A0A087YMD9_POEFO Loading...

Homeobox protein

AlphaFold DB (A0A3Q2QEI4), UniProt , Accession A0A087YMD9, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 312 aa.

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(Predicted Aligned Error values between residue pairs)
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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
1M39.9Very low46.2Very low237 Ų237153.4 Ų153.4100%1.16781%0.812SS**  0129.80-73.7152.973.400108
2S43.5Very low46.1Very low123 Ų123155.9 Ų155.986%0.8682%0.815SS**  trans71.8100.7162.4-56.10000120.3
3S47.6Very low45.3Very low93 Ų93157.4 Ų157.465%0.6582%0.815SS**  trans-58.1143.8155.7175.20000112.9
4M49.5Very low44.9Very low184 Ų184158.1 Ų158.191%0.90682%0.82SS**  trans-16793.4154.3-98.2161-163.700106.9
5R52.5Low45Very low221 Ų221155.3 Ų155.383%0.83481%0.812SS**  62105.983.3-68.7-172.8-164.3-1784.8114.3
6D46Very low44.4Very low157 Ų157150.3 Ų150.384%0.8481%0.81SS**  trans-56.3151.2148-66.3-53.7000110.5
7P55Low43.9Very low115 Ų115150.9 Ų150.975%0.74781%0.813SS**  -142.4134.8105.523.8-2.9000112.7
8L44.8Very low43.7Very low155 Ų155154.1 Ų154.181%0.81282%0.818SS**  65111.891.1-66.9176.2000116.3
9N38.9Very low43.4Very low122 Ų122155.1 Ų155.165%0.65282%0.822SS**  trans-27129.7152.8-173.421.4000115D11N9-D11 PolarHBondContact ND2-OD2 3.02Å
10I50.1Low43.2Very low152 Ų152151.9 Ų151.978%0.77982%0.819SS**  trans-133102160.3-63.8176.8000107.6
11D39.9Very low42.7Very low128 Ų128149.6 Ų149.668%0.68482%0.815SS**  trans-60.5128.2170.7-73.5-69.8000111.6N9 H13N9-D11 PolarHBondContact ND2-OD2 3.02Å; D11-H13 PolarHBondContact O-N 3.1Å
12H45.2Very low42.8Very low184 Ų184143.6 Ų143.685%0.85279%0.791SS**  trans-76.2107.7171-87.3-85.8000110.6L14H12-L14 PolarHBondContact O-N 3.11Å
13H35.8Very low42.8Very low175 Ų175145.5 Ų145.581%0.8179%0.787SS**  trans-72.498170.7-152-90.8000110D11 T15D11-H13 PolarHBondContact O-N 3.1Å; H13-T15 PolarHBondContact O-N 3.34Å
14L40.6Very low42.4Very low168 Ų168149.6 Ų149.688%0.8880%0.795SS**  trans-86.9102.3168.9-134.982.7000109.1H12 G16H12-L14 PolarHBondContact O-N 3.11Å; L14-G16 PolarHBondContact O-N 3.19Å
15T45.4Very low42Very low115 Ų115147 Ų14771%0.70679%0.789SS**  trans-66.4112.8171.644.50000110.4H13H13-T15 PolarHBondContact O-N 3.34Å
16G35.2Very low41.2Very low75 Ų75141.2 Ų141.277%0.77379%0.789SS**  trans-68.1126.9173.400000112.6L14 K18L14-G16 PolarHBondContact O-N 3.19Å; G16-K18 PolarHBondContact O-N 2.66Å
17N36.5Very low40.9Very low162 Ų162141.1 Ų141.187%0.86679%0.788SS**  trans-73.5110.9167.5-95.2-6.6000109.9L19N17-L19 PolarHBondContact O-N 3.29Å
18K39.8Very low40.2Very low208 Ų208140.4 Ų140.490%0.90479%0.792SS**  trans-74.6111.3173.4-164.7175.6-176.5-176.20109.7G16 A20G16-K18 PolarHBondContact O-N 2.66Å; K18-A20 PolarHBondContact O-N 3.43Å
19L39Very low39.9Very low172 Ų172142 Ų14290%0.90180%0.797SS**  trans-67115167.7-87139.8000109.5N17N17-L19 PolarHBondContact O-N 3.29Å
20A38.7Very low39.9Very low91 Ų91141 Ų14175%0.75281%0.806SS**  trans-84.6118170.500000110K18K18-A20 PolarHBondContact O-N 3.43Å
21S33.7Very low39.3Very low105 Ų105139.6 Ų139.673%0.73481%0.81SS**  trans-67.1122.5171.9-175.20000110.1
22T41.4Very low39Very low110 Ų110138.7 Ų138.768%0.67581%0.814SS**  trans-96.5112.9174.8-58.40000109.2
23H44Very low38.5Very low164 Ų164138 Ų13876%0.75982%0.815SS**  trans-71.8133.3168.5-75.2-97.2000110.2
24H38.1Very low38.8Very low178 Ų178137.9 Ų137.982%0.82482%0.815SS**  trans-90.4105.4174-47.9-72.8000109.2
25T41.7Very low38.6Very low129 Ų129135.9 Ų135.979%0.79181%0.812SS**  trans-91.5118.3169.9-41.30000108.8
26A34.8Very low38Very low100 Ų100138.2 Ų138.283%0.82682%0.819SS**  trans-73.9122.9175.500000110.5
27L39.9Very low38Very low156 Ų156144 Ų14482%0.81783%0.826SS**  trans-109.3113.4171.2-101.4154.4000108.8
28A40.7Very low37.9Very low100 Ų100147.8 Ų147.883%0.82683%0.828SS**  trans-66.3130.5170.700000110
29M38.7Very low37.4Very low187 Ų187143 Ų14392%0.92182%0.822SS**  trans-101.2106171.8-59.9-158.1-172.300108.7
30A38.4Very low37.3Very low103 Ų103141.6 Ų141.685%0.85182%0.819SS**  trans-85.7122.6167.300000109.4
31S37.6Very low37.2Very low122 Ų122143.8 Ų143.885%0.85382%0.819SS**  trans-64.3131.2168.8-76.80000111.1
32S33Very low37.1Very low109 Ų109143.6 Ų143.676%0.76282%0.817SS**  trans-146.1102.8150.1-167.10000108.1
33L36.4Very low37Very low170 Ų170147.5 Ų147.589%0.8983%0.825SS**  trans-105.6110171.3-75.8169.1000107.3
34Q41.8Very low36.5Very low171 Ų171147.5 Ų147.580%0.79983%0.825SS**  trans-97.2133.8159.3-76.2179.1-1800108.4
35P36.4Very low36.1Very low126 Ų126148.1 Ų148.182%0.81882%0.82SS**  trans-88.1114.5173.828-19.9000110.1
36L32.6Very low35.9Very low165 Ų165149 Ų14986%0.86482%0.819SS**  trans-87.4108.9167.9-140.478.5000108.4R38L36-R38 PolarHBondContact O-N 3.2Å
37Q35.5Very low35.9Very low197 Ų197152.4 Ų152.492%0.92182%0.818SS**  trans-60.3129.2168.1-81.5172.2-71.300109.5
38R32.8Very low35.5Very low240 Ų240149.9 Ų149.991%0.90681%0.809SS**  trans-122.3112164.4-149.2173.3-125-118.51.8110L36L36-R38 PolarHBondContact O-N 3.2Å
39S30.9Very low35.2Very low109 Ų109153.7 Ų153.776%0.76281%0.809SS**  trans-37.4134.2165.4169.80000113
40V36.8Very low35.1Very low141 Ų141150.6 Ų150.686%0.85580%0.801SS**  trans-116.7115160.3-74.30000107.6
41D35.3Very low35.1Very low138 Ų138152.8 Ų152.874%0.73880%0.803SS**  trans-149.5156.9157.9-140.1-44.8000110.1
42S31.8Very low35.1Very low101 Ų101152 Ų15271%0.70680%0.797SS**  trans9884.2168.9-55.40000119.1
43K40.5Very low35.1Very low192 Ų192154.1 Ų154.184%0.83580%0.801SS**  49.1122.5109-67.3-179179.1176.20120.3
44H31.8Very low35.1Very low163 Ų163151.7 Ų151.776%0.75579%0.793SS**  163.6147.2125.9-125.2-138.9000106.3
45R31Very low34.8Very low191 Ų191148.6 Ų148.672%0.72179%0.79SS**  cis-178.4136.817.8-173.9175.6-173.4162.8-4.8108.1
46L37.5Very low34.6Very low147 Ų147147.9 Ų147.977%0.7779%0.788SS**  trans60.4139.4148.2-62.1171.3000124.2
