-L312 PolarHBondContact O-N 3.26Å
313L37.2Very low36.6Very low107 Ų107126.1 Ų126.156%0.5670%0.701SS**EExtended strand (participates in β ladder)trans-98122.9172.6-61.4173.4000108.8T320L313-T320 HydrophobicContact CB-CG2 4.22Å; L313-T320 HydrophobicContact CD1-CG2 4.22Å; L313-T320 HydrophobicContact CD2-CG2 4.03Å; L313-T320 HydrophobicContact CG-CG2 4.39Å
314V42.6Very low36.5Very low83 Ų83125.6 Ų125.650%0.50370%0.695SS.*EExtended strand (participates in β ladder)trans-106.7126.6172.4-176.40000108.2I316V314-I316 HydrophobicContact CG1-CD1 4.42Å; V314-I316 HydrophobicContact CG1-CG1 4.13Å
315N32.3Very low36.6Very low107 Ų107123 Ų12357%0.57268%0.682SS**EExtended strand (participates in β ladder)trans-100.9122.2178.7-179.3-4.8000109.2G318N315-G318 WeakPolarHBondContact OD1-CA 3.48Å; N315-G318 PolarHBondContact OD1-N 3.25Å; N315-G318 VanDerWaalsContact OD1-N 3.12Å
316I41.9Very low36.5Very low111 Ų111126.7 Ų126.757%0.56969%0.688SS**EExtended strand (participates in β ladder)trans-129.1125.2172.9-51.4-179.6000107.1V314 G318 Q319V314-I316 HydrophobicContact CG1-CD1 4.42Å; V314-I316 HydrophobicContact CG1-CG1 4.13Å; I316-G318 PolarHBondContact O-N 3.42Å; I316-G318 VanDerWaalsContact O-N 3.13Å; I316-Q319 PolarHBondContact O-N 2.82Å
317Q37.8Very low36.5Very low199 Ų199127 Ų12793%0.9369%0.688SS**THydrogen-bonded Turntrans5232.3179.5-64.8-178.9-6.800115.1Q319Q317-Q319 PolarHBondContact O-N 3.46Å
318G52.2Low36.4Very low63 Ų63126.8 Ų126.865%0.64969%0.688SS**THydrogen-bonded Turntrans80.312.3172.200000115N315 I316N315-G318 WeakPolarHBondContact OD1-CA 3.48Å; N315-G318 PolarHBondContact OD1-N 3.25Å; N315-G318 VanDerWaalsContact OD1-N 3.12Å; I316-G318 PolarHBondContact O-N 3.42Å; I316-G318 VanDerWaalsContact O-N 3.13Å
319Q39.6Very low36.3Very low126 Ų126122.6 Ų122.659%0.58968%0.682SS**EExtended strand (participates in β ladder)trans-114.1132.4168.8-67.1-171.14.100110.6I316 Q317 F321I316-Q319 PolarHBondContact O-N 2.82Å; Q317-Q319 PolarHBondContact O-N 3.46Å; Q319-F321 HydrophobicContact CB-CD2 4.46Å; Q319-F321 HydrophobicContact CB-CE2 3.59Å; Q319-F321 HydrophobicContact CB-CZ 3.66Å; Q319-F321 WeakPolarHBondContact O-CD2 3.47Å; Q319-F321 WeakPolarHBondContact O-CE2 3.4Å
320T33.9Very low36.2Very low95 Ų95121.8 Ų121.858%0.58369%0.687SS**EExtended strand (participates in β ladder)trans-94.3113.3-177.6-49.30000109.7L313L313-T320 HydrophobicContact CB-CG2 4.22Å; L313-T320 HydrophobicContact CD1-CG2 4.22Å; L313-T320 HydrophobicContact CD2-CG2 4.03Å; L313-T320 HydrophobicContact CG-CG2 4.39Å
321F40.5Very low36.3Very low115 Ų115124.1 Ų124.150%0.50470%0.695SS.*EExtended strand (participates in β ladder)trans-103126.2179.9-61.6-81.8000111.1Q319Q319-F321 HydrophobicContact CB-CD2 4.46Å; Q319-F321 HydrophobicContact CB-CE2 3.59Å; Q319-F321 HydrophobicContact CB-CZ 3.66Å; Q319-F321 WeakPolarHBondContact O-CD2 3.47Å; Q319-F321 WeakPolarHBondContact O-CE2 3.4Å
322A34.1Very low36.1Very low75 Ų75120.9 Ų120.962%0.6269%0.691SS**EExtended strand (participates in β ladder)trans-89.9111176.200000110.5V324A322-V324 PolarHBondContact O-N 3.03Å
323L38.1Very low35.7Very low141 Ų141121.5 Ų121.574%0.73870%0.695SS**  trans-82.4112175-68.5172.8000110.3
324V35.3Very low35.5Very low126 Ų126122 Ų12276%0.76471%0.707SS**  trans-94.4114.7172-179.60000108.8A322 H326A322-V324 PolarHBondContact O-N 3.03Å; V324-H326 PolarHBondContact O-N 3.37Å
325P34.2Very low34.9Very low96 Ų96123.7 Ų123.762%0.62372%0.717SS**  trans-74.6109.5-179.829.2-33.2000110.5I327P325-I327 PolarHBondContact O-N 3.23Å
326H31.7Very low35.1Very low170 Ų170123.5 Ų123.579%0.78772%0.724SS**  trans-85.3109.4174.4-146.3-59.3000110.1V324 L328V324-H326 PolarHBondContact O-N 3.37Å; H326-L328 PolarHBondContact O-N 2.87Å
327I33.6Very low34.6Very low150 Ų150127.2 Ų127.277%0.76974%0.736SS**PPolyproline II helixtrans-63.4132.7172.9-58.4175.3000108.5P325P325-I327 PolarHBondContact O-N 3.23Å
328L28.8Very low34.2Very low152 Ų152126.9 Ų126.980%0.79673%0.732SS**PPolyproline II helixtrans-99.7124.9174.8-72.6174.8000110.5H326H326-L328 PolarHBondContact O-N 2.87Å
329P32.4Very low33.1Very low116 Ų116130 Ų13075%0.75374%0.738SS**PPolyproline II helixtrans-73.7161159.232.5-33.2000110.8
330S29.7Very low32.6Very low112 Ų112135.2 Ų135.278%0.78375%0.752SS**PPolyproline II helixtrans-54.6143.4-170.8-49.30000114.8S332S330-S332 PolarHBondContact O-N 2.8Å
331P35.9Very low32.5Very low137 Ų137137.9 Ų137.989%0.8976%0.762SS**  trans-73.6115.3-173.729.2-34.9000112.4
332S29.2Very low31.9Very low104 Ų104136.3 Ų136.373%0.72777%0.77SS**  trans-133.7148.4163.770.90000111.3S330S330-S332 PolarHBondContact O-N 2.8Å
333L29.4Very low31.9Very low167 Ų167138.5 Ų138.587%0.87478%0.778SS**  trans63.5117.5173.1-55.3179.6000117.8
334S32.3Very low31.7Very low117 Ų117137.7 Ų137.782%0.81878%0.778SS**  trans-83.1128.5165.8173.60000111.2
335V29.7Very low31.6Very low119 Ų119137.6 Ų137.672%0.72178%0.78SS**  trans-137.9123.8158.4-176.20000108.9K337V335-K337 PolarHBondContact O-N 3.44Å
336S37Very low31.7Very low103 Ų103140.6 Ų140.672%0.7279%0.79SS**  trans-65.495.6176.1-52.80000111.4F338S336-F338 PolarHBondContact O-N 3.2Å
337K31.8Very low31.7Very low188 Ų188137.4 Ų137.482%0.81779%0.793SS**  trans-84.3109.9168.4-76.2-176.1177.3176.40109.8V335 V339V335-K337 PolarHBondContact O-N 3.44Å; K337-V339 PolarHBondContact O-N 3.5Å
338F29.9Very low31.7Very low192 Ų192134.9 Ų134.984%0.84279%0.794SS**  trans-58.9125.6166.5-72.7-100.2000109.5S336 R340S336-F338 PolarHBondContact O-N 3.2Å; F338-R340 VanDerWaalsContact C-N 3.32Å; F338-R340 PolarHBondContact O-N 3.44Å
339V29Very low32.2Very low130 Ų130137.5 Ų137.579%0.78880%0.799SS**  trans-72.490.7170.3-177.50000108.2K337 I341K337-V339 PolarHBondContact O-N 3.5Å; V339-I341 HydrophobicContact CG1-CG1 3.98Å; V339-I341 PolarHBondContact O-N 3.03Å; V339-I341 VanDerWaalsContact O-N 3.09Å
340R29.1Very low32.5Very low234 Ų234137.7 Ų137.788%0.88380%0.8SS**  trans-73.593.4166.2-77.2-175.2173.2173.9-2.2108.4F338 A342F338-R340 VanDerWaalsContact C-N 3.32Å; F338-R340 PolarHBondContact O-N 3.44Å; R340-A342 PolarHBondContact O-N 3.48Å; R340-A342 VanDerWaalsContact O-N 3.13Å
341I31.1Very low32.7Very low151 Ų151140.9 Ų140.977%0.77481%0.808SS**  trans-66.9107.9164.8-54.8179.8000106.9V339V339-I341 HydrophobicContact CG1-CG1 3.98Å; V339-I341 PolarHBondContact O-N 3.03Å; V339-I341 VanDerWaalsContact O-N 3.09Å
342A27.7Very low32.5Very low83 Ų83137.6 Ų137.669%0.68680%0.799SS**PPolyproline II helixtrans-79121.9169.900000108.5R340 V344R340-A342 PolarHBondContact O-N 3.48Å; R340-A342 VanDerWaalsContact O-N 3.13Å; A342-V344 PolarHBondContact O-N 3.37Å
343P34.1Very low32.6Very low121 Ų121142 Ų14279%0.78681%0.813SS**PPolyproline II helixtrans-70.2130176.528.4-33.1000110.2
344V33.4Very low32.6Very low123 Ų123137.7 Ų137.775%0.74581%0.809SS**PPolyproline II helixtrans-72130171.4179.10000108.7A342 I346A342-V344 PolarHBondContact O-N 3.37Å; V344-I346 PolarHBondContact O-N 3.44Å; V344-I346 VanDerWaalsContact O-N 3.14Å
345P34.3Very low32.7Very low124 Ų124141.5 Ų141.581%0.80581%0.814SS**  trans-73.7106179.329-33.8000111.1
346I35.7Very low33Very low160 Ų160140.9 Ų140.982%0.82182%0.815SS**  trans-81.9120.2166.4-59.4177.6000107.9V344 A348V344-I346 PolarHBondContact O-N 3.44Å; V344-I346 VanDerWaalsContact O-N 3.14Å; I346-A348 PolarHBondContact O-N 2.79Å
347A31.3Very low32.9Very low102 Ų102140.4 Ų140.484%0.84382%0.817SS**  trans-74.2122.6-178.500000111.8
348A33.6Very low33Very low97 Ų97136.2 Ų136.280%0.80282%0.817SS**  trans-108.6135.9172.800000110.8I346I346-A348 PolarHBondContact O-N 2.79Å
349K39Very low33.3Very low208 Ų208132 Ų13290%0.90481%0.812SS**  trans-94.9135.2171.5-84.2177.4172.3175.40110.1