47E34.3Very low35.4Very low172 Ų172145 Ų14580%0.80478%0.78SS**  trans-66.6153.2170.7-80.9-169.413000116.1
48V32.8Very low35.2Very low103 Ų103144.2 Ų144.262%0.62478%0.776SS**  trans58.6128135.4-177.50000118.1
49H33.6Very low35.4Very low181 Ų181136.7 Ų136.784%0.83876%0.76SS**  -175.3128.1116-92.583.1000110.6
50T37Very low35.6Very low121 Ų121137.2 Ų137.274%0.74276%0.758SS**  trans-72.3142.4165.349.30000110.8
51V37.8Very low35.7Very low150 Ų150139.2 Ų139.291%0.90976%0.758SS**  trans-175152.9131.2-85.70000111
52S37Very low36.1Very low104 Ų104142.5 Ų142.573%0.72777%0.766SS**  trans-78.5162.5-172.9-43.60000115.7
53D33.2Very low36.7Very low155 Ų155146.3 Ų146.383%0.82977%0.772SS**  trans73.3148.2140-90.8-46.4000123.7
54T37.4Very low36.7Very low119 Ų119145.2 Ų145.273%0.7377%0.768SS**  trans86.4112.1151.2-170.60000122.5
55S33.9Very low37.3Very low106 Ų106144 Ų14474%0.74177%0.766SS**  trans73.3110.8136.564.30000122.8
56S33.8Very low37.8Very low111 Ų111140.4 Ų140.478%0.77676%0.757SS**  trans-43.2164.1138.9-142.90000112.8
57P48.5Very low37.8Very low105 Ų105140 Ų14068%0.68276%0.755SS**  cis-149.6177.133.140.9-18.3000119.4
58E32.6Very low38.4Very low179 Ų179139.9 Ų139.984%0.83675%0.752SS**  trans63.9151.7156.8-80.9-154101.500119
59S35.5Very low39.2Very low82 Ų82142.5 Ų142.557%0.57376%0.763SS**  cis-169178.4-24.842.90000104.4
60V35.7Very low39.7Very low121 Ų121141.3 Ų141.373%0.73376%0.762SS**  trans95.2119.6161.4-150.50000117.6
61E38.4Very low40.1Very low182 Ų182142 Ų14285%0.8576%0.762SS**  trans109.7116.5149.8-45.1-151.2138.300121.7
62K43Very low40.3Very low207 Ų207139.3 Ų139.390%0.975%0.75SS**  trans-72.6126.4170.6-68.5164.5173170.60109
63E44.5Very low40.7Very low181 Ų181140 Ų14085%0.84676%0.755SS**  trans-126.1118.4153.7-78.1-151.5139.800112.1I65E63-I65 PolarHBondContact O-N 3.37Å
64K41.8Very low41.5Very low169 Ų169139.5 Ų139.574%0.73575%0.752SS**  trans-7997.1174.5174.2-171.8177.6-122.20107.7Q66K64-Q66 PolarHBondContact O-N 3.19Å
65I43.5Very low42.4Very low139 Ų139137.6 Ų137.671%0.71374%0.737SS**  trans-82.4100.1169.1-59.4-176.7000108.8E63 N67E63-I65 PolarHBondContact O-N 3.37Å; I65-N67 PolarHBondContact O-N 3.19Å
66Q42.7Very low43.6Very low115 Ų115137.8 Ų137.854%0.53774%0.736SS.*  trans-85.990.1173-175.6169.3-1.400108.7K64 K68K64-Q66 PolarHBondContact O-N 3.19Å; Q66-K68 PolarHBondContact O-N 3.24Å; Q66-K68 VanDerWaalsContact O-N 3.11Å
67N36.2Very low44.7Very low138 Ų138136.7 Ų136.774%0.73873%0.728SS**  trans-80.588167.7-86.46.9000109.7I65I65-N67 PolarHBondContact O-N 3.19Å
68K48.2Very low45.2Very low170 Ų170139.5 Ų139.574%0.73973%0.73SS**  trans-77.6115.4152.6-81.9-177.9171.3-176.70107.1Q66Q66-K68 PolarHBondContact O-N 3.24Å; Q66-K68 VanDerWaalsContact O-N 3.11Å
69N48.2Very low46.6Very low157 Ų157139.6 Ų139.684%0.8473%0.727SS**  trans-122.6125.8154.5-81.5-27000107.8
70D45.2Very low48Very low156 Ų156145 Ų14583%0.83474%0.741SS**  trans-82.3155-177.1-148.8-26.7000111.1
71D45.4Very low49.6Very low135 Ų135151.1 Ų151.172%0.72275%0.75SS**  trans62.5140.2149.4-15442.8000124.4
72S42.6Very low51.5Low94 Ų94150.9 Ų150.966%0.65775%0.749SS**  trans104.5116.5147-91.10000121.5
73S43.6Very low53.5Low119 Ų119151.6 Ų151.683%0.83275%0.746SS**  trans91.283.6162730000118.8D75S73-D75 PolarHBondContact O-N 3.47Å
74D51.3Low55.4Low144 Ų144153.2 Ų153.277%0.7775%0.745SS**  trans-75.888.8161.7-147.2-32000109.7P76D74-P76 WeakPolarHBondContact O-CD 3.45Å
75D57Low57.7Low80 Ų80152.9 Ų152.943%0.42875%0.746SS.*  trans-95.7104.5159.5176.68.8000108.2S73 S77 K78S73-D75 PolarHBondContact O-N 3.47Å; D75-S77 PolarHBondContact O-N 3.35Å; D75-S77 VanDerWaalsContact O-N 3.1Å; D75-S77 WeakPolarHBondContact OD1-CB 3.41Å; D75-S77 PolarHBondContact OD1-N 2.79Å; D75-S77 PolarHBondContact OD1-OG 3.39Å; D75-S77 PolarHBondContact OD2-OG 3.37Å; D75-K78 IonicContact OD2-NZ 2.85Å
76P57.4Low60Low110 Ų110155.7 Ų155.771%0.71475%0.747SS**THydrogen-bonded Turntrans-73.72.8-174.627.7-33.3000114.1D74D74-P76 WeakPolarHBondContact O-CD 3.45Å
77S57.8Low62.5Low87 Ų87152.3 Ų152.361%0.60874%0.735SS**THydrogen-bonded Turntrans-96.3-2.9-165.670.50000117.5D75D75-S77 PolarHBondContact O-N 3.35Å; D75-S77 VanDerWaalsContact O-N 3.1Å; D75-S77 WeakPolarHBondContact OD1-CB 3.41Å; D75-S77 PolarHBondContact OD1-N 2.79Å; D75-S77 PolarHBondContact OD1-OG 3.39Å; D75-S77 PolarHBondContact OD2-OG 3.37Å
78K59.1Low65.3Low165 Ų165153 Ų15372%0.71773%0.733SS**  trans-123.811-170.4-69.4176.8-171.8149.50118.3D75 K80D75-K78 IonicContact OD2-NZ 2.85Å; K78-K80 PolarHBondContact O-N 3.48Å
79K60.7Low67.7Low181 Ų181147.8 Ų147.879%0.78771%0.71SS**  trans-77.864.6177.7-66.4175.5-174164.50112.2R81K79-R81 PolarHBondContact O-N 3.1Å; K79-R81 VanDerWaalsContact O-N 3.1Å
80K65.4Low70.1Confident196 Ų196143.8 Ų143.885%0.85269%0.692SS**  trans-54.5113.4164.6-155.5173.3-172.6175.10106.6K78 Q82K78-K80 PolarHBondContact O-N 3.48Å; K80-Q82 PolarHBondContact O-N 2.79Å
81R69.1Low72.6Confident249 Ų249141.1 Ų141.194%0.9469%0.685SS**  trans-49100.7-171.9-70.5173.193.9-163.111.8110.6K79 R83K79-R81 PolarHBondContact O-N 3.1Å; K79-R81 VanDerWaalsContact O-N 3.1Å; R81-R83 PolarHBondContact O-N 3.29Å
82Q79.2Confident75.1Confident176 Ų176141.3 Ų141.382%0.82268%0.682SS**PPolyproline II helixtrans-60.1122.9174.9-171.969.51300107.8K80 R84K80-Q82 PolarHBondContact O-N 2.79Å; Q82-R84 PolarHBondContact O-N 3.2Å
83R84.2Confident77.8Confident222 Ų222138.1 Ų138.184%0.83866%0.657SS**PPolyproline II helixtrans-60.3128.3177.5-175.8178.7177.6-159.91.5108.4R81 Q85R81-R83 PolarHBondContact O-N 3.29Å; R83-Q85 PolarHBondContact O-N 3.34Å
84R84.1Confident80.4Confident216 Ų216135.9 Ų135.982%0.81564%0.635SS**PPolyproline II helixtrans-56.6134.4177.2-64.2-177.6-177-168.3-0.9109.6Q82 R86Q82-R84 PolarHBondContact O-N 3.2Å; R84-R86 PolarHBondContact O-N 3.48Å
85Q90.1Very high82.6Confident162 Ų162135.2 Ų135.276%0.75763%0.627SS**PPolyproline II helixtrans-59.9138.8177.5-165.959.820.100110.6R83R83-Q85 PolarHBondContact O-N 3.34Å
86R93.3Very high84.6Confident198 Ų198133.8 Ų133.875%0.74762%0.618SS**PPolyproline II helixtrans-76.5137.3178.9-172.7176.8-179.2-178.3-1.4109.5R84R84-R86 PolarHBondContact O-N 3.48Å
87T93.9Very high86.5Confident44 Ų44128.5 Ų128.527%0.2758%0.584SS.*PPolyproline II helixtrans-82.7132.4172.4-53.60000109.6F89 L121 R125T87-F89 HydrophobicContact CG2-CD1 4.35Å; T87-F89 HydrophobicContact CG2-CE1 4.01Å; T87-F89 HydrophobicContact CG2-CZ 4.37Å; T87-L121 HydrophobicContact CG2-CD2 4.35Å; T87-R125 WeakPolarHBondContact OG1-CD 3.37Å; T87-R125 PolarHBondContact OG1-NH1 2.99Å
88H96.1Very high88.4Confident151 Ų151126.3 Ų126.370%0.69956%0.564SS**PPolyproline II helixtrans-102129.8169.3-72-110.3000107.9
89F97.8Very high90.3Very high61 Ų61119.8 Ų119.827%0.26854%0.54SS..PPolyproline II helixtrans-94.4139.2179.3-58.6-70.9000109.4T87 Q93 L94 L121 R125 W129T87-F89 HydrophobicContact CG2-CD1 4.35Å; T87-F89 HydrophobicContact CG2-CE1 4.01Å; T87-F89 HydrophobicContact CG2-CZ 4.37Å; F89-Q93 HydrophobicContact CB-CB 4.5Å; F89-L94 HydrophobicContact CB-CD1 4.45Å; F89-L94 HydrophobicContact CB-CD2 3.71Å; F89-L94 HydrophobicContact CB-CG 3.83Å; F89-L94 HydrophobicContact CD2-CD2 4.17Å; F89-L94 HydrophobicContact CG-CD2 4.13Å; F89-L121 HydrophobicContact CD1-CD1 3.69Å; F89-L121 HydrophobicContact CD1-CD2 3.94Å; F89-L121 HydrophobicContact CD1-CG 4.5Å; F89-L121 HydrophobicContact CE1-CD1 3.6Å; F89-L121 HydrophobicContact CE1-CD2 3.9Å; F89-L121 HydrophobicContact CE1-CG 4.4Å; F89-R125 HydrophobicContact CE1-CB 4.43Å; F89-W129 AromaticContact CD2-CD1 3.93Å; F89-W129 AromaticContact CE2-CD1 3.62Å; F89-W129 HydrophobicContact CZ-CB 4.36Å; F89-W129 AromaticContact CZ-CD1 3.95Å
90T98.5Very high92Very high73 Ų73111.5 Ų111.545%0.44851%0.505SS..PPolyproline II helixtrans-72.1164170.972.10000110.4Q92 Q93 L94T90-Q92 PolarHBondContact O-N 2.87Å; T90-Q93 PolarHBondContact O-N 2.75Å; T90-Q93 VanDerWaalsContact OG1-CG 3.26Å; T90-Q93 WeakPolarHBondContact OG1-CG 3.27Å; T90-Q93 PolarHBondContact OG1-N 3.31Å; T90-L94 WeakPolarHBondContact O-CG 3.43Å; T90-L94 PolarHBondContact O-N 3.31Å; T90-L94 VanDerWaalsContact O-N 3.13Å
91S98.1Very high93.6Very high100 Ų100102.4 Ų102.470%0.69947%0.466SS*.Hα-helixtrans-59.2-46.4177.4-168.30000111.8Q93 L94 Q95S91-Q93 PolarHBondContact O-N 3.38Å; S91-L94 WeakPolarHBondContact O-CB 3.49Å; S91-L94 PolarHBondContact O-N 3.1Å; S91-L94 VanDerWaalsContact O-N 3.14Å; S91-Q95 PolarHBondContact O-N 3.5Å
92Q98.1Very high95Very high139 Ų13997 Ų9765%0.6545%0.451SS*.Hα-helixtrans-57.7-46177.5-174.8-167-3.500111.9T90 L94 Q95 E96T90-Q92 PolarHBondContact O-N 2.87Å; Q92-L94 VanDerWaalsContact C-N 3.3Å; Q92-L94 PolarHBondContact O-N 3.45Å; Q92-Q95 WeakPolarHBondContact O-CB 3.43Å; Q92-Q95 PolarHBondContact O-N 3.48Å; Q92-Q95 VanDerWaalsContact O-N 3.16Å; Q92-E96 PolarHBondContact O-N 2.95Å; Q92-E96 VanDerWaalsContact O-N 3.07Å
93Q98.3Very high95.8Very high28 Ų2897.3 Ų97.313%0.13145%0.445CS..Hα-helixtrans-59.9-42177.4-72171.4-22.500111.7F89 T90 S91 Q95 E96 L97 T119F89-Q93 HydrophobicContact CB-CB 4.5Å; T90-Q93 PolarHBondContact O-N 2.75Å; T90-Q93 VanDerWaalsContact OG1-CG 3.26Å; T90-Q93 WeakPolarHBondContact OG1-CG 3.27Å; T90-Q93 PolarHBondContact OG1-N 3.31Å; S91-Q93 PolarHBondContact O-N 3.38Å; Q93-Q95 VanDerWaalsContact C-N 3.33Å; Q93-E96 PolarHBondContact O-N 2.93Å; Q93-L97 WeakPolarHBondContact O-CB 3.38Å; Q93-L97 WeakPolarHBondContact O-CD1 3.27Å; Q93-L97 WeakPolarHBondContact O-CG 3.34Å; Q93-L97 PolarHBondContact O-N 2.88Å; Q93-T119 PolarHBondContact NE2-O 3.27Å
94L98.4Very high96.5Very high71 Ų7189.8 Ų89.837%0.37242%0.421SS..Hα-helixtrans-65.4-37.6177.4-68175.3000112.1F89 T90 S91 Q92 E98 W129F89-L94 HydrophobicContact CB-CD1 4.45Å; F89-L94 HydrophobicContact CB-CD2 3.71Å; F89-L94 HydrophobicContact CB-CG 3.83Å; F89-L94 HydrophobicContact CD2-CD2 4.17Å; F89-L94 HydrophobicContact CG-CD2 4.13Å; T90-L94 WeakPolarHBondContact O-CG 3.43Å; T90-L94 PolarHBondContact O-N 3.31Å; T90-L94 VanDerWaalsContact O-N 3.13Å; S91-L94 WeakPolarHBondContact O-CB 3.49Å; S91-L94 PolarHBondContact O-N 3.1Å; S91-L94 VanDerWaalsContact O-N 3.14Å; Q92-L94 VanDerWaalsContact C-N 3.3Å; Q92-L94 PolarHBondContact O-N 3.45Å; L94-E98 VanDerWaalsContact O-CB 3.28Å; L94-E98 WeakPolarHBondContact O-CB 3.46Å; L94-E98 PolarHBondContact O-N 3.02Å; L94-W129 HydrophobicContact CD2-CZ2 4.47Å; L94-W129 VanDerWaalsContact CD2-NE1 3.28Å
95Q98.3Very high97.1Very high130 Ų13084.4 Ų84.461%0.60740%0.401SS*.Hα-helixtrans-61.8-48.7176.7-179.3176.6-29.600111.2S91 Q92 Q93 L97 E98 A99S91-Q95 PolarHBondContact O-N 3.5Å; Q92-Q95 WeakPolarHBondContact O-CB 3.43Å; Q92-Q95 PolarHBondContact O-N 3.48Å; Q92-Q95 VanDerWaalsContact O-N 3.16Å; Q93-Q95 VanDerWaalsContact C-N 3.33Å; Q95-L97 PolarHBondContact O-N 3.42Å; Q95-E98 PolarHBondContact O-N 3.27Å; Q95-A99 WeakPolarHBondContact O-CB 3.25Å; Q95-A99 PolarHBondContact O-N 2.89Å
96E98Very high97.5Very high50 Ų5083.6 Ų83.623%0.23439%0.392CS..Hα-helixtrans-64.7-41.5178.8-65.9-54.115400112.7Q92 Q93 E98 A99 T100 W118 T119Q92-E96 PolarHBondContact O-N 2.95Å; Q92-E96 VanDerWaalsContact O-N 3.07Å; Q93-E96 PolarHBondContact O-N 2.93Å; E96-E98 VanDerWaalsContact C-N 3.32Å; E96-E98 PolarHBondContact O-N 3.04Å; E96-A99 PolarHBondContact O-N 3.29Å; E96-T100 WeakPolarHBondContact O-CB 3.44Å; E96-T100 PolarHBondContact O-N 3.42Å; E96-T100 PolarHBondContact O-OG1 3.34Å; E96-W118 HydrophobicContact CB-CH2 4.25Å; E96-W118 HydrophobicContact CB-CZ2 4.01Å; E96-W118 HydrophobicContact CG-CH2 4.41Å; E96-W118 WeakPolarHBondContact OE2-CH2 3.42Å; E96-W118 WeakPolarHBondContact OE2-CZ3 3.36Å; E96-T119 HydrophobicContact CB-CG2 4.04Å