350P40.2Very low33.8Very low120 Ų120135 Ų13578%0.77982%0.818SS**  trans-89.2128.8179.533.3-32.8000113.1
351L32.9Very low34Very low179 Ų179128.3 Ų128.394%0.93781%0.812SS**  trans-148.2137.2157.3-64174.4000105.9
352G31.4Very low34.2Very low68 Ų68127.6 Ų127.670%0.70182%0.821SS**  cis165.9115.8-10.600000111.5
353L31Very low34.5Very low195 Ų195127 Ų127100%1.02182%0.816SS**  trans65.4148173.7-65.6161.4000117.8
354G30.9Very low34.6Very low77 Ų77128.7 Ų128.779%0.79482%0.816SS**  trans144.378.5173.600000115.2
355E33.3Very low34.9Very low197 Ų197130.3 Ų130.392%0.92182%0.82SS**  trans-86.6165.4168.5-53.3175.9135.100109.3
356S36.6Very low35.4Very low107 Ų107131.8 Ų131.875%0.74882%0.82SS**  cis-157.1178.217.965.30000111.7
357A34.7Very low35.6Very low93 Ų93127.3 Ų127.377%0.76981%0.813SS**  trans31.6140.6150.300000122.4
358A34.3Very low36.4Very low99 Ų99126.7 Ų126.782%0.81882%0.817SS**  cis-171.5150.3-12.100000109.5
359S35.8Very low36.7Very low105 Ų105129.3 Ų129.373%0.73481%0.812SS**  trans175.4118.5134.4-167.10000113.3
360Q40.1Very low36.6Very low192 Ų192130.2 Ų130.290%0.89781%0.81SS**  trans27.792.2142.3-51.4-177.730.600120.5
361A32.4Very low36.3Very low93 Ų93132.9 Ų132.977%0.76981%0.81SS**  trans-163.4135.913600000110.6A363A361-A363 VanDerWaalsContact C-N 3.34Å; A361-A363 PolarHBondContact O-N 2.82Å
362S35.3Very low36.9Very low137 Ų137131.5 Ų131.596%0.95880%0.798SS**  trans-79.273.8-178.2-58.80000112.9
363A34.3Very low37.7Very low70 Ų70136.9 Ų136.958%0.57980%0.803SS**  trans-95.6116.8172.500000111.4A361 L365A361-A363 VanDerWaalsContact C-N 3.34Å; A361-A363 PolarHBondContact O-N 2.82Å; A363-L365 HydrophobicContact CB-CG 4.39Å; A363-L365 PolarHBondContact O-N 3.37Å
364I35.4Very low38.2Very low156 Ų156131.2 Ų131.280%0.878%0.779SS**  trans-76.691.4172.1-61.3175.1000108.6I366I364-I366 HydrophobicContact CG2-CD1 4.17Å; I364-I366 HydrophobicContact CG2-CG1 4.09Å; I364-I366 PolarHBondContact O-N 3.42Å
365L40.3Very low39.2Very low158 Ų158131.9 Ų131.983%0.82777%0.77SS**  trans-8790177.8-71.5172.7000111.3A363A363-L365 HydrophobicContact CB-CG 4.39Å; A363-L365 PolarHBondContact O-N 3.37Å
366I44.6Very low40.2Very low154 Ų154126.9 Ų126.979%0.7975%0.752SS**  trans-101.2102165.4-60.1175.4000108.5I364I364-I366 HydrophobicContact CG2-CD1 4.17Å; I364-I366 HydrophobicContact CG2-CG1 4.09Å; I364-I366 PolarHBondContact O-N 3.42Å
367G39.6Very low41.1Very low66 Ų66124.4 Ų124.468%0.6874%0.739SS**SBendtrans73.9113.4173.300000114.3Q369G367-Q369 PolarHBondContact O-N 3.08Å
368G48.1Very low42.1Very low90 Ų90126.9 Ų126.993%0.92874%0.739SS**SBendtrans-7246.7-175.900000116.5
369Q41Very low43.6Very low151 Ų151129.1 Ų129.171%0.70674%0.736SS**  trans-106.9106162.8-74.3-169.6300109.8G367 F371G367-Q369 PolarHBondContact O-N 3.08Å; Q369-F371 HydrophobicContact CB-CD2 4.23Å; Q369-F371 HydrophobicContact CB-CE2 4.18Å; Q369-F371 PolarHBondContact O-N 3.43Å
370R35.7Very low45.6Very low228 Ų228127.7 Ų127.786%0.8672%0.72SS**  trans-68.786.6165.7-170.6-177.7-164166.94.3107.7Q372R370-Q372 VanDerWaalsContact C-N 3.27Å; R370-Q372 PolarHBondContact O-N 3.28Å
371F35.5Very low47.6Very low175 Ų175126.5 Ų126.577%0.76871%0.712SS**  trans-58.595.9167.4-87.3-89.7000108.2Q369 K373Q369-F371 HydrophobicContact CB-CD2 4.23Å; Q369-F371 HydrophobicContact CB-CE2 4.18Å; Q369-F371 PolarHBondContact O-N 3.43Å; F371-K373 PolarHBondContact O-N 3.21Å
372Q45.3Very low50.4Low150 Ų150126.3 Ų126.370%0.70170%0.696SS**PPolyproline II helixtrans-48.4132.7158.1-64.2-76.126.800106.5R370 S374R370-Q372 VanDerWaalsContact C-N 3.27Å; R370-Q372 PolarHBondContact O-N 3.28Å; Q372-S374 PolarHBondContact O-N 3.36Å
373K47Very low53Low182 Ų182122.3 Ų122.379%0.79166%0.662SS**PPolyproline II helixtrans-55.6130166.8-68.7177.9-179.1174.90106.3F371F371-K373 PolarHBondContact O-N 3.21Å
374S41.4Very low55.7Low75 Ų75125 Ų12552%0.52466%0.66SS.*PPolyproline II helixtrans-53.1128.5-172.6-178.60000110.1Q372 V376 A377Q372-S374 PolarHBondContact O-N 3.36Å; S374-V376 PolarHBondContact O-N 3.46Å; S374-A377 WeakPolarHBondContact O-CB 3.44Å; S374-A377 PolarHBondContact O-N 3.22Å
375P53.2Low58.5Low92 Ų92117.8 Ų117.860%0.59762%0.624SS**THydrogen-bonded Turntrans-55.8-19.3-175.3-2835.3000114.5A377 D378P375-A377 PolarHBondContact O-N 3.4Å; P375-D378 PolarHBondContact O-N 3.24Å
376V53Low60.9Low91 Ų91115.7 Ų115.755%0.55262%0.623SS**Hα-helixtrans-55.7-27.4172.4-173.70000112.5S374 I380S374-V376 PolarHBondContact O-N 3.46Å; V376-I380 HydrophobicContact CG1-CD1 4.36Å; V376-I380 WeakPolarHBondContact O-CG1 3.31Å
377A56.3Low63.1Low56 Ų56113 Ų11346%0.46361%0.605SS.*Hα-helixtrans-65.2-38.7179.400000113.1S374 P375S374-A377 WeakPolarHBondContact O-CB 3.44Å; S374-A377 PolarHBondContact O-N 3.22Å; P375-A377 PolarHBondContact O-N 3.4Å
378D56.2Low65.5Low144 Ų144114.8 Ų114.877%0.7761%0.605SS**Hα-helixtrans-86.9-12.8-174.3-57.4-47.8000112.7P375P375-D378 PolarHBondContact O-N 3.24Å
379L64.5Low67.4Low147 Ų147114.3 Ų114.377%0.7760%0.6SS**Hα-helixtrans-86.2-17175.1-87.6156.6000114.1K381L379-K381 PolarHBondContact O-N 3.44Å; L379-K381 VanDerWaalsContact O-N 3.14Å
380I78.4Confident69.9Low75 Ų75107.7 Ų107.739%0.38557%0.57SS.*SBendtrans-82.695.9179.3-59.9163.7000109.4V376 M382 T395V376-I380 HydrophobicContact CG1-CD1 4.36Å; V376-I380 WeakPolarHBondContact O-CG1 3.31Å; I380-M382 HydrophobicContact CB-CE 3.99Å; I380-M382 HydrophobicContact CG2-CE 3.6Å; I380-M382 HydrophobicContact CG2-SD 4.3Å; I380-M382 PolarHBondContact O-N 3.42Å; I380-T395 HydrophobicContact CG2-CG2 3.86Å
381K81.8Confident72.5Confident167 Ų167103.6 Ų103.673%0.72657%0.565SS**  trans-55.5110.5175.8-172.7174-175.6174.20111.2L379L379-K381 PolarHBondContact O-N 3.44Å; L379-K381 VanDerWaalsContact O-N 3.14Å
382M90.6Very high75.3Confident89 Ų89100 Ų10044%0.43855%0.549SS..  trans-88.9129.3179.5-62.7-64.6168.100111.7I380 M393 T395I380-M382 HydrophobicContact CB-CE 3.99Å; I380-M382 HydrophobicContact CG2-CE 3.6Å; I380-M382 HydrophobicContact CG2-SD 4.3Å; I380-M382 PolarHBondContact O-N 3.42Å; M382-M393 HydrophobicContact CB-CE 3.56Å; M382-M393 HydrophobicContact CG-CE 4.12Å; M382-T395 HydrophobicContact CE-CG2 3.91Å; M382-T395 HydrophobicContact SD-CG2 3.77Å
383H90.8Very high77.6Confident52 Ų5298.3 Ų98.324%0.24154%0.543CS..EExtended strand (participates in β ladder)trans-95.2106.3174.5-57.4-83.1000110M393 Y394 K396 S397 L400H383-M393 CarbonylContact O-C 3.55Å; H383-M393 WeakPolarHBondContact O-CA 3.44Å; H383-Y394 PolarHBondContact N-O 3.06Å; H383-Y394 PolarHBondContact O-N 3.44Å; H383-K396 VanDerWaalsContact CD2-C 3.5Å; H383-S397 PolarHBondContact CD2-N 3.34Å; H383-S397 VanDerWaalsContact CD2-N 3.3Å; H383-S397 PolarHBondContact NE2-N 2.95Å; H383-L400 HydrophobicContact CB-CB 4.06Å; H383-L400 HydrophobicContact CB-CD2 3.74Å
384K91.6Very high79.7Confident127 Ų12792.1 Ų92.155%0.55252%0.515SS*.EExtended strand (participates in β ladder)trans-78.1146.3175.9-168.1-169.2173-1730110.9M393 L400K384-M393 HydrophobicContact CB-CG 4.05Å; K384-M393 HydrophobicContact CG-CG 3.93Å; K384-L400 WeakPolarHBondContact O-CD2 3.29Å
385C93.9Very high82.2Confident5 Ų592.4 Ų92.43%0.03451%0.514CS..  trans-66.2134167.4-164.90000111.3C390 K392 L400 H403 H407C385-C390 HydrophobicContact CB-CB 4.17Å; C385-K392 WeakPolarHBondContact CB-O 3.42Å; C385-K392 PolarHBondContact N-O 3.41Å; C385-L400 HydrophobicContact CB-CD1 4.17Å; C385-H403 PolarHBondContact SG-NE2 3.34Å; C385-H407 PolarHBondContact SG-NE2 3.29Å
386S91.3Very high84Confident114 Ų11494 Ų9480%0.79751%0.511SS*.  trans-83.4-14178.4-146.70000113.2
387F90.1Very high85.7Confident96 Ų9693.4 Ų93.442%0.42151%0.511SS..SBendtrans-72.8131.5-174.1-164.9-92.2000111.6G389 C390 H407F387-G389 PolarHBondContact O-N 2.84Å; F387-C390 HydrophobicContact CB-CB 4.14Å; F387-C390 WeakPolarHBondContact O-CB 3.35Å; F387-C390 PolarHBondContact O-N 2.97Å; F387-H407 HydrophobicContact CB-CB 4.42Å; F387-H407 AromaticContact CD1-CE1 3.81Å; F387-H407 AromaticContact CD1-CG 3.97Å; F387-H407 AromaticContact CD1-ND1 3.56Å; F387-H407 HydrophobicContact CD2-CB 3.63Å; F387-H407 AromaticContact CD2-CG 3.86Å; F387-H407 AromaticContact CE1-ND1 3.95Å; F387-H407 HydrophobicContact CE2-CB 3.96Å; F387-H407 HydrophobicContact CG-CB 3.94Å; F387-H407 AromaticContact CG-CD2 3.81Å; F387-H407 AromaticContact CG-CG 3.6Å; F387-H407 AromaticContact CG-ND1 3.72Å
388P90.5Very high87.3Confident105 Ų10594 Ų9468%0.68251%0.511SS*.THydrogen-bonded Turntrans-57.8139-178.623.3-33.6000111.8C390P388-C390 PolarHBondContact O-N 3.47Å
389G88.6Confident89Confident80 Ų8091.8 Ų91.883%0.82550%0.496SS*.THydrogen-bonded Turntrans75-7.9-173.100000115.6F387 N391F387-G389 PolarHBondContact O-N 2.84Å; G389-N391 PolarHBondContact O-N 2.85Å
390C92.2Very high90.3Very high11 Ų1186 Ų867%0.07447%0.466CS..  trans-96.390.3-177.7-155.50000113.9C385 F387 P388 K392 H403 H407C385-C390 HydrophobicContact CB-CB 4.17Å; F387-C390 HydrophobicContact CB-CB 4.14Å; F387-C390 WeakPolarHBondContact O-CB 3.35Å; F387-C390 PolarHBondContact O-N 2.97Å; P388-C390 PolarHBondContact O-N 3.47Å; C390-K392 PolarHBondContact O-N 3.38Å; C390-H403 PolarHBondContact SG-NE2 3.07Å; C390-H407 WeakPolarHBondContact CB-CE1 3.42Å; C390-H407 WeakPolarHBondContact CB-NE2 3.4Å; C390-H407 PolarHBondContact SG-CE1 2.97Å; C390-H407 PolarHBondContact SG-NE2 3.25Å
391N91.2Very high90.8Very high142 Ų14289.2 Ų89.276%0.75948%0.477SS*.  trans-78.536178.7-66.6-38.8000114.7G389G389-N391 PolarHBondContact O-N 2.85Å
392K92.9Very high91.1Very high99 Ų9982.7 Ų82.743%0.4346%0.455SS..  trans-95.1140.7179.5-64.3-170.2-175.6-60.60111.7C385 C390 Y394C385-K392 WeakPolarHBondContact CB-O 3.42Å; C385-K392 PolarHBondContact N-O 3.41Å; C390-K392 PolarHBondContact O-N 3.38Å; K392-Y394 HydrophobicContact CB-CE2 3.75Å
393M93.6Very high91.1Very high116 Ų11678.9 Ų78.957%0.57144%0.436SS*.EExtended strand (participates in β ladder)trans-133.8148.1-178.2-66.5174.466.300110.3M382 H383 K384M382-M393 HydrophobicContact CB-CE 3.56Å; M382-M393 HydrophobicContact CG-CE 4.12Å; H383-M393 CarbonylContact O-C 3.55Å; H383-M393 WeakPolarHBondContact O-CA 3.44Å; K384-M393 HydrophobicContact CB-CG 4.05Å; K384-M393 HydrophobicContact CG-CG 3.93Å
394Y92.8Very high91.1Very high52 Ų5279 Ų7920%0.20444%0.438CS..EExtended strand (participates in β ladder)trans-138.1137.5-170.4-64-88.1000111.9H383 K392 K396 H399 L400 H403H383-Y394 PolarHBondContact N-O 3.06Å; H383-Y394 PolarHBondContact O-N 3.44Å; K392-Y394 HydrophobicContact CB-CE2 3.75Å; Y394-K396 PolarHBondContact O-N 3.02Å; Y394-H399 HydrophobicContact CD1-CB 3.6Å; Y394-H399 HydrophobicContact CE1-CB 4.41Å; Y394-H399 HydrophobicContact CG-CB 4.12Å; Y394-L400 HydrophobicContact CD2-CB 4.16Å; Y394-L400 HydrophobicContact CD2-CD1 4.17Å; Y394-L400 HydrophobicContact CE2-CD1 4.49Å; Y394-L400 HydrophobicContact CG-CB 4.42Å; Y394-H403 HydrophobicContact CE1-CB 4.42Å; Y394-H403 HydrophobicContact CE2-CB 3.92Å; Y394-H403 AromaticContact CE2-CD2 3.35Å; Y394-H403 WeakPolarHBondContact CE2-CD2 3.42Å; Y394-H403 AromaticContact CE2-CG 3.83Å; Y394-H403 AromaticContact CZ-CD2 3.71Å; Y394-H403 AromaticContact CZ-CG 3.76Å; Y394-H403 PolarHBondContact OH-CD2 3.42Å; Y394-H403 VanDerWaalsContact OH-CG 3.28Å
395T92.7Very high91.1Very high81 Ų8175.2 Ų75.250%0.49742%0.42SS..SBendtrans-75.2-6.9175.852.90000114.3I380 M382I380-T395 HydrophobicContact CG2-CG2 3.86Å; M382-T395 HydrophobicContact CE-CG2 3.91Å; M382-T395 HydrophobicContact SD-CG2 3.77Å
396K90.3Very high90.8Very high126 Ų12681.5 Ų81.555%0.54844%0.443SS..SBendtrans-136.4136178.5-64.4-161.9173.4-157.20110.7H383 Y394 S398 H399 L400H383-K396 VanDerWaalsContact CD2-C 3.5Å; Y394-K396 PolarHBondContact O-N 3.02Å; K396-S398 VanDerWaalsContact C-N 3.29Å; K396-S398 PolarHBondContact O-N 3.11Å; K396-H399 HydrophobicContact CB-CB 4.44Å; K396-H399 PolarHBondContact O-N 2.9Å; K396-H399 VanDerWaalsContact O-N 3.14Å; K396-L400 PolarHBondContact O-N 2.75Å
397S90.4Very high90.7Very high77 Ų7779.1 Ų79.154%0.53842%0.419SS..Hα-helixtrans-56.7-41.1176.255.40000112.3H383 H399 L400 K401H383-S397 PolarHBondContact CD2-N 3.34Å; H383-S397 VanDerWaalsContact CD2-N 3.3Å; H383-S397 PolarHBondContact NE2-N 2.95Å; S397-H399 VanDerWaalsContact C-N 3.32Å; S397-H399 PolarHBondContact O-N 3.4Å; S397-L400 PolarHBondContact O-N 3.15Å; S397-L400 VanDerWaalsContact O-N 3.13Å; S397-K401 PolarHBondContact O-N 2.92Å
398S89.4Confident90.6Very high68 Ų6878.7 Ų78.748%0.47643%0.425SS..Hα-helixtrans-60.2-37.3176.257.80000113.2K396 K401 A402K396-S398 VanDerWaalsContact C-N 3.29Å; K396-S398 PolarHBondContact O-N 3.11Å; S398-K401 PolarHBondContact O-N 2.9Å; S398-A402 WeakPolarHBondContact O-CB 3.24Å; S398-A402 PolarHBondContact O-N 3.19Å
399H90.8Very high90.5Very high98 Ų9876.1 Ų76.145%0.45442%0.417SS..Hα-helixtrans-70.3-35.2174.9-64.7172.3000112.1Y394 K396 S397 H403Y394-H399 HydrophobicContact CD1-CB 3.6Å; Y394-H399 HydrophobicContact CE1-CB 4.41Å; Y394-H399 HydrophobicContact CG-CB 4.12Å; K396-H399 HydrophobicContact CB-CB 4.44Å; K396-H399 PolarHBondContact O-N 2.9Å; K396-H399 VanDerWaalsContact O-N 3.14Å; S397-H399 VanDerWaalsContact C-N 3.32Å; S397-H399 PolarHBondContact O-N 3.4Å; H399-H403 WeakPolarHBondContact O-CB 3.2Å; H399-H403 PolarHBondContact O-N 3.4Å
400L92.6Very high90.6Very high25 Ų2576.3 Ų76.313%0.13140%0.396CS..Hα-helixtrans-66.1-47.7170.4173.760.8000111H383 K384 C385 Y394 K396 S397 A402 H403 L404H383-L400 HydrophobicContact CB-CB 4.06Å; H383-L400 HydrophobicContact CB-CD2 3.74Å; K384-L400 WeakPolarHBondContact O-CD2 3.29Å; C385-L400 HydrophobicContact CB-CD1 4.17Å; Y394-L400 HydrophobicContact CD2-CB 4.16Å; Y394-L400 HydrophobicContact CD2-CD1 4.17Å; Y394-L400 HydrophobicContact CE2-CD1 4.49Å; Y394-L400 HydrophobicContact CG-CB 4.42Å; K396-L400 PolarHBondContact O-N 2.75Å; S397-L400 PolarHBondContact O-N 3.15Å; S397-L400 VanDerWaalsContact O-N 3.13Å; L400-A402 VanDerWaalsContact C-N 3.31Å; L400-A402 PolarHBondContact O-N 3.25Å; L400-H403 CarbonylContact O-C 3.57Å; L400-H403 WeakPolarHBondContact O-CA 3.42Å; L400-H403 WeakPolarHBondContact O-CB 3.45Å; L400-H403 PolarHBondContact O-N 3.35Å; L400-L404 HydrophobicContact CD1-CD1 4.21Å; L400-L404 HydrophobicContact CD1-CD2 4.18Å; L400-L404 HydrophobicContact CD1-CG 3.89Å; L400-L404 HydrophobicContact CG-CD1 4.05Å; L400-L404 HydrophobicContact CG-CG 4.22Å; L400-L404 WeakPolarHBondContact O-CG 3.43Å; L400-L404 PolarHBondContact O-N 2.88Å
401K89.6Confident90.5Very high144 Ų14480 Ų8063%0.62641%0.411SS*.Hα-helixtrans-57.6-44.1178.7-164.7171.1-174.31740111.1S397 S398 H403 L404S397-K401 PolarHBondContact O-N 2.92Å; S398-K401 PolarHBondContact O-N 2.9Å; K401-H403 VanDerWaalsContact C-N 3.31Å; K401-H403 PolarHBondContact O-N 3.43Å; K401-L404 PolarHBondContact O-N 3.05Å
402A88.4Confident90.4Very high30 Ų3075.9 Ų75.925%0.24839%0.392CS..Hα-helixtrans-67.1-26.3173.600000114S398 L400S398-A402 WeakPolarHBondContact O-CB 3.24Å; S398-A402 PolarHBondContact O-N 3.19Å; L400-A402 VanDerWaalsContact C-N 3.31Å; L400-A402 PolarHBondContact O-N 3.25Å