97L98.4Very high97.7Very high0 Ų074.4 Ų74.40%036%0.358CS..Hα-helixtrans-62.8-40.1176-72168.2000111.5Q93 Q95 F101 I115 L121 V126 W129 F130Q93-L97 WeakPolarHBondContact O-CB 3.38Å; Q93-L97 WeakPolarHBondContact O-CD1 3.27Å; Q93-L97 WeakPolarHBondContact O-CG 3.34Å; Q93-L97 PolarHBondContact O-N 2.88Å; Q95-L97 PolarHBondContact O-N 3.42Å; L97-F101 WeakPolarHBondContact O-CB 3.32Å; L97-F101 PolarHBondContact O-N 2.91Å; L97-I115 HydrophobicContact CD2-CG2 3.62Å; L97-L121 HydrophobicContact CD1-CD1 4.19Å; L97-V126 HydrophobicContact CD2-CG1 4.11Å; L97-W129 HydrophobicContact CB-CD2 4Å; L97-W129 HydrophobicContact CB-CE3 3.92Å; L97-W129 HydrophobicContact CB-CH2 3.62Å; L97-W129 HydrophobicContact CB-CZ2 3.65Å; L97-W129 HydrophobicContact CB-CZ3 3.75Å; L97-W129 HydrophobicContact CD1-CD2 3.87Å; L97-W129 HydrophobicContact CD1-CE3 4.46Å; L97-W129 HydrophobicContact CD1-CG 3.88Å; L97-W129 HydrophobicContact CD2-CD2 4.44Å; L97-W129 HydrophobicContact CD2-CE3 4.26Å; L97-W129 HydrophobicContact CG-CD2 4.34Å; L97-W129 HydrophobicContact CG-CE3 4.45Å; L97-F130 HydrophobicContact CD2-CE2 3.86Å
98E98.3Very high97.9Very high41 Ų4177.5 Ų77.519%0.19237%0.373CS..Hα-helixtrans-71.7-42.8177.4-168.164.2-142.500112.2L94 Q95 E96 T100 F101 Q102 R133L94-E98 VanDerWaalsContact O-CB 3.28Å; L94-E98 WeakPolarHBondContact O-CB 3.46Å; L94-E98 PolarHBondContact O-N 3.02Å; Q95-E98 PolarHBondContact O-N 3.27Å; E96-E98 VanDerWaalsContact C-N 3.32Å; E96-E98 PolarHBondContact O-N 3.04Å; E98-T100 VanDerWaalsContact C-N 3.25Å; E98-T100 PolarHBondContact O-N 3.03Å; E98-F101 WeakPolarHBondContact O-CB 3.49Å; E98-F101 PolarHBondContact O-N 3.3Å; E98-F101 VanDerWaalsContact O-N 3.08Å; E98-Q102 WeakPolarHBondContact O-CG 3.4Å; E98-Q102 PolarHBondContact O-N 3.39Å; E98-R133 IonicContact OE1-CZ 2.91Å; E98-R133 IonicContact OE1-NE 3.37Å; E98-R133 PolarHBondContact OE1-NE 3.37Å; E98-R133 IonicContact OE1-NH2 3.17Å; E98-R133 PolarHBondContact OE1-NH2 3.35Å; E98-R133 WeakPolarHBondContact OE2-CD 3.4Å; E98-R133 IonicContact OE2-CZ 3.42Å; E98-R133 IonicContact OE2-NE 2.65Å; E98-R133 PolarHBondContact OE2-NE 2.96Å; E98-R133 IonicContact OE2-NH1 3.08Å; E98-R133 PolarHBondContact OE2-NH1 3.4Å; E98-R133 IonicContact OE2-NH2 2.83Å; E98-R133 PolarHBondContact OE2-NH2 3.47Å; E98-R133 VanDerWaalsContact OE2-NH2 3.08Å
99A97.9Very high98Very high27 Ų2774 Ų7422%0.22336%0.358CS..Hα-helixtrans-57.4-43.3176.100000110.7Q95 E96 Q102 R103Q95-A99 WeakPolarHBondContact O-CB 3.25Å; Q95-A99 PolarHBondContact O-N 2.89Å; E96-A99 PolarHBondContact O-N 3.29Å; A99-Q102 PolarHBondContact O-N 3.29Å; A99-R103 PolarHBondContact O-N 3.16Å
100T97.5Very high98Very high8 Ų874 Ų745%0.04937%0.366CS..Hα-helixtrans-68.3-38.8175.9-51.30000111.9E96 E98 Q102 R103 N104 I115 F130E96-T100 WeakPolarHBondContact O-CB 3.44Å; E96-T100 PolarHBondContact O-N 3.42Å; E96-T100 PolarHBondContact O-OG1 3.34Å; E98-T100 VanDerWaalsContact C-N 3.25Å; E98-T100 PolarHBondContact O-N 3.03Å; T100-Q102 VanDerWaalsContact C-N 3.28Å; T100-Q102 PolarHBondContact O-N 3.06Å; T100-R103 PolarHBondContact O-N 3.17Å; T100-N104 PolarHBondContact O-N 3.25Å; T100-I115 HydrophobicContact CG2-CD1 3.53Å; T100-I115 HydrophobicContact CG2-CG1 4.35Å; T100-F130 HydrophobicContact CG2-CZ 4.23Å
101F98.3Very high98Very high4 Ų472.6 Ų72.62%0.01836%0.357CS..Hα-helixtrans-61.2-34.9176.7-175.8-96.9000113.4L97 E98 R103 N104 R105 W129 F130 R133 R134 W137L97-F101 WeakPolarHBondContact O-CB 3.32Å; L97-F101 PolarHBondContact O-N 2.91Å; E98-F101 WeakPolarHBondContact O-CB 3.49Å; E98-F101 PolarHBondContact O-N 3.3Å; E98-F101 VanDerWaalsContact O-N 3.08Å; F101-R103 VanDerWaalsContact C-N 3.34Å; F101-N104 CarbonylContact O-C 3.5Å; F101-R105 HydrophobicContact CD1-CG 4.35Å; F101-R105 HydrophobicContact CD2-CB 4.34Å; F101-R105 HydrophobicContact CD2-CG 4.26Å; F101-R105 HydrophobicContact CE1-CG 3.94Å; F101-R105 HydrophobicContact CE2-CB 3.87Å; F101-R105 HydrophobicContact CE2-CG 3.85Å; F101-R105 HydrophobicContact CG-CG 4.5Å; F101-R105 HydrophobicContact CZ-CB 4.13Å; F101-R105 HydrophobicContact CZ-CG 3.67Å; F101-R105 WeakPolarHBondContact O-CG 3.41Å; F101-W129 HydrophobicContact CB-CH2 4.44Å; F101-W129 HydrophobicContact CB-CZ3 4.27Å; F101-F130 HydrophobicContact CB-CE1 4.06Å; F101-F130 AromaticContact CD2-CD1 3.85Å; F101-F130 HydrophobicContact CD2-CD1 3.85Å; F101-F130 AromaticContact CD2-CE1 3.9Å; F101-F130 HydrophobicContact CD2-CE1 3.9Å; F101-R133 HydrophobicContact CD1-CG 3.93Å; F101-R133 HydrophobicContact CD2-CB 4.27Å; F101-R133 HydrophobicContact CD2-CG 3.59Å; F101-R133 HydrophobicContact CE1-CG 3.91Å; F101-R133 HydrophobicContact CE2-CB 4.14Å; F101-R133 HydrophobicContact CE2-CG 3.57Å; F101-R133 HydrophobicContact CG-CG 3.78Å; F101-R133 HydrophobicContact CZ-CG 3.73Å; F101-R134 HydrophobicContact CE2-CG 3.72Å; F101-R134 HydrophobicContact CZ-CG 4.25Å; F101-W137 HydrophobicContact CZ-CB 4.29Å; F101-W137 HydrophobicContact CZ-CG 4.4Å
102Q97.9Very high98Very high136 Ų13669.9 Ų69.964%0.63633%0.331SS*.Hα-helixtrans-64.3-39.8176-69.5174.414.900111.8E98 A99 T100E98-Q102 WeakPolarHBondContact O-CG 3.4Å; E98-Q102 PolarHBondContact O-N 3.39Å; A99-Q102 PolarHBondContact O-N 3.29Å; T100-Q102 VanDerWaalsContact C-N 3.28Å; T100-Q102 PolarHBondContact O-N 3.06Å
103R97.2Very high98Very high182 Ų18268 Ų6869%0.68732%0.322SS*.Hα-helixtrans-76.2-46177.3-58.9-174.2-136.3107.91.5112.2A99 T100 F101A99-R103 PolarHBondContact O-N 3.16Å; T100-R103 PolarHBondContact O-N 3.17Å; F101-R103 VanDerWaalsContact C-N 3.34Å
104N97.6Very high98Very high65 Ų6572.8 Ų72.835%0.34835%0.345SS..  trans-142.6111.7-178.4-175.73.4000111.6T100 F101 Y106 P107T100-N104 PolarHBondContact O-N 3.25Å; F101-N104 CarbonylContact O-C 3.5Å; N104-Y106 VanDerWaalsContact C-N 3.3Å; N104-Y106 PolarHBondContact ND2-O 2.81Å; N104-Y106 PolarHBondContact O-N 2.82Å; N104-Y106 VanDerWaalsContact OD1-C 3.22Å; N104-Y106 PolarHBondContact OD1-N 3.12Å; N104-Y106 PolarHBondContact OD1-O 2.95Å; N104-P107 WeakPolarHBondContact ND2-CA 3.46Å