403H90.3Very high90.3Very high9 Ų974.3 Ų74.34%0.04239%0.386CS..Hα-helixtrans-75.1-43.3172.6170.429.9000112.4C385 C390 Y394 H399 L400 K401 R405 R406 H407C385-H403 PolarHBondContact SG-NE2 3.34Å; C390-H403 PolarHBondContact SG-NE2 3.07Å; Y394-H403 HydrophobicContact CE1-CB 4.42Å; Y394-H403 HydrophobicContact CE2-CB 3.92Å; Y394-H403 AromaticContact CE2-CD2 3.35Å; Y394-H403 WeakPolarHBondContact CE2-CD2 3.42Å; Y394-H403 AromaticContact CE2-CG 3.83Å; Y394-H403 AromaticContact CZ-CD2 3.71Å; Y394-H403 AromaticContact CZ-CG 3.76Å; Y394-H403 PolarHBondContact OH-CD2 3.42Å; Y394-H403 VanDerWaalsContact OH-CG 3.28Å; H399-H403 WeakPolarHBondContact O-CB 3.2Å; H399-H403 PolarHBondContact O-N 3.4Å; L400-H403 CarbonylContact O-C 3.57Å; L400-H403 WeakPolarHBondContact O-CA 3.42Å; L400-H403 WeakPolarHBondContact O-CB 3.45Å; L400-H403 PolarHBondContact O-N 3.35Å; K401-H403 VanDerWaalsContact C-N 3.31Å; K401-H403 PolarHBondContact O-N 3.43Å; H403-R405 PolarHBondContact O-N 3.49Å; H403-R405 VanDerWaalsContact O-N 3.17Å; H403-R406 PolarHBondContact O-N 2.69Å; H403-H407 AromaticContact CD2-NE2 3.84Å; H403-H407 AromaticContact CE1-CD2 3.76Å; H403-H407 AromaticContact CE1-NE2 2.9Å; H403-H407 PolarHBondContact CE1-NE2 2.83Å; H403-H407 AromaticContact NE2-CD2 3.99Å; H403-H407 AromaticContact NE2-NE2 2.7Å; H403-H407 PolarHBondContact NE2-NE2 3.24Å
404L91.1Very high90.3Very high55 Ų5570.2 Ų70.229%0.28837%0.37SS..Hα-helixtrans-57.2-31-177.7-71.4171.6000112.2L400 K401 R406 H407 T408L400-L404 HydrophobicContact CD1-CD1 4.21Å; L400-L404 HydrophobicContact CD1-CD2 4.18Å; L400-L404 HydrophobicContact CD1-CG 3.89Å; L400-L404 HydrophobicContact CG-CD1 4.05Å; L400-L404 HydrophobicContact CG-CG 4.22Å; L400-L404 WeakPolarHBondContact O-CG 3.43Å; L400-L404 PolarHBondContact O-N 2.88Å; K401-L404 PolarHBondContact O-N 3.05Å; L404-R406 PolarHBondContact O-N 2.35Å; L404-R406 VanDerWaalsContact O-N 3.12Å; L404-H407 WeakPolarHBondContact O-CA 3.37Å; L404-H407 WeakPolarHBondContact O-CB 3.5Å; L404-H407 PolarHBondContact O-N 3.27Å; L404-T408 PolarHBondContact O-N 2.83Å; L404-T408 PolarHBondContact O-OG1 3.48Å
405R91Very high90.4Very high46 Ų4668.3 Ų68.317%0.17436%0.364CS..Hα-helixtrans-57.1-22.9172.3-63.7-166.3172149.72.1115.6H403 H407 T408 G409 E410 F413 S425H403-R405 PolarHBondContact O-N 3.49Å; H403-R405 VanDerWaalsContact O-N 3.17Å; R405-H407 VanDerWaalsContact C-N 3.3Å; R405-T408 WeakPolarHBondContact CA-OG1 3.32Å; R405-G409 CarbonylContact O-C 3.27Å; R405-G409 WeakPolarHBondContact O-CA 3.38Å; R405-G409 PolarHBondContact O-N 3.49Å; R405-E410 HydrophobicContact CB-CB 4.06Å; R405-E410 HydrophobicContact CG-CB 3.8Å; R405-E410 IonicContact NE-OE2 2.79Å; R405-E410 PolarHBondContact NE-OE2 2.87Å; R405-E410 VanDerWaalsContact NE-OE2 3.11Å; R405-E410 PolarHBondContact O-N 2.7Å; R405-F413 VanDerWaalsContact NH1-CE2 3.34Å; R405-S425 WeakPolarHBondContact CD-O 3.46Å; R405-S425 PolarHBondContact NH1-O 3.33Å; R405-S425 VanDerWaalsContact NH1-O 3.1Å
406R87.8Confident90.4Very high138 Ų13872 Ų7252%0.52138%0.381SS..Hα-helixtrans-84.9-4173.2-171.2154.95072.63.6113.4H403 L404H403-R406 PolarHBondContact O-N 2.69Å; L404-R406 PolarHBondContact O-N 2.35Å; L404-R406 VanDerWaalsContact O-N 3.12Å
407H89.3Confident90.3Very high64 Ų6472.7 Ų72.730%0.29638%0.38SS..Hα-helixtrans-102.4-40.6167.1-61.5-57.9000111.6C385 F387 C390 H403 L404 R405C385-H407 PolarHBondContact SG-NE2 3.29Å; F387-H407 HydrophobicContact CB-CB 4.42Å; F387-H407 AromaticContact CD1-CE1 3.81Å; F387-H407 AromaticContact CD1-CG 3.97Å; F387-H407 AromaticContact CD1-ND1 3.56Å; F387-H407 HydrophobicContact CD2-CB 3.63Å; F387-H407 AromaticContact CD2-CG 3.86Å; F387-H407 AromaticContact CE1-ND1 3.95Å; F387-H407 HydrophobicContact CE2-CB 3.96Å; F387-H407 HydrophobicContact CG-CB 3.94Å; F387-H407 AromaticContact CG-CD2 3.81Å; F387-H407 AromaticContact CG-CG 3.6Å; F387-H407 AromaticContact CG-ND1 3.72Å; C390-H407 WeakPolarHBondContact CB-CE1 3.42Å; C390-H407 WeakPolarHBondContact CB-NE2 3.4Å; C390-H407 PolarHBondContact SG-CE1 2.97Å; C390-H407 PolarHBondContact SG-NE2 3.25Å; H403-H407 AromaticContact CD2-NE2 3.84Å; H403-H407 AromaticContact CE1-CD2 3.76Å; H403-H407 AromaticContact CE1-NE2 2.9Å; H403-H407 PolarHBondContact CE1-NE2 2.83Å; H403-H407 AromaticContact NE2-CD2 3.99Å; H403-H407 AromaticContact NE2-NE2 2.7Å; H403-H407 PolarHBondContact NE2-NE2 3.24Å; L404-H407 WeakPolarHBondContact O-CA 3.37Å; L404-H407 WeakPolarHBondContact O-CB 3.5Å; L404-H407 PolarHBondContact O-N 3.27Å; R405-H407 VanDerWaalsContact C-N 3.3Å
408T88.1Confident90.4Very high87 Ų8778 Ų7853%0.53440%0.397SS..Hα-helixtrans-80.2-15.4177.358.40000113.9L404 R405 E410L404-T408 PolarHBondContact O-N 2.83Å; L404-T408 PolarHBondContact O-OG1 3.48Å; R405-T408 WeakPolarHBondContact CA-OG1 3.32Å; T408-E410 WeakPolarHBondContact CB-OE1 3.41Å; T408-E410 PolarHBondContact O-N 3.38Å; T408-E410 WeakPolarHBondContact OG1-CG 2.92Å; T408-E410 PolarHBondContact OG1-OE1 2.99Å
409G87.8Confident90.3Very high51 Ų5179 Ų7953%0.52642%0.418SS..  trans77-0.3-177.100000114.7R405 K411R405-G409 CarbonylContact O-C 3.27Å; R405-G409 WeakPolarHBondContact O-CA 3.38Å; R405-G409 PolarHBondContact O-N 3.49Å; G409-K411 PolarHBondContact O-N 2.51Å
410E90.3Very high90.3Very high83 Ų8375.4 Ų75.439%0.38840%0.403SS..  trans-49.7122.3179.2-80.7165.6-113.800112.8R405 T408 P412R405-E410 HydrophobicContact CB-CB 4.06Å; R405-E410 HydrophobicContact CG-CB 3.8Å; R405-E410 IonicContact NE-OE2 2.79Å; R405-E410 PolarHBondContact NE-OE2 2.87Å; R405-E410 VanDerWaalsContact NE-OE2 3.11Å; R405-E410 PolarHBondContact O-N 2.7Å; T408-E410 WeakPolarHBondContact CB-OE1 3.41Å; T408-E410 PolarHBondContact O-N 3.38Å; T408-E410 WeakPolarHBondContact OG1-CG 2.92Å; T408-E410 PolarHBondContact OG1-OE1 2.99Å; E410-P412 HydrophobicContact CB-CG 4.41Å; E410-P412 WeakPolarHBondContact O-CD 3.42Å
411K90.3Very high90.1Very high89 Ų8977.2 Ų77.239%0.38743%0.428SS..  trans-121.271.5172.2-69.2169.7177.6-178.20110.4D128 G409 F413 R423 F424D128-K411 IonicContact OD2-NZ 3.23Å; D128-K411 PolarHBondContact OD2-NZ 2.73Å; G409-K411 PolarHBondContact O-N 2.51Å; K411-F413 PolarHBondContact O-N 2.9Å; K411-R423 HydrophobicContact CB-CB 3.65Å; K411-R423 WeakPolarHBondContact O-CB 3.35Å; K411-R423 PolarHBondContact O-NE 3.36Å; K411-F424 CarbonylContact C-O 3.26Å; K411-F424 VanDerWaalsContact C-O 3.27Å; K411-F424 VanDerWaalsContact CA-O 3.3Å; K411-F424 WeakPolarHBondContact CA-O 3.41Å
412P88.7Confident90.2Very high55 Ų5576.5 Ų76.536%0.35742%0.421SS..  trans-67.6-35.4-173.2-22.537000113E410 A414 R423E410-P412 HydrophobicContact CB-CG 4.41Å; E410-P412 WeakPolarHBondContact O-CD 3.42Å; P412-A414 PolarHBondContact O-N 3.13Å; P412-A414 VanDerWaalsContact O-N 3.1Å; P412-R423 PolarHBondContact O-NH2 3.38Å
413F91.6Very high90.5Very high67 Ų6781.6 Ų81.629%0.29443%0.434SS..EExtended strand (participates in β ladder)trans-81.291.5-171.7-59-73000111.3R405 K411 R423 F424 S425 S427 L430R405-F413 VanDerWaalsContact NH1-CE2 3.34Å; K411-F413 PolarHBondContact O-N 2.9Å; F413-R423 CarbonylContact O-C 3.57Å; F413-R423 WeakPolarHBondContact O-CA 3.47Å; F413-F424 HydrophobicContact CB-CB 4.33Å; F413-F424 PolarHBondContact N-O 2.73Å; F413-F424 VanDerWaalsContact N-O 3.16Å; F413-F424 PolarHBondContact O-N 2.92Å; F413-S425 WeakPolarHBondContact CE2-O 3.36Å; F413-S427 VanDerWaalsContact CE2-N 3.34Å; F413-L430 HydrophobicContact CB-CB 4.11Å; F413-L430 HydrophobicContact CB-CD2 3.87Å
414A92.4Very high90.5Very high29 Ų2982.3 Ų82.324%0.2444%0.437CS..EExtended strand (participates in β ladder)trans-74.2154.1174.500000112.5P412 N416 W422 R423 L430P412-A414 PolarHBondContact O-N 3.13Å; P412-A414 VanDerWaalsContact O-N 3.1Å; A414-N416 PolarHBondContact O-OD1 3.29Å; A414-W422 CarbonylContact C-O 3.6Å; A414-R423 HydrophobicContact CB-CG 4.13Å; A414-L430 WeakPolarHBondContact O-CD1 3.43Å; A414-L430 VanDerWaalsContact O-CD2 3.23Å; A414-L430 WeakPolarHBondContact O-CD2 3.12Å