105R97.3Very high98Very high102 Ų10269.7 Ų69.739%0.38533%0.328SS..SBendtrans-75.7-18179.1-65.3-179.6171.774.3-0.2113.3F101 R134F101-R105 HydrophobicContact CD1-CG 4.35Å; F101-R105 HydrophobicContact CD2-CB 4.34Å; F101-R105 HydrophobicContact CD2-CG 4.26Å; F101-R105 HydrophobicContact CE1-CG 3.94Å; F101-R105 HydrophobicContact CE2-CB 3.87Å; F101-R105 HydrophobicContact CE2-CG 3.85Å; F101-R105 HydrophobicContact CG-CG 4.5Å; F101-R105 HydrophobicContact CZ-CB 4.13Å; F101-R105 HydrophobicContact CZ-CG 3.67Å; F101-R105 WeakPolarHBondContact O-CG 3.41Å; R105-R134 WeakPolarHBondContact O-CD 3.35Å; R105-R134 PolarHBondContact O-NH1 3.16Å
106Y98.1Very high98Very high146 Ų14664 Ų6457%0.57330%0.303SS*.SBendtrans-129.370.3-178.1-64.9-90.7000110.4N104N104-Y106 VanDerWaalsContact C-N 3.3Å; N104-Y106 PolarHBondContact ND2-O 2.81Å; N104-Y106 PolarHBondContact O-N 2.82Å; N104-Y106 VanDerWaalsContact OD1-C 3.22Å; N104-Y106 PolarHBondContact OD1-N 3.12Å; N104-Y106 PolarHBondContact OD1-O 2.95Å
107P97.6Very high98Very high5 Ų567.2 Ų67.23%0.03233%0.327CS..  trans-65.2138.4176.128.7-35.8000110.8N104 T111 R112 F130N104-P107 WeakPolarHBondContact ND2-CA 3.46Å; P107-T111 HydrophobicContact CB-CG2 3.96Å; P107-R112 HydrophobicContact CB-CG 4.07Å; P107-R112 HydrophobicContact CG-CG 3.91Å; P107-R112 PolarHBondContact O-NH1 3.36Å; P107-F130 VanDerWaalsContact CD-CD1 3.49Å; P107-F130 HydrophobicContact CG-CD1 3.61Å; P107-F130 HydrophobicContact CG-CD2 4.03Å; P107-F130 HydrophobicContact CG-CE1 3.56Å; P107-F130 HydrophobicContact CG-CE2 4Å; P107-F130 HydrophobicContact CG-CG 3.86Å; P107-F130 HydrophobicContact CG-CZ 3.78Å
108D98.1Very high97.9Very high109 Ų10973.6 Ų73.658%0.58335%0.351SS*.  trans-76.2177.9175.6-164.716.4000111.6T111 R112D108-T111 PolarHBondContact O-N 3.43Å; D108-R112 VanDerWaalsContact O-CG 3.3Å; D108-R112 WeakPolarHBondContact O-CG 3.32Å; D108-R112 PolarHBondContact O-N 3.46Å
109M97.9Very high97.9Very high77 Ų7772.1 Ų72.138%0.37934%0.344SS..Hα-helixtrans-54.8-52.7-178.1-165.466.5152.300112.4T111 R112 E113 E123M109-T111 PolarHBondContact O-N 3.07Å; M109-R112 WeakPolarHBondContact O-CB 3.3Å; M109-R112 PolarHBondContact O-N 3.13Å; M109-R112 VanDerWaalsContact O-N 3.1Å; M109-R112 PolarHBondContact SD-NH2 2.6Å; M109-E113 WeakPolarHBondContact O-CG 3.49Å; M109-E113 PolarHBondContact O-N 3.32Å; M109-E123 HydrophobicContact SD-CG 4.35Å
110S98.2Very high97.9Very high62 Ų6277.9 Ų77.943%0.43437%0.371SS..Hα-helixtrans-58-49.8-179.954.30000111.8R112 E113 E114S110-R112 VanDerWaalsContact C-N 3.27Å; S110-R112 PolarHBondContact O-N 2.87Å; S110-E113 WeakPolarHBondContact O-CB 3.36Å; S110-E113 PolarHBondContact O-N 2.73Å; S110-E114 PolarHBondContact O-N 3.11Å
111T97.9Very high97.9Very high43 Ų4378.7 Ų78.726%0.26438%0.375SS..Hα-helixtrans-61.1-36.9177.5-47.10000111.6P107 D108 M109 E113 I115P107-T111 HydrophobicContact CB-CG2 3.96Å; D108-T111 PolarHBondContact O-N 3.43Å; M109-T111 PolarHBondContact O-N 3.07Å; T111-E113 VanDerWaalsContact C-N 3.34Å; T111-I115 HydrophobicContact CG2-CD1 4.06Å; T111-I115 WeakPolarHBondContact O-CB 3.31Å; T111-I115 VanDerWaalsContact O-CD1 3.31Å; T111-I115 WeakPolarHBondContact O-CD1 3.43Å; T111-I115 WeakPolarHBondContact O-CG1 3.1Å; T111-I115 PolarHBondContact O-N 2.94Å
112R98.4Very high97.9Very high43 Ų4382.6 Ų82.616%0.16240%0.399CS..Hα-helixtrans-68.2-33.9175.3-72.5-168.9-57.4-92.9-2.3112.5P107 D108 M109 S110 I115 A116 E123 V126P107-R112 HydrophobicContact CB-CG 4.07Å; P107-R112 HydrophobicContact CG-CG 3.91Å; P107-R112 PolarHBondContact O-NH1 3.36Å; D108-R112 VanDerWaalsContact O-CG 3.3Å; D108-R112 WeakPolarHBondContact O-CG 3.32Å; D108-R112 PolarHBondContact O-N 3.46Å; M109-R112 WeakPolarHBondContact O-CB 3.3Å; M109-R112 PolarHBondContact O-N 3.13Å; M109-R112 VanDerWaalsContact O-N 3.1Å; M109-R112 PolarHBondContact SD-NH2 2.6Å; S110-R112 VanDerWaalsContact C-N 3.27Å; S110-R112 PolarHBondContact O-N 2.87Å; R112-I115 PolarHBondContact O-N 2.96Å; R112-A116 WeakPolarHBondContact O-CB 3.35Å; R112-A116 PolarHBondContact O-N 3.49Å; R112-E123 HydrophobicContact CB-CG 4.05Å; R112-E123 IonicContact CZ-OE1 2.75Å; R112-E123 IonicContact NE-OE1 3.2Å; R112-E123 PolarHBondContact NE-OE1 3.45Å; R112-E123 IonicContact NH2-OE1 3.68Å; R112-V126 HydrophobicContact CB-CG1 4.28Å; R112-V126 HydrophobicContact CG-CG1 4.18Å
113E98.4Very high97.9Very high98 Ų9877.6 Ų77.646%0.45838%0.376SS..Hα-helixtrans-69.1-46.3176.2-72.3172.4173.100111.2M109 S110 T111 I115 A116 V117 E123M109-E113 WeakPolarHBondContact O-CG 3.49Å; M109-E113 PolarHBondContact O-N 3.32Å; S110-E113 WeakPolarHBondContact O-CB 3.36Å; S110-E113 PolarHBondContact O-N 2.73Å; T111-E113 VanDerWaalsContact C-N 3.34Å; E113-I115 PolarHBondContact O-N 3.35Å; E113-A116 WeakPolarHBondContact O-CB 3.47Å; E113-A116 PolarHBondContact O-N 2.9Å; E113-V117 WeakPolarHBondContact O-CG2 3.44Å; E113-V117 PolarHBondContact O-N 3Å; E113-E123 HydrophobicContact CG-CG 4.17Å
114E98.1Very high97.9Very high130 Ų13071.2 Ų71.261%0.60736%0.362SS*.Hα-helixtrans-54.1-44.8169.7-70.1171.6-165.900110.4S110 A116 V117 W118S110-E114 PolarHBondContact O-N 3.11Å; E114-A116 VanDerWaalsContact C-N 3.27Å; E114-A116 PolarHBondContact O-N 3.11Å; E114-V117 PolarHBondContact O-N 3.48Å; E114-W118 PolarHBondContact O-N 3.33Å