415C95.4Very high90.5Very high12 Ų1280.9 Ų80.98%0.08143%0.432CS..  trans-91.1112.5166.9-1690000110.7W417 W422 L430 H433 H437C415-W417 PolarHBondContact O-N 3.34Å; C415-W422 WeakPolarHBondContact CB-O 3.29Å; C415-W422 PolarHBondContact N-O 3.32Å; C415-L430 HydrophobicContact CB-CD1 3.86Å; C415-H433 VanDerWaalsContact SG-CD2 3.55Å; C415-H433 PolarHBondContact SG-NE2 2.99Å; C415-H433 VanDerWaalsContact SG-NE2 3.38Å; C415-H437 PolarHBondContact SG-NE2 2.97Å
416N92.2Very high90.3Very high159 Ų15983.8 Ų83.885%0.8544%0.443SS*.  trans-71.58.4179.1-5516.8000113.7A414A414-N416 PolarHBondContact O-OD1 3.29Å
417W89.9Confident90.4Very high141 Ų14180.4 Ų80.453%0.53444%0.44SS..SBendtrans-77.4123.4175.3-166.3-79.2000109.7C415 G419 C420 H437C415-W417 PolarHBondContact O-N 3.34Å; W417-G419 PolarHBondContact O-N 2.93Å; W417-C420 HydrophobicContact CB-CB 4.06Å; W417-C420 WeakPolarHBondContact O-CB 3.47Å; W417-C420 PolarHBondContact O-N 3.12Å; W417-H437 HydrophobicContact CD2-CB 3.73Å; W417-H437 AromaticContact CD2-CD2 3.95Å; W417-H437 AromaticContact CD2-CG 3.76Å; W417-H437 HydrophobicContact CE3-CB 3.66Å; W417-H437 HydrophobicContact CG-CB 4.34Å; W417-H437 AromaticContact CG-CD2 3.71Å; W417-H437 AromaticContact CG-CG 3.82Å; W417-H437 HydrophobicContact CH2-CB 4.17Å; W417-H437 HydrophobicContact CZ2-CB 4.24Å; W417-H437 HydrophobicContact CZ3-CB 3.89Å
418Q90.7Very high90.4Very high189 Ų18980.9 Ų80.988%0.88345%0.445SS*.THydrogen-bonded Turntrans-60.6134.6-174.3-165.4170.65.300111.3C420Q418-C420 PolarHBondContact O-N 3.17Å
419G87.8Confident90.5Very high89 Ų8979 Ų7992%0.91843%0.43SS*.THydrogen-bonded Turntrans75.3-1.2-174.100000115.4W417W417-G419 PolarHBondContact O-N 2.93Å
420C91.3Very high90.8Very high22 Ų2277.8 Ų77.815%0.14941%0.411CS..THydrogen-bonded Turntrans-85.1-61.8176-172.80000112.6W417 Q418 W422 H433 H437W417-C420 HydrophobicContact CB-CB 4.06Å; W417-C420 WeakPolarHBondContact O-CB 3.47Å; W417-C420 PolarHBondContact O-N 3.12Å; Q418-C420 PolarHBondContact O-N 3.17Å; C420-W422 PolarHBondContact O-N 3.09Å; C420-W422 VanDerWaalsContact SG-CD1 3.55Å; C420-H433 VanDerWaalsContact SG-CE1 3.55Å; C420-H433 PolarHBondContact SG-NE2 2.71Å; C420-H437 WeakPolarHBondContact CB-NE2 3.42Å; C420-H437 PolarHBondContact SG-CE1 3.33Å; C420-H437 PolarHBondContact SG-NE2 3.25Å
421G88.3Confident90.9Very high63 Ų6376.1 Ų76.165%0.64941%0.409SS*.  trans68.2-1.6178.700000116.5
422W91.8Very high90.9Very high129 Ų12976.7 Ų76.749%0.48941%0.409SS..  trans-63.5138.3179.2-81.159.1000111.7A414 C415 C420 F424A414-W422 CarbonylContact C-O 3.6Å; C415-W422 WeakPolarHBondContact CB-O 3.29Å; C415-W422 PolarHBondContact N-O 3.32Å; C420-W422 PolarHBondContact O-N 3.09Å; C420-W422 VanDerWaalsContact SG-CD1 3.55Å; W422-F424 HydrophobicContact CB-CE2 3.8Å; W422-F424 HydrophobicContact CB-CZ 3.81Å; W422-F424 HydrophobicContact CD2-CZ 4.43Å; W422-F424 HydrophobicContact CE3-CE1 4.05Å; W422-F424 AromaticContact CE3-CZ 3.82Å; W422-F424 HydrophobicContact CE3-CZ 3.82Å; W422-F424 HydrophobicContact CG-CZ 4.48Å
423R93.8Very high91.1Very high137 Ų13775.4 Ų75.452%0.51740%0.398SS..EExtended strand (participates in β ladder)trans-124146.3177.2-51.9-170.572.4123.15.5111.8K411 P412 F413 A414K411-R423 HydrophobicContact CB-CB 3.65Å; K411-R423 WeakPolarHBondContact O-CB 3.35Å; K411-R423 PolarHBondContact O-NE 3.36Å; P412-R423 PolarHBondContact O-NH2 3.38Å; F413-R423 CarbonylContact O-C 3.57Å; F413-R423 WeakPolarHBondContact O-CA 3.47Å; A414-R423 HydrophobicContact CB-CG 4.13Å
424F92Very high91.1Very high24 Ų2479.5 Ų79.511%0.10541%0.411CS..EExtended strand (participates in β ladder)trans-128.4153.2-171.4-58.9-83.5000113K411 F413 W422 E429 L430 H433K411-F424 CarbonylContact C-O 3.26Å; K411-F424 VanDerWaalsContact C-O 3.27Å; K411-F424 VanDerWaalsContact CA-O 3.3Å; K411-F424 WeakPolarHBondContact CA-O 3.41Å; F413-F424 HydrophobicContact CB-CB 4.33Å; F413-F424 PolarHBondContact N-O 2.73Å; F413-F424 VanDerWaalsContact N-O 3.16Å; F413-F424 PolarHBondContact O-N 2.92Å; W422-F424 HydrophobicContact CB-CE2 3.8Å; W422-F424 HydrophobicContact CB-CZ 3.81Å; W422-F424 HydrophobicContact CD2-CZ 4.43Å; W422-F424 HydrophobicContact CE3-CE1 4.05Å; W422-F424 AromaticContact CE3-CZ 3.82Å; W422-F424 HydrophobicContact CE3-CZ 3.82Å; W422-F424 HydrophobicContact CG-CZ 4.48Å; F424-E429 HydrophobicContact CB-CB 3.93Å; F424-E429 HydrophobicContact CD1-CB 3.87Å; F424-E429 HydrophobicContact CG-CB 4.13Å; F424-L430 HydrophobicContact CB-CB 4.3Å; F424-L430 HydrophobicContact CD2-CB 3.84Å; F424-L430 HydrophobicContact CD2-CD1 3.91Å; F424-L430 HydrophobicContact CD2-CG 4.48Å; F424-L430 HydrophobicContact CE2-CD1 4.1Å; F424-L430 HydrophobicContact CG-CB 4.26Å; F424-H433 HydrophobicContact CE1-CB 4.05Å; F424-H433 HydrophobicContact CE2-CB 3.82Å; F424-H433 AromaticContact CE2-CD2 3.4Å; F424-H433 WeakPolarHBondContact CE2-CD2 3.39Å; F424-H433 AromaticContact CE2-CG 3.58Å; F424-H433 HydrophobicContact CZ-CB 3.45Å; F424-H433 VanDerWaalsContact CZ-CB 3.45Å; F424-H433 AromaticContact CZ-CD2 3.58Å; F424-H433 AromaticContact CZ-CG 3.27Å; F424-H433 AromaticContact CZ-ND1 3.69Å
425S89.6Confident91.1Very high25 Ų2581.9 Ų81.918%0.17541%0.414CS..SBendtrans-77.1-28.818075.60000112.6R405 F413 E429R405-S425 WeakPolarHBondContact CD-O 3.46Å; R405-S425 PolarHBondContact NH1-O 3.33Å; R405-S425 VanDerWaalsContact NH1-O 3.1Å; F413-S425 WeakPolarHBondContact CE2-O 3.36Å; S425-E429 PolarHBondContact N-OE2 2.89Å; S425-E429 PolarHBondContact OG-OE2 3.07Å
426R87.8Confident90.8Very high107 Ų10785.2 Ų85.240%0.40444%0.438SS..SBendtrans-129.6153.1-176.6-60.5156.251.7120.4-3.9112.5D428 E429 L430R426-D428 WeakPolarHBondContact CB-OD1 3.39Å; R426-D428 IonicContact CZ-OD1 2.79Å; R426-D428 IonicContact CZ-OD2 2.88Å; R426-D428 IonicContact NE-OD1 3.11Å; R426-D428 PolarHBondContact NE-OD1 2.79Å; R426-D428 IonicContact NE-OD2 3.38Å; R426-D428 VanDerWaalsContact NH2-CG 3.26Å; R426-D428 IonicContact NH2-OD1 3.42Å; R426-D428 PolarHBondContact NH2-OD1 2.85Å; R426-D428 VanDerWaalsContact NH2-OD1 3.15Å; R426-D428 IonicContact NH2-OD2 3.15Å; R426-D428 PolarHBondContact NH2-OD2 2.81Å; R426-E429 HydrophobicContact CB-CB 4.44Å; R426-E429 HydrophobicContact CB-CG 3.98Å; R426-E429 PolarHBondContact N-OE2 3.14Å; R426-E429 VanDerWaalsContact N-OE2 3.09Å; R426-E429 WeakPolarHBondContact O-CB 3.36Å; R426-E429 PolarHBondContact O-N 3.36Å; R426-L430 PolarHBondContact O-N 3.13Å
427S90.2Very high90.7Very high67 Ų6780.8 Ų80.847%0.46941%0.411SS..Hα-helixtrans-70.9-29.3179.650.40000113.6F413 S431F413-S427 VanDerWaalsContact CE2-N 3.34Å; S427-S431 VanDerWaalsContact O-CB 3.29Å; S427-S431 WeakPolarHBondContact O-CB 3.41Å; S427-S431 PolarHBondContact O-N 3.01Å; S427-S431 PolarHBondContact O-OG 2.94Å
428D88.6Confident90.6Very high73 Ų7377.3 Ų77.339%0.3941%0.409SS..Hα-helixtrans-73-30.217570.3-46.1000112.3R426 R432R426-D428 WeakPolarHBondContact CB-OD1 3.39Å; R426-D428 IonicContact CZ-OD1 2.79Å; R426-D428 IonicContact CZ-OD2 2.88Å; R426-D428 IonicContact NE-OD1 3.11Å; R426-D428 PolarHBondContact NE-OD1 2.79Å; R426-D428 IonicContact NE-OD2 3.38Å; R426-D428 VanDerWaalsContact NH2-CG 3.26Å; R426-D428 IonicContact NH2-OD1 3.42Å; R426-D428 PolarHBondContact NH2-OD1 2.85Å; R426-D428 VanDerWaalsContact NH2-OD1 3.15Å; R426-D428 IonicContact NH2-OD2 3.15Å; R426-D428 PolarHBondContact NH2-OD2 2.81Å; D428-R432 WeakPolarHBondContact O-CB 3.47Å; D428-R432 PolarHBondContact O-N 3.42Å
429E91.1Very high90.4Very high47 Ų4770.5 Ų70.522%0.2239%0.39CS..Hα-helixtrans-65.2-48.9171.9-64.9174.9151.400111F424 S425 R426 R432 H433F424-E429 HydrophobicContact CB-CB 3.93Å; F424-E429 HydrophobicContact CD1-CB 3.87Å; F424-E429 HydrophobicContact CG-CB 4.13Å; S425-E429 PolarHBondContact N-OE2 2.89Å; S425-E429 PolarHBondContact OG-OE2 3.07Å; R426-E429 HydrophobicContact CB-CB 4.44Å; R426-E429 HydrophobicContact CB-CG 3.98Å; R426-E429 PolarHBondContact N-OE2 3.14Å; R426-E429 VanDerWaalsContact N-OE2 3.09Å; R426-E429 WeakPolarHBondContact O-CB 3.36Å; R426-E429 PolarHBondContact O-N 3.36Å; E429-R432 PolarHBondContact O-N 2.89Å; E429-H433 WeakPolarHBondContact O-CB 3.41Å; E429-H433 PolarHBondContact O-N 3.33Å
430L94.1Very high90.6Very high26 Ų2669.9 Ų69.914%0.13637%0.368CS..Hα-helixtrans-60-46.5172.7171.961.1000111.6F413 A414 C415 F424 R426 R432 H433 R434F413-L430 HydrophobicContact CB-CB 4.11Å; F413-L430 HydrophobicContact CB-CD2 3.87Å; A414-L430 WeakPolarHBondContact O-CD1 3.43Å; A414-L430 VanDerWaalsContact O-CD2 3.23Å; A414-L430 WeakPolarHBondContact O-CD2 3.12Å; C415-L430 HydrophobicContact CB-CD1 3.86Å; F424-L430 HydrophobicContact CB-CB 4.3Å; F424-L430 HydrophobicContact CD2-CB 3.84Å; F424-L430 HydrophobicContact CD2-CD1 3.91Å; F424-L430 HydrophobicContact CD2-CG 4.48Å; F424-L430 HydrophobicContact CE2-CD1 4.1Å; F424-L430 HydrophobicContact CG-CB 4.26Å; R426-L430 PolarHBondContact O-N 3.13Å; L430-R432 VanDerWaalsContact C-N 3.27Å; L430-R432 PolarHBondContact O-N 3.32Å; L430-H433 CarbonylContact O-C 3.58Å; L430-H433 PolarHBondContact O-N 3.19Å; L430-H433 VanDerWaalsContact O-N 3.11Å; L430-R434 PolarHBondContact O-N 3.44Å
431S91.5Very high90.6Very high49 Ų4974.6 Ų74.634%0.34339%0.386SS..Hα-helixtrans-63.9-32.4-179.5-60.30000112.7S427S427-S431 VanDerWaalsContact O-CB 3.29Å; S427-S431 WeakPolarHBondContact O-CB 3.41Å; S427-S431 PolarHBondContact O-N 3.01Å; S427-S431 PolarHBondContact O-OG 2.94Å
432R90.8Very high90.7Very high101 Ų10175.1 Ų75.138%0.38138%0.378SS..Hα-helixtrans-72.2-41.9171.7178.7-174.968.3-159.2-2.6111.4D428 E429 L430 R435 R454D428-R432 WeakPolarHBondContact O-CB 3.47Å; D428-R432 PolarHBondContact O-N 3.42Å; E429-R432 PolarHBondContact O-N 2.89Å; L430-R432 VanDerWaalsContact C-N 3.27Å; L430-R432 PolarHBondContact O-N 3.32Å; R432-R435 WeakPolarHBondContact O-CB 3.18Å; R432-R435 PolarHBondContact O-N 3.12Å; R432-R454 HydrophobicContact CG-CG 4.18Å
433H92.8Very high90.9Very high27 Ų2772.6 Ų72.613%0.12537%0.369CS..Hα-helixtrans-64.3-40.5176.7165.875.6000112.2C415 C420 F424 E429 L430 R435 S436 H437C415-H433 VanDerWaalsContact SG-CD2 3.55Å; C415-H433 PolarHBondContact SG-NE2 2.99Å; C415-H433 VanDerWaalsContact SG-NE2 3.38Å; C420-H433 VanDerWaalsContact SG-CE1 3.55Å; C420-H433 PolarHBondContact SG-NE2 2.71Å; F424-H433 HydrophobicContact CE1-CB 4.05Å; F424-H433 HydrophobicContact CE2-CB 3.82Å; F424-H433 AromaticContact CE2-CD2 3.4Å; F424-H433 WeakPolarHBondContact CE2-CD2 3.39Å; F424-H433 AromaticContact CE2-CG 3.58Å; F424-H433 HydrophobicContact CZ-CB 3.45Å; F424-H433 VanDerWaalsContact CZ-CB 3.45Å; F424-H433 AromaticContact CZ-CD2 3.58Å; F424-H433 AromaticContact CZ-CG 3.27Å; F424-H433 AromaticContact CZ-ND1 3.69Å; E429-H433 WeakPolarHBondContact O-CB 3.41Å; E429-H433 PolarHBondContact O-N 3.33Å; L430-H433 CarbonylContact O-C 3.58Å; L430-H433 PolarHBondContact O-N 3.19Å; L430-H433 VanDerWaalsContact O-N 3.11Å; H433-R435 PolarHBondContact O-N 3.06Å; H433-S436 PolarHBondContact O-N 3.32Å; H433-S436 PolarHBondContact O-OG 2.67Å; H433-H437 AromaticContact CD2-NE2 3.27Å; H433-H437 PolarHBondContact CD2-NE2 3.42Å; H433-H437 VanDerWaalsContact CD2-NE2 3.27Å; H433-H437 AromaticContact CE1-CE1 3.7Å; H433-H437 AromaticContact CE1-NE2 3.05Å; H433-H437 PolarHBondContact CE1-NE2 3.16Å; H433-H437 AromaticContact NE2-CE1 3.9Å; H433-H437 AromaticContact NE2-NE2 2.35Å; H433-H437 PolarHBondContact NE2-NE2 2.83Å
434R92.1Very high91Very high153 Ų15370.2 Ų70.258%0.57736%0.363SS*.Hα-helixtrans-56.6-23.4177.1-167.316671.4-150.96.8113.5L430 S436 H437 S438L430-R434 PolarHBondContact O-N 3.44Å; R434-S436 VanDerWaalsContact C-N 3.34Å; R434-H437 PolarHBondContact O-N 3.39Å; R434-S438 PolarHBondContact O-N 3.43Å; R434-S438 PolarHBondContact O-OG 2.79Å
435R91.2Very high91.1Very high80 Ų8069 Ų6930%0.30236%0.358SS..Hα-helixtrans-74.6-15174.2-56.5175.7-167.7170.10.4114.3R432 H433 G439 V440 A453R432-R435 WeakPolarHBondContact O-CB 3.18Å; R432-R435 PolarHBondContact O-N 3.12Å; H433-R435 PolarHBondContact O-N 3.06Å; R435-G439 WeakPolarHBondContact O-CA 3.41Å; R435-G439 PolarHBondContact O-N 3.02Å; R435-V440 PolarHBondContact O-N 2.95Å; R435-A453 PolarHBondContact NH1-O 2.94Å
436S89Confident91.3Very high82 Ų8273.1 Ų73.157%0.57338%0.384SS*.Hα-helixtrans-74.4-33.2170.364.70000111.6H433 R434H433-S436 PolarHBondContact O-N 3.32Å; H433-S436 PolarHBondContact O-OG 2.67Å; R434-S436 VanDerWaalsContact C-N 3.34Å
437H89.6Confident91.5Very high65 Ų6572.6 Ų72.630%0.30139%0.392SS..Hα-helixtrans-71.4-44.2175.7-57.9-42.7000112C415 W417 C420 H433 R434C415-H437 PolarHBondContact SG-NE2 2.97Å; W417-H437 HydrophobicContact CD2-CB 3.73Å; W417-H437 AromaticContact CD2-CD2 3.95Å; W417-H437 AromaticContact CD2-CG 3.76Å; W417-H437 HydrophobicContact CE3-CB 3.66Å; W417-H437 HydrophobicContact CG-CB 4.34Å; W417-H437 AromaticContact CG-CD2 3.71Å; W417-H437 AromaticContact CG-CG 3.82Å; W417-H437 HydrophobicContact CH2-CB 4.17Å; W417-H437 HydrophobicContact CZ2-CB 4.24Å; W417-H437 HydrophobicContact CZ3-CB 3.89Å; C420-H437 WeakPolarHBondContact CB-NE2 3.42Å; C420-H437 PolarHBondContact SG-CE1 3.33Å; C420-H437 PolarHBondContact SG-NE2 3.25Å; H433-H437 AromaticContact CD2-NE2 3.27Å; H433-H437 PolarHBondContact CD2-NE2 3.42Å; H433-H437 VanDerWaalsContact CD2-NE2 3.27Å; H433-H437 AromaticContact CE1-CE1 3.7Å; H433-H437 AromaticContact CE1-NE2 3.05Å; H433-H437 PolarHBondContact CE1-NE2 3.16Å; H433-H437 AromaticContact NE2-CE1 3.9Å; H433-H437 AromaticContact NE2-NE2 2.35Å; H433-H437 PolarHBondContact NE2-NE2 2.83Å; R434-H437 PolarHBondContact O-N 3.39Å
438S88Confident91.7Very high68 Ų6871.8 Ų71.848%0.47639%0.387SS..SBendtrans-85.4-4.8179.464.20000114.8R434 V440R434-S438 PolarHBondContact O-N 3.43Å; R434-S438 PolarHBondContact O-OG 2.79Å; S438-V440 PolarHBondContact O-N 3.1Å; S438-V440 WeakPolarHBondContact OG-CG2 3.45Å
439G87.7Confident91.9Very high47 Ų4775 Ų7549%0.48540%0.399SS..  trans62.86.8-17800000115.7R435 K441R435-G439 WeakPolarHBondContact O-CA 3.41Å; R435-G439 PolarHBondContact O-N 3.02Å; G439-K441 PolarHBondContact O-N 3.48Å
440V91.6Very high92Very high76 Ų7679 Ų7946%0.46142%0.416SS..  trans-68.2119.5-169.7175.10000111.5R435 S438 P442R435-V440 PolarHBondContact O-N 2.95Å; S438-V440 PolarHBondContact O-N 3.1Å; S438-V440 WeakPolarHBondContact OG-CG2 3.45Å; V440-P442 VanDerWaalsContact O-CD 3.29Å; V440-P442 WeakPolarHBondContact O-CD 3.48Å
441K91.8Very high92Very high121 Ų12183.6 Ų83.653%0.52644%0.435SS..  trans-113.379.6-179.4-66.5174.4-171.6-176.70110.7G439 Y443 K451 F452 A453G439-K441 PolarHBondContact O-N 3.48Å; K441-Y443 VanDerWaalsContact C-N 3.35Å; K441-Y443 PolarHBondContact O-N 2.87Å; K441-K451 HydrophobicContact CB-CB 3.76Å; K441-F452 CarbonylContact C-O 3.16Å; K441-F452 VanDerWaalsContact C-O 3.26Å; K441-F452 WeakPolarHBondContact CA-O 3.23Å; K441-A453 HydrophobicContact CG-CB 4.39Å
442P90.4Very high92.1Very high74 Ų7483.2 Ų83.248%0.48143%0.427SS..  trans-82-8.4-16934.1-35.2000114.2V440 F452V440-P442 VanDerWaalsContact O-CD 3.29Å; V440-P442 WeakPolarHBondContact O-CD 3.48Å; P442-F452 WeakPolarHBondContact CD-O 3.43Å
443Y94.3Very high92.2Very high76 Ų7680 Ų8030%0.29842%0.422SS..EExtended strand (participates in β ladder)trans-102.198-177-55.3-75.8000110.4K441 K451 F452 S455K441-Y443 VanDerWaalsContact C-N 3.35Å; K441-Y443 PolarHBondContact O-N 2.87Å; Y443-K451 CarbonylContact O-C 3.59Å; Y443-F452 WeakPolarHBondContact CD2-O 3.35Å; Y443-F452 PolarHBondContact N-O 3.24Å; Y443-F452 VanDerWaalsContact N-O 3.08Å; Y443-F452 PolarHBondContact O-N 3.13Å; Y443-S455 VanDerWaalsContact CD2-N 3.32Å