115I98.1Very high97.9Very high5 Ų571.4 Ų71.43%0.02636%0.358CS..Hα-helixtrans-65.3-33.7179.3-65.9160.8000112.4L97 T100 T111 R112 E113 W118 T119 V126 F130L97-I115 HydrophobicContact CD2-CG2 3.62Å; T100-I115 HydrophobicContact CG2-CD1 3.53Å; T100-I115 HydrophobicContact CG2-CG1 4.35Å; T111-I115 HydrophobicContact CG2-CD1 4.06Å; T111-I115 WeakPolarHBondContact O-CB 3.31Å; T111-I115 VanDerWaalsContact O-CD1 3.31Å; T111-I115 WeakPolarHBondContact O-CD1 3.43Å; T111-I115 WeakPolarHBondContact O-CG1 3.1Å; T111-I115 PolarHBondContact O-N 2.94Å; R112-I115 PolarHBondContact O-N 2.96Å; E113-I115 PolarHBondContact O-N 3.35Å; I115-W118 HydrophobicContact CG1-CZ2 4.43Å; I115-W118 PolarHBondContact O-NE1 3.39Å; I115-W118 VanDerWaalsContact O-NE1 3.11Å; I115-T119 HydrophobicContact CG2-CG2 4.43Å; I115-T119 WeakPolarHBondContact O-CB 3.49Å; I115-T119 PolarHBondContact O-N 3.04Å; I115-T119 PolarHBondContact O-OG1 3.35Å; I115-V126 HydrophobicContact CB-CG1 4.14Å; I115-V126 HydrophobicContact CG2-CG1 3.74Å; I115-V126 HydrophobicContact CG2-CG2 4.06Å; I115-F130 HydrophobicContact CD1-CE2 4.11Å; I115-F130 HydrophobicContact CD1-CZ 4.16Å
116A98.4Very high97.9Very high10 Ų1066.5 Ų66.58%0.08334%0.34CS..Hα-helixtrans-67.7-42.6178.800000110.9R112 E113 E114 N120 L121 E123 V126R112-A116 WeakPolarHBondContact O-CB 3.35Å; R112-A116 PolarHBondContact O-N 3.49Å; E113-A116 WeakPolarHBondContact O-CB 3.47Å; E113-A116 PolarHBondContact O-N 2.9Å; E114-A116 VanDerWaalsContact C-N 3.27Å; E114-A116 PolarHBondContact O-N 3.11Å; A116-N120 WeakPolarHBondContact O-CA 3.38Å; A116-N120 PolarHBondContact O-N 2.85Å; A116-N120 VanDerWaalsContact O-N 3.07Å; A116-L121 CarbonylContact C-O 3.47Å; A116-L121 WeakPolarHBondContact CA-O 3.42Å; A116-L121 VanDerWaalsContact CB-O 3.27Å; A116-L121 WeakPolarHBondContact CB-O 3.26Å; A116-L121 PolarHBondContact O-N 3.27Å; A116-L121 VanDerWaalsContact O-O 3.07Å; A116-E123 HydrophobicContact CB-CB 4.38Å; A116-V126 HydrophobicContact CB-CG2 4.16Å
117V98.3Very high97.9Very high119 Ų11965.2 Ų65.272%0.72133%0.334SS*.Hα-helixtrans-62.7-60.3-178.4173.50000111.5E113 E114 T119 N120E113-V117 WeakPolarHBondContact O-CG2 3.44Å; E113-V117 PolarHBondContact O-N 3Å; E114-V117 PolarHBondContact O-N 3.48Å; V117-T119 VanDerWaalsContact C-N 3.33Å; V117-T119 PolarHBondContact O-N 3.36Å; V117-N120 PolarHBondContact O-N 2.83Å; V117-N120 VanDerWaalsContact O-N 3.13Å
118W97.3Very high98Very high134 Ų13468 Ų6851%0.50835%0.351SS..Hα-helixtrans-68.8-23.2-17674.7-30.1000114.6E96 E114 I115E96-W118 HydrophobicContact CB-CH2 4.25Å; E96-W118 HydrophobicContact CB-CZ2 4.01Å; E96-W118 HydrophobicContact CG-CH2 4.41Å; E96-W118 WeakPolarHBondContact OE2-CH2 3.42Å; E96-W118 WeakPolarHBondContact OE2-CZ3 3.36Å; E114-W118 PolarHBondContact O-N 3.33Å; I115-W118 HydrophobicContact CG1-CZ2 4.43Å; I115-W118 PolarHBondContact O-NE1 3.39Å; I115-W118 VanDerWaalsContact O-NE1 3.11Å
119T97.4Very high98Very high9 Ų964.2 Ų64.26%0.05533%0.328CS..Hα-helixtrans-91.7-3.3174.2610000113.4Q93 E96 I115 V117 L121Q93-T119 PolarHBondContact NE2-O 3.27Å; E96-T119 HydrophobicContact CB-CG2 4.04Å; I115-T119 HydrophobicContact CG2-CG2 4.43Å; I115-T119 WeakPolarHBondContact O-CB 3.49Å; I115-T119 PolarHBondContact O-N 3.04Å; I115-T119 PolarHBondContact O-OG1 3.35Å; V117-T119 VanDerWaalsContact C-N 3.33Å; V117-T119 PolarHBondContact O-N 3.36Å; T119-L121 VanDerWaalsContact C-N 3.31Å; T119-L121 PolarHBondContact O-N 3.38Å; T119-L121 WeakPolarHBondContact OG1-CD1 3.48Å
120N98.1Very high98Very high148 Ų14860.6 Ų60.679%0.79131%0.31SS*.THydrogen-bonded Turntrans52.246.4-173.1-158.837.1000113.1A116 V117A116-N120 WeakPolarHBondContact O-CA 3.38Å; A116-N120 PolarHBondContact O-N 2.85Å; A116-N120 VanDerWaalsContact O-N 3.07Å; V117-N120 PolarHBondContact O-N 2.83Å; V117-N120 VanDerWaalsContact O-N 3.13Å
121L97.2Very high98Very high25 Ų2563.7 Ų63.713%0.13132%0.316CS..  trans-117.6163.7175.8-65.6174.4000109.3T87 F89 L97 A116 T119 V126T87-L121 HydrophobicContact CG2-CD2 4.35Å; F89-L121 HydrophobicContact CD1-CD1 3.69Å; F89-L121 HydrophobicContact CD1-CD2 3.94Å; F89-L121 HydrophobicContact CD1-CG 4.5Å; F89-L121 HydrophobicContact CE1-CD1 3.6Å; F89-L121 HydrophobicContact CE1-CD2 3.9Å; F89-L121 HydrophobicContact CE1-CG 4.4Å; L97-L121 HydrophobicContact CD1-CD1 4.19Å; A116-L121 CarbonylContact C-O 3.47Å; A116-L121 WeakPolarHBondContact CA-O 3.42Å; A116-L121 VanDerWaalsContact CB-O 3.27Å; A116-L121 WeakPolarHBondContact CB-O 3.26Å; A116-L121 PolarHBondContact O-N 3.27Å; A116-L121 VanDerWaalsContact O-O 3.07Å; T119-L121 VanDerWaalsContact C-N 3.31Å; T119-L121 PolarHBondContact O-N 3.38Å; T119-L121 WeakPolarHBondContact OG1-CD1 3.48Å; L121-V126 HydrophobicContact CB-CG2 4.2Å
122T98Very high98Very high86 Ų8665.9 Ų65.953%0.52833%0.326SS..  trans-81.6147.2168.355.80000110.3A124 R125 V126T122-A124 PolarHBondContact O-N 3.37Å; T122-A124 VanDerWaalsContact O-N 3.12Å; T122-R125 WeakPolarHBondContact O-CA 3.41Å; T122-R125 WeakPolarHBondContact O-CB 3.43Å; T122-R125 PolarHBondContact O-N 3.48Å; T122-R125 VanDerWaalsContact OG1-CG 3.27Å; T122-R125 WeakPolarHBondContact OG1-CG 3.11Å; T122-V126 PolarHBondContact O-N 2.9Å
123E98.1Very high98Very high32 Ų3266.5 Ų66.515%0.1533%0.328CS..Hα-helixtrans-50.4-40.3176.1-178.7-79.115700111.3M109 R112 E113 A116 R125 V126 R127M109-E123 HydrophobicContact SD-CG 4.35Å; R112-E123 HydrophobicContact CB-CG 4.05Å; R112-E123 IonicContact CZ-OE1 2.75Å; R112-E123 IonicContact NE-OE1 3.2Å; R112-E123 PolarHBondContact NE-OE1 3.45Å; R112-E123 IonicContact NH2-OE1 3.68Å; E113-E123 HydrophobicContact CG-CG 4.17Å; A116-E123 HydrophobicContact CB-CB 4.38Å; E123-R125 VanDerWaalsContact C-N 3.25Å; E123-R125 PolarHBondContact O-N 2.85Å; E123-V126 WeakPolarHBondContact O-CB 3.43Å; E123-V126 PolarHBondContact O-N 2.98Å; E123-V126 VanDerWaalsContact O-N 3.16Å; E123-R127 WeakPolarHBondContact O-CB 3.36Å; E123-R127 PolarHBondContact O-N 2.92Å; E123-R127 IonicContact OE1-CZ 3.59Å; E123-R127 VanDerWaalsContact OE1-CZ 3.29Å; E123-R127 IonicContact OE1-NE 3.3Å; E123-R127 PolarHBondContact OE1-NE 3.44Å; E123-R127 IonicContact OE1-NH2 3.7Å; E123-R127 PolarHBondContact OE1-NH2 3.33Å; E123-R127 IonicContact OE2-CZ 3.29Å; E123-R127 VanDerWaalsContact OE2-CZ 3.3Å; E123-R127 IonicContact OE2-NE 2.88Å; E123-R127 PolarHBondContact OE2-NE 3.46Å; E123-R127 IonicContact OE2-NH2 2.87Å; E123-R127 PolarHBondContact OE2-NH2 3.29Å
124A97.4Very high98Very high47 Ų4764.1 Ų64.139%0.38832%0.315SS..Hα-helixtrans-59.7-34.7177.400000112.7T122 V128T122-A124 PolarHBondContact O-N 3.37Å; T122-A124 VanDerWaalsContact O-N 3.12Å; A124-V128 VanDerWaalsContact O-CG2 3.25Å; A124-V128 WeakPolarHBondContact O-CG2 3.15Å; A124-V128 PolarHBondContact O-N 3.5Å
125R97.8Very high98Very high69 Ų6960 Ų6026%0.2630%0.303SS..Hα-helixtrans-73-42.2176.1-65.7-62.9138.3138.6-2.9111.7T87 F89 T122 E123 R127 V128 W129T87-R125 WeakPolarHBondContact OG1-CD 3.37Å; T87-R125 PolarHBondContact OG1-NH1 2.99Å; F89-R125 HydrophobicContact CE1-CB 4.43Å; T122-R125 WeakPolarHBondContact O-CA 3.41Å; T122-R125 WeakPolarHBondContact O-CB 3.43Å; T122-R125 PolarHBondContact O-N 3.48Å; T122-R125 VanDerWaalsContact OG1-CG 3.27Å; T122-R125 WeakPolarHBondContact OG1-CG 3.11Å; E123-R125 VanDerWaalsContact C-N 3.25Å; E123-R125 PolarHBondContact O-N 2.85Å; R125-R127 VanDerWaalsContact C-N 3.35Å; R125-V128 PolarHBondContact O-N 3.17Å; R125-W129 WeakPolarHBondContact O-CB 3.4Å; R125-W129 PolarHBondContact O-N 2.96Å
126V98.3Very high97.9Very high0 Ų066.6 Ų66.60%033%0.332CS..Hα-helixtrans-57.8-49.8173.1179.60000109.7L97 R112 I115 A116 L121 T122 E123 V128 W129 F130L97-V126 HydrophobicContact CD2-CG1 4.11Å; R112-V126 HydrophobicContact CB-CG1 4.28Å; R112-V126 HydrophobicContact CG-CG1 4.18Å; I115-V126 HydrophobicContact CB-CG1 4.14Å; I115-V126 HydrophobicContact CG2-CG1 3.74Å; I115-V126 HydrophobicContact CG2-CG2 4.06Å; A116-V126 HydrophobicContact CB-CG2 4.16Å; L121-V126 HydrophobicContact CB-CG2 4.2Å; T122-V126 PolarHBondContact O-N 2.9Å; E123-V126 WeakPolarHBondContact O-CB 3.43Å; E123-V126 PolarHBondContact O-N 2.98Å; E123-V126 VanDerWaalsContact O-N 3.16Å; V126-V128 PolarHBondContact O-N 3.29Å; V126-W129 WeakPolarHBondContact O-CB 3.48Å; V126-W129 PolarHBondContact O-N 3.02Å; V126-W129 VanDerWaalsContact O-N 3.11Å; V126-F130 HydrophobicContact CG1-CD2 3.7Å; V126-F130 HydrophobicContact CG1-CE2 3.71Å; V126-F130 WeakPolarHBondContact O-CD2 3.28Å; V126-F130 PolarHBondContact O-N 3.13Å
127R98.1Very high97.7Very high118 Ų11869.5 Ų69.545%0.44534%0.34SS..Hα-helixtrans-54.5-48.9176.5-171.1-167.9-59.4-179.7-3.2112.7E123 R125 W129 F130 K131E123-R127 WeakPolarHBondContact O-CB 3.36Å; E123-R127 PolarHBondContact O-N 2.92Å; E123-R127 IonicContact OE1-CZ 3.59Å; E123-R127 VanDerWaalsContact OE1-CZ 3.29Å; E123-R127 IonicContact OE1-NE 3.3Å; E123-R127 PolarHBondContact OE1-NE 3.44Å; E123-R127 IonicContact OE1-NH2 3.7Å; E123-R127 PolarHBondContact OE1-NH2 3.33Å; E123-R127 IonicContact OE2-CZ 3.29Å; E123-R127 VanDerWaalsContact OE2-CZ 3.3Å; E123-R127 IonicContact OE2-NE 2.88Å; E123-R127 PolarHBondContact OE2-NE 3.46Å; E123-R127 IonicContact OE2-NH2 2.87Å; E123-R127 PolarHBondContact OE2-NH2 3.29Å; R125-R127 VanDerWaalsContact C-N 3.35Å; R127-W129 VanDerWaalsContact C-N 3.35Å; R127-F130 PolarHBondContact O-N 3.37Å; R127-K131 WeakPolarHBondContact O-CB 3.35Å; R127-K131 PolarHBondContact O-N 2.8Å
128V98.1Very high97.6Very high65 Ų6569.7 Ų69.739%0.39433%0.328SS..Hα-helixtrans-65.4-39.6178.4170.90000111.2A124 R125 V126 K131 N132A124-V128 VanDerWaalsContact O-CG2 3.25Å; A124-V128 WeakPolarHBondContact O-CG2 3.15Å; A124-V128 PolarHBondContact O-N 3.5Å; R125-V128 PolarHBondContact O-N 3.17Å; V126-V128 PolarHBondContact O-N 3.29Å; V128-K131 PolarHBondContact O-N 3.05Å; V128-N132 PolarHBondContact O-N 3.04Å; V128-N132 PolarHBondContact O-ND2 3.41Å
129W98.3Very high97.5Very high28 Ų2870.5 Ų70.511%0.10634%0.335CS..Hα-helixtrans-60.4-50.9176.5-172.5102.2000111.2F89 L94 L97 F101 R125 V126 R127 K131 N132 R133F89-W129 AromaticContact CD2-CD1 3.93Å; F89-W129 AromaticContact CE2-CD1 3.62Å; F89-W129 HydrophobicContact CZ-CB 4.36Å; F89-W129 AromaticContact CZ-CD1 3.95Å; L94-W129 HydrophobicContact CD2-CZ2 4.47Å; L94-W129 VanDerWaalsContact CD2-NE1 3.28Å; L97-W129 HydrophobicContact CB-CD2 4Å; L97-W129 HydrophobicContact CB-CE3 3.92Å; L97-W129 HydrophobicContact CB-CH2 3.62Å; L97-W129 HydrophobicContact CB-CZ2 3.65Å; L97-W129 HydrophobicContact CB-CZ3 3.75Å; L97-W129 HydrophobicContact CD1-CD2 3.87Å; L97-W129 HydrophobicContact CD1-CE3 4.46Å; L97-W129 HydrophobicContact CD1-CG 3.88Å; L97-W129 HydrophobicContact CD2-CD2 4.44Å; L97-W129 HydrophobicContact CD2-CE3 4.26Å; L97-W129 HydrophobicContact CG-CD2 4.34Å; L97-W129 HydrophobicContact CG-CE3 4.45Å; F101-W129 HydrophobicContact CB-CH2 4.44Å; F101-W129 HydrophobicContact CB-CZ3 4.27Å; R125-W129 WeakPolarHBondContact O-CB 3.4Å; R125-W129 PolarHBondContact O-N 2.96Å; V126-W129 WeakPolarHBondContact O-CB 3.48Å; V126-W129 PolarHBondContact O-N 3.02Å; V126-W129 VanDerWaalsContact O-N 3.11Å; R127-W129 VanDerWaalsContact C-N 3.35Å; W129-K131 VanDerWaalsContact C-N 3.32Å; W129-K131 PolarHBondContact O-N 3.48Å; W129-N132 PolarHBondContact O-N 3.49Å; W129-N132 VanDerWaalsContact O-N 3.13Å; W129-R133 HydrophobicContact CE3-CB 4.05Å; W129-R133 HydrophobicContact CH2-CB 4.11Å; W129-R133 HydrophobicContact CH2-CG 3.8Å; W129-R133 HydrophobicContact CZ3-CB 3.8Å; W129-R133 HydrophobicContact CZ3-CG 3.83Å; W129-R133 WeakPolarHBondContact O-CB 3.33Å; W129-R133 PolarHBondContact O-N 3.14Å
130F98.6Very high97.1Very high2 Ų276.4 Ų76.41%0.00936%0.356CS..Hα-helixtrans-61.2-39178.3-89-88.9000112.2L97 T100 F101 P107 I115 V126 R127 R133 R134L97-F130 HydrophobicContact CD2-CE2 3.86Å; T100-F130 HydrophobicContact CG2-CZ 4.23Å; F101-F130 HydrophobicContact CB-CE1 4.06Å; F101-F130 AromaticContact CD2-CD1 3.85Å; F101-F130 HydrophobicContact CD2-CD1 3.85Å; F101-F130 AromaticContact CD2-CE1 3.9Å; F101-F130 HydrophobicContact CD2-CE1 3.9Å; P107-F130 VanDerWaalsContact CD-CD1 3.49Å; P107-F130 HydrophobicContact CG-CD1 3.61Å; P107-F130 HydrophobicContact CG-CD2 4.03Å; P107-F130 HydrophobicContact CG-CE1 3.56Å; P107-F130 HydrophobicContact CG-CE2 4Å; P107-F130 HydrophobicContact CG-CG 3.86Å; P107-F130 HydrophobicContact CG-CZ 3.78Å; I115-F130 HydrophobicContact CD1-CE2 4.11Å; I115-F130 HydrophobicContact CD1-CZ 4.16Å; V126-F130 HydrophobicContact CG1-CD2 3.7Å; V126-F130 HydrophobicContact CG1-CE2 3.71Å; V126-F130 WeakPolarHBondContact O-CD2 3.28Å; V126-F130 PolarHBondContact O-N 3.13Å; R127-F130 PolarHBondContact O-N 3.37Å; F130-R133 PolarHBondContact O-N 3.13Å; F130-R134 WeakPolarHBondContact O-CG 3.41Å; F130-R134 PolarHBondContact O-N 3.27Å