444Q95.9Very high92.1Very high86 Ų8682.4 Ų82.440%0.40243%0.43SS..EExtended strand (participates in β ladder)trans-87.3142.8-179.8-176.8159.5-20.300112.4E449 K451 L458Q444-E449 WeakPolarHBondContact CG-O 3.3Å; Q444-K451 HydrophobicContact CB-CG 4.21Å; Q444-K451 HydrophobicContact CG-CG 4.22Å; Q444-L458 WeakPolarHBondContact O-CD2 3.44Å
445C95.3Very high92.1Very high0 Ų078 Ų780%042%0.423CS..  trans-77.2126171.5-174.30000111.6V447 E449 K450 F452 L458 H461C445-V447 PolarHBondContact O-N 3.39Å; C445-V447 PolarHBondContact SG-N 3.11Å; C445-E449 WeakPolarHBondContact O-CA 3.33Å; C445-E449 PolarHBondContact O-N 2.85Å; C445-K450 WeakPolarHBondContact CB-O 3.41Å; C445-K450 PolarHBondContact N-O 3.44Å; C445-F452 HydrophobicContact CB-CE2 4.42Å; C445-L458 HydrophobicContact CB-CD1 3.93Å; C445-H461 VanDerWaalsContact SG-CD2 3.57Å; C445-H461 PolarHBondContact SG-NE2 2.75Å
446P93.6Very high92.2Very high111 Ų11176.6 Ų76.672%0.72142%0.421SS*.THydrogen-bonded Turntrans-76.4-0.2178.332.2-36.7000114.3
447V92.9Very high92.5Very high95 Ų9576 Ų7658%0.57641%0.409SS*.THydrogen-bonded Turntrans-110-33.6-177.4-1750000112.6C445 H465C445-V447 PolarHBondContact O-N 3.39Å; C445-V447 PolarHBondContact SG-N 3.11Å; V447-H465 HydrophobicContact CB-CB 4.48Å; V447-H465 HydrophobicContact CG1-CB 4.14Å; V447-H465 HydrophobicContact CG2-CB 4.39Å
448C93.7Very high92.7Very high51 Ų5174 Ų7435%0.34540%0.401SS..THydrogen-bonded Turntrans-144.820.8-177.775.50000113.5K450 H461 H465C448-K450 PolarHBondContact O-N 3.1Å; C448-H461 PolarHBondContact SG-NE2 3.17Å; C448-H465 PolarHBondContact SG-CE1 2.93Å; C448-H465 PolarHBondContact SG-NE2 2.93Å
449E92.3Very high93.1Very high140 Ų14074 Ų7465%0.65440%0.401SS*.  trans57.3-1.6172.5-58.5-168.3-171.200118.2Q444 C445 K451Q444-E449 WeakPolarHBondContact CG-O 3.3Å; C445-E449 WeakPolarHBondContact O-CA 3.33Å; C445-E449 PolarHBondContact O-N 2.85Å; E449-K451 WeakPolarHBondContact O-CG 3.41Å; E449-K451 PolarHBondContact O-N 3.35Å
450K93.4Very high93.3Very high131 Ų13177.8 Ų77.857%0.5740%0.404SS*.  trans-55.5126.8175.5-68.5-165.8176.9-158.40110.6C445 C448 F452C445-K450 WeakPolarHBondContact CB-O 3.41Å; C445-K450 PolarHBondContact N-O 3.44Å; C448-K450 PolarHBondContact O-N 3.1Å; K450-F452 HydrophobicContact CB-CE2 4.01Å; K450-F452 HydrophobicContact CB-CZ 4.11Å; K450-F452 WeakPolarHBondContact O-CD2 3.44Å; K450-F452 WeakPolarHBondContact O-CE2 3.34Å
451K95.1Very high93.4Very high122 Ų12275.9 Ų75.953%0.5339%0.39SS..EExtended strand (participates in β ladder)trans-98.3139.3-175.8-63-179.4176.4174.40111.1K441 Y443 Q444 E449K441-K451 HydrophobicContact CB-CB 3.76Å; Y443-K451 CarbonylContact O-C 3.59Å; Q444-K451 HydrophobicContact CB-CG 4.21Å; Q444-K451 HydrophobicContact CG-CG 4.22Å; E449-K451 WeakPolarHBondContact O-CG 3.41Å; E449-K451 PolarHBondContact O-N 3.35Å
452F92.9Very high93.5Very high41 Ų4173.2 Ų73.218%0.1838%0.381CS..EExtended strand (participates in β ladder)trans-125.7145.6-177.4-59.7-88.9000111.4K441 P442 Y443 C445 K450 R454 H457 L458 H461K441-F452 CarbonylContact C-O 3.16Å; K441-F452 VanDerWaalsContact C-O 3.26Å; K441-F452 WeakPolarHBondContact CA-O 3.23Å; P442-F452 WeakPolarHBondContact CD-O 3.43Å; Y443-F452 WeakPolarHBondContact CD2-O 3.35Å; Y443-F452 PolarHBondContact N-O 3.24Å; Y443-F452 VanDerWaalsContact N-O 3.08Å; Y443-F452 PolarHBondContact O-N 3.13Å; C445-F452 HydrophobicContact CB-CE2 4.42Å; K450-F452 HydrophobicContact CB-CE2 4.01Å; K450-F452 HydrophobicContact CB-CZ 4.11Å; K450-F452 WeakPolarHBondContact O-CD2 3.44Å; K450-F452 WeakPolarHBondContact O-CE2 3.34Å; F452-R454 PolarHBondContact O-N 3.38Å; F452-H457 HydrophobicContact CB-CB 4.37Å; F452-H457 HydrophobicContact CD1-CB 3.94Å; F452-H457 HydrophobicContact CG-CB 4.41Å; F452-L458 HydrophobicContact CB-CB 4.38Å; F452-L458 HydrophobicContact CD2-CB 3.92Å; F452-L458 HydrophobicContact CD2-CD1 3.89Å; F452-L458 HydrophobicContact CE2-CD1 4.02Å; F452-L458 HydrophobicContact CG-CB 4.29Å; F452-H461 HydrophobicContact CE1-CB 4.12Å; F452-H461 HydrophobicContact CE2-CB 4.02Å; F452-H461 AromaticContact CE2-CD2 3.45Å; F452-H461 VanDerWaalsContact CE2-CD2 3.45Å; F452-H461 WeakPolarHBondContact CE2-CD2 3.42Å; F452-H461 AromaticContact CE2-CG 3.78Å; F452-H461 HydrophobicContact CZ-CB 3.55Å; F452-H461 AromaticContact CZ-CD2 3.47Å; F452-H461 VanDerWaalsContact CZ-CD2 3.47Å; F452-H461 WeakPolarHBondContact CZ-CD2 3.4Å; F452-H461 AromaticContact CZ-CG 3.33Å; F452-H461 AromaticContact CZ-ND1 3.87Å
453A91.7Very high93.6Very high34 Ų3476.3 Ų76.328%0.28139%0.387SS..SBendtrans-73.4-14.4174.100000113.7R435 K441R435-A453 PolarHBondContact NH1-O 2.94Å; K441-A453 HydrophobicContact CG-CB 4.39Å
454R91.3Very high93.4Very high77 Ų7776.7 Ų76.729%0.29140%0.397SS..SBendtrans-139.1137.8-172.2-67.6167.655.8163.8-2.5112.3R432 F452 D456 H457 L458R432-R454 HydrophobicContact CG-CG 4.18Å; F452-R454 PolarHBondContact O-N 3.38Å; R454-D456 IonicContact CZ-OD1 2.75Å; R454-D456 VanDerWaalsContact CZ-OD1 3.23Å; R454-D456 IonicContact NE-OD1 3.68Å; R454-D456 PolarHBondContact NE-OD1 3.38Å; R454-D456 IonicContact NH2-OD1 3.63Å; R454-D456 PolarHBondContact NH2-OD1 3.42Å; R454-D456 IonicContact NH2-OD2 2.82Å; R454-D456 PolarHBondContact NH2-OD2 3.01Å; R454-D456 PolarHBondContact O-N 3.14Å; R454-H457 HydrophobicContact CB-CB 4.31Å; R454-H457 WeakPolarHBondContact CD-NE2 3.44Å; R454-H457 PolarHBondContact NE-CE1 3.03Å; R454-H457 VanDerWaalsContact NE-CE1 3.3Å; R454-H457 PolarHBondContact NE-NE2 2.88Å; R454-H457 PolarHBondContact O-N 3.11Å; R454-L458 PolarHBondContact O-N 3.22Å
455S93.4Very high92.9Very high62 Ų6276 Ų7643%0.43439%0.393SS..Hα-helixtrans-64.6-34.9177.352.10000112.9Y443 H457 L458 S459Y443-S455 VanDerWaalsContact CD2-N 3.32Å; S455-H457 VanDerWaalsContact C-N 3.28Å; S455-H457 PolarHBondContact O-N 3.4Å; S455-L458 PolarHBondContact O-N 3.38Å; S455-S459 WeakPolarHBondContact O-CB 3.36Å; S455-S459 PolarHBondContact O-N 3.42Å; S455-S459 PolarHBondContact O-OG 3.3Å
456D92.6Very high92.2Very high49 Ų4985.4 Ų85.426%0.26243%0.429SS..Hα-helixtrans-67.7-29.3177.482.6-83.8000112.6R454 K460R454-D456 IonicContact CZ-OD1 2.75Å; R454-D456 VanDerWaalsContact CZ-OD1 3.23Å; R454-D456 IonicContact NE-OD1 3.68Å; R454-D456 PolarHBondContact NE-OD1 3.38Å; R454-D456 IonicContact NH2-OD1 3.63Å; R454-D456 PolarHBondContact NH2-OD1 3.42Å; R454-D456 IonicContact NH2-OD2 2.82Å; R454-D456 PolarHBondContact NH2-OD2 3.01Å; R454-D456 PolarHBondContact O-N 3.14Å; D456-K460 WeakPolarHBondContact O-CD 3.39Å; D456-K460 VanDerWaalsContact O-CG 3.24Å; D456-K460 WeakPolarHBondContact O-CG 3.39Å; D456-K460 PolarHBondContact O-N 3.33Å; D456-K460 WeakPolarHBondContact OD2-CE 3.32Å; D456-K460 IonicContact OD2-NZ 2.77Å; D456-K460 PolarHBondContact OD2-NZ 2.67Å
457H94.1Very high91.1Very high71 Ų7187 Ų8733%0.32943%0.425SS..Hα-helixtrans-73.4-44.5175.3-64.63.9000110.7F452 R454 S455 S459 K460 H461F452-H457 HydrophobicContact CB-CB 4.37Å; F452-H457 HydrophobicContact CD1-CB 3.94Å; F452-H457 HydrophobicContact CG-CB 4.41Å; R454-H457 HydrophobicContact CB-CB 4.31Å; R454-H457 WeakPolarHBondContact CD-NE2 3.44Å; R454-H457 PolarHBondContact NE-CE1 3.03Å; R454-H457 VanDerWaalsContact NE-CE1 3.3Å; R454-H457 PolarHBondContact NE-NE2 2.88Å; R454-H457 PolarHBondContact O-N 3.11Å; S455-H457 VanDerWaalsContact C-N 3.28Å; S455-H457 PolarHBondContact O-N 3.4Å; H457-S459 VanDerWaalsContact C-N 3.33Å; H457-S459 PolarHBondContact O-N 2.98Å; H457-K460 PolarHBondContact O-N 3.01Å; H457-H461 WeakPolarHBondContact O-CB 3.34Å; H457-H461 PolarHBondContact O-N 3.11Å
458L95.8Very high89.7Confident22 Ų2287.1 Ų87.112%0.11543%0.427CS..Hα-helixtrans-56.8-46.2170174.260.4000111.5Q444 C445 F452 R454 S455 K460 H461 I462Q444-L458 WeakPolarHBondContact O-CD2 3.44Å; C445-L458 HydrophobicContact CB-CD1 3.93Å; F452-L458 HydrophobicContact CB-CB 4.38Å; F452-L458 HydrophobicContact CD2-CB 3.92Å; F452-L458 HydrophobicContact CD2-CD1 3.89Å; F452-L458 HydrophobicContact CE2-CD1 4.02Å; F452-L458 HydrophobicContact CG-CB 4.29Å; R454-L458 PolarHBondContact O-N 3.22Å; S455-L458 PolarHBondContact O-N 3.38Å; L458-K460 VanDerWaalsContact C-N 3.32Å; L458-K460 PolarHBondContact O-N 3.38Å; L458-H461 WeakPolarHBondContact O-CB 3.22Å; L458-H461 PolarHBondContact O-N 3.39Å; L458-H461 VanDerWaalsContact O-N 3.13Å; L458-I462 HydrophobicContact CD1-CD1 3.76Å; L458-I462 HydrophobicContact CD1-CG1 3.86Å; L458-I462 HydrophobicContact CD2-CD1 4.4Å; L458-I462 HydrophobicContact CG-CD1 3.79Å; L458-I462 HydrophobicContact CG-CG1 4.33Å; L458-I462 WeakPolarHBondContact O-CG1 3.48Å; L458-I462 PolarHBondContact O-N 2.78Å
459S94.5Very high87.9Confident69 Ų6996 Ų9648%0.48345%0.454SS..Hα-helixtrans-64.9-30.4179.2-66.70000113.8S455 H457S455-S459 WeakPolarHBondContact O-CB 3.36Å; S455-S459 PolarHBondContact O-N 3.42Å; S455-S459 PolarHBondContact O-OG 3.3Å; H457-S459 VanDerWaalsContact C-N 3.33Å; H457-S459 PolarHBondContact O-N 2.98Å
460K93.4Very high86.2Confident125 Ų12595 Ų9554%0.54346%0.462SS..Hα-helixtrans-72.5-43.3169.8-72.8163.4-169.71660110.9D456 H457 L458 K463D456-K460 WeakPolarHBondContact O-CD 3.39Å; D456-K460 VanDerWaalsContact O-CG 3.24Å; D456-K460 WeakPolarHBondContact O-CG 3.39Å; D456-K460 PolarHBondContact O-N 3.33Å; D456-K460 WeakPolarHBondContact OD2-CE 3.32Å; D456-K460 IonicContact OD2-NZ 2.77Å; D456-K460 PolarHBondContact OD2-NZ 2.67Å; H457-K460 PolarHBondContact O-N 3.01Å; L458-K460 VanDerWaalsContact C-N 3.32Å; L458-K460 PolarHBondContact O-N 3.38Å; K460-K463 WeakPolarHBondContact O-CB 3.36Å; K460-K463 PolarHBondContact O-N 3.11Å
461H93.9Very high84.3Confident36 Ų3692 Ų9217%0.16747%0.469CS..Hα-helixtrans-64.1-41.9179.5173.268.5000113.2C445 C448 F452 H457 L458 K463 V464 H465C445-H461 VanDerWaalsContact SG-CD2 3.57Å; C445-H461 PolarHBondContact SG-NE2 2.75Å; C448-H461 PolarHBondContact SG-NE2 3.17Å; F452-H461 HydrophobicContact CE1-CB 4.12Å; F452-H461 HydrophobicContact CE2-CB 4.02Å; F452-H461 AromaticContact CE2-CD2 3.45Å; F452-H461 VanDerWaalsContact CE2-CD2 3.45Å; F452-H461 WeakPolarHBondContact CE2-CD2 3.42Å; F452-H461 AromaticContact CE2-CG 3.78Å; F452-H461 HydrophobicContact CZ-CB 3.55Å; F452-H461 AromaticContact CZ-CD2 3.47Å; F452-H461 VanDerWaalsContact CZ-CD2 3.47Å; F452-H461 WeakPolarHBondContact CZ-CD2 3.4Å; F452-H461 AromaticContact CZ-CG 3.33Å; F452-H461 AromaticContact CZ-ND1 3.87Å; H457-H461 WeakPolarHBondContact O-CB 3.34Å; H457-H461 PolarHBondContact O-N 3.11Å; L458-H461 WeakPolarHBondContact O-CB 3.22Å; L458-H461 PolarHBondContact O-N 3.39Å; L458-H461 VanDerWaalsContact O-N 3.13Å; H461-K463 PolarHBondContact O-N 3Å; H461-K463 VanDerWaalsContact O-N 3.15Å; H461-V464 VanDerWaalsContact O-CB 3.28Å; H461-V464 WeakPolarHBondContact O-CB 3.31Å; H461-V464 PolarHBondContact O-N 3.13Å; H461-H465 AromaticContact CD2-NE2 3.83Å; H461-H465 AromaticContact CE1-NE2 3.38Å; H461-H465 PolarHBondContact CE1-NE2 2.66Å; H461-H465 AromaticContact NE2-CD2 3.81Å; H461-H465 AromaticContact NE2-NE2 3.01Å; H461-H465 PolarHBondContact NE2-NE2 3.21Å
462I92.8Very high82Confident66 Ų6697.5 Ų97.534%0.33849%0.486SS..Hα-helixtrans-58-30.2176.7-71.5169.5000111.9L458 V464 H465 R466L458-I462 HydrophobicContact CD1-CD1 3.76Å; L458-I462 HydrophobicContact CD1-CG1 3.86Å; L458-I462 HydrophobicContact CD2-CD1 4.4Å; L458-I462 HydrophobicContact CG-CD1 3.79Å; L458-I462 HydrophobicContact CG-CG1 4.33Å; L458-I462 WeakPolarHBondContact O-CG1 3.48Å; L458-I462 PolarHBondContact O-N 2.78Å; I462-V464 PolarHBondContact O-N 3.3Å; I462-H465 PolarHBondContact O-N 3.28Å; I462-R466 PolarHBondContact O-N 3.39Å
463K92.6Very high79.7Confident138 Ų138101.5 Ų101.560%0.651%0.514SS*.Hα-helixtrans-66.1-25.7175.1-63.3176-176.9-173.30112.9K460 H461 R466 F467K460-K463 WeakPolarHBondContact O-CB 3.36Å; K460-K463 PolarHBondContact O-N 3.11Å; H461-K463 PolarHBondContact O-N 3Å; H461-K463 VanDerWaalsContact O-N 3.15Å; K463-R466 PolarHBondContact O-N 3.23Å; K463-F467 PolarHBondContact O-N 3.12Å
464V89.7Confident77.7Confident85 Ų85106 Ų10652%0.51554%0.538SS..Hα-helixtrans-69.7-34.9176.2-172.90000111.1H461 I462 F467 P468H461-V464 VanDerWaalsContact O-CB 3.28Å; H461-V464 WeakPolarHBondContact O-CB 3.31Å; H461-V464 PolarHBondContact O-N 3.13Å; I462-V464 PolarHBondContact O-N 3.3Å; V464-F467 CarbonylContact O-C 3.59Å; V464-P468 WeakPolarHBondContact O-CA 3.43Å
465H86.5Confident75.5Confident70 Ų70113.5 Ų113.532%0.32457%0.566SS.*Hα-helixtrans-71.5-30.5173-62.6-59.3000112.7V447 C448 H461 I462V447-H465 HydrophobicContact CB-CB 4.48Å; V447-H465 HydrophobicContact CG1-CB 4.14Å; V447-H465 HydrophobicContact CG2-CB 4.39Å; C448-H465 PolarHBondContact SG-CE1 2.93Å; C448-H465 PolarHBondContact SG-NE2 2.93Å; H461-H465 AromaticContact CD2-NE2 3.83Å; H461-H465 AromaticContact CE1-NE2 3.38Å; H461-H465 PolarHBondContact CE1-NE2 2.66Å; H461-H465 AromaticContact NE2-CD2 3.81Å; H461-H465 AromaticContact NE2-NE2 3.01Å; H461-H465 PolarHBondContact NE2-NE2 3.21Å; I462-H465 PolarHBondContact O-N 3.28Å
466R79.4Confident73Confident198 Ų198115.3 Ų115.375%0.74758%0.579SS**Hα-helixtrans-77.7-28.9175.5-165.9176.4-174.695.51.1113I462 K463I462-R466 PolarHBondContact O-N 3.39Å; K463-R466 PolarHBondContact O-N 3.23Å
467F71.5Confident70.9Confident146 Ų146118.2 Ų118.264%0.6461%0.609SS**SBendtrans-13673.9179.4-57.7-72.7000109.6K463 V464 R469K463-F467 PolarHBondContact O-N 3.12Å; V464-F467 CarbonylContact O-C 3.59Å; F467-R469 PolarHBondContact O-N 3.3Å
468P62.9Low68.5Low96 Ų96125.2 Ų125.262%0.62365%0.649SS**  trans-58.9132170.525.6-33.7000108.5V464 S470V464-P468 WeakPolarHBondContact O-CA 3.43Å; P468-S470 PolarHBondContact O-N 3.01Å
469R56.8Low67.1Low238 Ų238130.4 Ų130.490%0.89868%0.676SS**  trans-66.996.5175.2-87.5-179.7148.493.5-5.8109.3F467F467-R469 PolarHBondContact O-N 3.3Å
470S57Low65.7Low119 Ų119133.6 Ų133.683%0.83269%0.686SS**  trans-57138.6160.246.40000109P468P468-S470 PolarHBondContact O-N 3.01Å
471G52.5Low64.2Low69 Ų69134.1 Ų134.171%0.71169%0.694SS**  trans8156.1-17900000115.2
472R46.3Very low62.4Low237 Ų237139.8 Ų139.889%0.89473%0.725SS**  trans-100.183.1130.9-136.3-169.1-65.2-165.41.1107V474R472-V474 PolarHBondContact O-N 2.83Å; R472-V474 VanDerWaalsContact O-N 3.16Å
473T45.8Very low60.5Low124 Ų124144.4 Ų144.476%0.76175%0.749SS**  trans-62.3114.7168.9330000107.5R475T473-R475 PolarHBondContact O-N 3.41Å
474V48.3Very low58.4Low129 Ų129144.9 Ų144.978%0.78276%0.759SS**  trans-64.2110.3166.1179.20000105.6R472 S476R472-V474 PolarHBondContact O-N 2.83Å; R472-V474 VanDerWaalsContact O-N 3.16Å; V474-S476 PolarHBondContact O-N 3.09Å; V474-S476 VanDerWaalsContact O-N 3.1Å
475R44.8Very low56.1Low235 Ų235149.1 Ų149.189%0.88778%0.776SS**  trans-66.6106160.9-73.9-177.8177.4169.7-1.8105.4T473 A477T473-R475 PolarHBondContact O-N 3.41Å; R475-A477 PolarHBondContact O-N 3.12Å; R475-A477 VanDerWaalsContact O-N 3.11Å
476S42Very low53.8Low100 Ų100155.2 Ų155.270%0.69981%0.811SS**  trans-55.7118.1165.5-610000107.6V474 N478V474-S476 PolarHBondContact O-N 3.09Å; V474-S476 VanDerWaalsContact O-N 3.1Å; S476-N478 PolarHBondContact O-N 3.43Å
477A47.7Very low51.7Low109 Ų109151.7 Ų151.790%0.90182%0.816SS**  trans-69.5123.1155.400000106.1R475R475-A477 PolarHBondContact O-N 3.12Å; R475-A477 VanDerWaalsContact O-N 3.11Å
478N44.7Very low49.9Very low218 Ų218152.2 Ų152.2100%1.16683%0.832SS**  trans-148.10-177-170115.2000107.7S476S476-N478 PolarHBondContact O-N 3.43Å

Retrieved 478 of 478 residues in 613.4 ms (Link to these results)