131K98.3Very high96.5Very high126 Ų12673.1 Ų73.155%0.54834%0.336SS..Hα-helixtrans-60.1-47.6174-172.2176.169.1177.20111.7R127 V128 W129 A135R127-K131 WeakPolarHBondContact O-CB 3.35Å; R127-K131 PolarHBondContact O-N 2.8Å; V128-K131 PolarHBondContact O-N 3.05Å; W129-K131 VanDerWaalsContact C-N 3.32Å; W129-K131 PolarHBondContact O-N 3.48Å; K131-A135 PolarHBondContact O-N 3.08Å
132N98.1Very high95.8Very high89 Ų8980.2 Ų80.248%0.47636%0.361SS..Hα-helixtrans-67-38.1178.7-72.2-18.1000112V128 W129 A135 K136V128-N132 PolarHBondContact O-N 3.04Å; V128-N132 PolarHBondContact O-ND2 3.41Å; W129-N132 PolarHBondContact O-N 3.49Å; W129-N132 VanDerWaalsContact O-N 3.13Å; N132-A135 PolarHBondContact O-N 2.96Å; N132-K136 PolarHBondContact O-N 3.07Å
133R98.1Very high94.9Very high56 Ų5680.4 Ų80.421%0.21136%0.359CS..Hα-helixtrans-61.9-48.3176.9-174.866.4-168.5172.2-1.3111.1E98 F101 W129 F130 A135 K136 W137E98-R133 IonicContact OE1-CZ 2.91Å; E98-R133 IonicContact OE1-NE 3.37Å; E98-R133 PolarHBondContact OE1-NE 3.37Å; E98-R133 IonicContact OE1-NH2 3.17Å; E98-R133 PolarHBondContact OE1-NH2 3.35Å; E98-R133 WeakPolarHBondContact OE2-CD 3.4Å; E98-R133 IonicContact OE2-CZ 3.42Å; E98-R133 IonicContact OE2-NE 2.65Å; E98-R133 PolarHBondContact OE2-NE 2.96Å; E98-R133 IonicContact OE2-NH1 3.08Å; E98-R133 PolarHBondContact OE2-NH1 3.4Å; E98-R133 IonicContact OE2-NH2 2.83Å; E98-R133 PolarHBondContact OE2-NH2 3.47Å; E98-R133 VanDerWaalsContact OE2-NH2 3.08Å; F101-R133 HydrophobicContact CD1-CG 3.93Å; F101-R133 HydrophobicContact CD2-CB 4.27Å; F101-R133 HydrophobicContact CD2-CG 3.59Å; F101-R133 HydrophobicContact CE1-CG 3.91Å; F101-R133 HydrophobicContact CE2-CB 4.14Å; F101-R133 HydrophobicContact CE2-CG 3.57Å; F101-R133 HydrophobicContact CG-CG 3.78Å; F101-R133 HydrophobicContact CZ-CG 3.73Å; W129-R133 HydrophobicContact CE3-CB 4.05Å; W129-R133 HydrophobicContact CH2-CB 4.11Å; W129-R133 HydrophobicContact CH2-CG 3.8Å; W129-R133 HydrophobicContact CZ3-CB 3.8Å; W129-R133 HydrophobicContact CZ3-CG 3.83Å; W129-R133 WeakPolarHBondContact O-CB 3.33Å; W129-R133 PolarHBondContact O-N 3.14Å; F130-R133 PolarHBondContact O-N 3.13Å; R133-A135 VanDerWaalsContact C-N 3.33Å; R133-A135 PolarHBondContact O-N 3.48Å; R133-K136 PolarHBondContact O-N 2.81Å; R133-W137 PolarHBondContact O-N 3.48Å
134R97.9Very high94Very high49 Ų4984.6 Ų84.619%0.18538%0.379CS..Hα-helixtrans-61.4-38.2174.2-71.6-165.2-63.9-90.75113.1F101 R105 F130 W137 R138F101-R134 HydrophobicContact CE2-CG 3.72Å; F101-R134 HydrophobicContact CZ-CG 4.25Å; R105-R134 WeakPolarHBondContact O-CD 3.35Å; R105-R134 PolarHBondContact O-NH1 3.16Å; F130-R134 WeakPolarHBondContact O-CG 3.41Å; F130-R134 PolarHBondContact O-N 3.27Å; R134-W137 PolarHBondContact O-N 3.21Å; R134-R138 PolarHBondContact O-N 3.38Å
135A97.8Very high92.6Very high42 Ų4288.5 Ų88.535%0.34739%0.389SS..Hα-helixtrans-62.1-43.9176.100000111.9K131 N132 R133 K139K131-A135 PolarHBondContact O-N 3.08Å; N132-A135 PolarHBondContact O-N 2.96Å; R133-A135 VanDerWaalsContact C-N 3.33Å; R133-A135 PolarHBondContact O-N 3.48Å; A135-K139 WeakPolarHBondContact O-CB 3.38Å; A135-K139 PolarHBondContact O-N 3.35Å
136K96.5Very high91.3Very high144 Ų14487.4 Ų87.463%0.62640%0.395SS*.Hα-helixtrans-63.4-42.2173.9-73.1-176177.8-175.40112N132 R133 K139 R140N132-K136 PolarHBondContact O-N 3.07Å; R133-K136 PolarHBondContact O-N 2.81Å; K136-K139 PolarHBondContact O-N 2.98Å; K136-R140 PolarHBondContact O-N 3.17Å
137W95.1Very high89.7Confident71 Ų7191.2 Ų91.227%0.26941%0.413SS..Hα-helixtrans-59.4-51.2178.2-179.281.2000111.5F101 R133 R134 K139 R140 E141F101-W137 HydrophobicContact CZ-CB 4.29Å; F101-W137 HydrophobicContact CZ-CG 4.4Å; R133-W137 PolarHBondContact O-N 3.48Å; R134-W137 PolarHBondContact O-N 3.21Å; W137-K139 VanDerWaalsContact C-N 3.29Å; W137-K139 PolarHBondContact O-N 3.42Å; W137-R140 WeakPolarHBondContact O-CB 3.44Å; W137-R140 PolarHBondContact O-N 3.08Å; W137-R140 VanDerWaalsContact O-N 3.12Å; W137-E141 WeakPolarHBondContact CH2-OE1 3.28Å; W137-E141 WeakPolarHBondContact CZ2-OE1 3.43Å; W137-E141 PolarHBondContact O-N 3.35Å
138R95.7Very high87.9Confident124 Ų12492 Ų9247%0.46843%0.425SS..Hα-helixtrans-61-34.9174.7-72.3-171.9-77.8101.2-4.4113.2R134 R142R134-R138 PolarHBondContact O-N 3.38Å; R138-R142 PolarHBondContact O-N 2.83Å
139K93.9Very high86Confident150 Ų15093.7 Ų93.765%0.65244%0.438SS*.Hα-helixtrans-66.9-38.2176.6-173.4173.3-178.51800111.7A135 K136 W137 R142 N143A135-K139 WeakPolarHBondContact O-CB 3.38Å; A135-K139 PolarHBondContact O-N 3.35Å; K136-K139 PolarHBondContact O-N 2.98Å; W137-K139 VanDerWaalsContact C-N 3.29Å; W137-K139 PolarHBondContact O-N 3.42Å; K139-R142 PolarHBondContact O-N 3.44Å; K139-N143 PolarHBondContact O-N 3.49Å; K139-N143 VanDerWaalsContact O-N 3.08Å
140R90.8Very high83.8Confident133 Ų13398.8 Ų98.850%0.50246%0.461SS..Hα-helixtrans-63.3-43.3178-172.5-173.1-68.1142.3-5.8111.5K136 W137 N143 Q144K136-R140 PolarHBondContact O-N 3.17Å; W137-R140 WeakPolarHBondContact O-CB 3.44Å; W137-R140 PolarHBondContact O-N 3.08Å; W137-R140 VanDerWaalsContact O-N 3.12Å; R140-N143 PolarHBondContact O-N 3.38Å; R140-Q144 WeakPolarHBondContact O-CG 3.48Å; R140-Q144 PolarHBondContact O-N 2.9Å
141E83.9Confident81.6Confident79 Ų79105.1 Ų105.137%0.36950%0.495SS..Hα-helixtrans-61.4-45.5177.7-68.1-176.6152.700112.5W137 N143 Q144 Q145W137-E141 WeakPolarHBondContact CH2-OE1 3.28Å; W137-E141 WeakPolarHBondContact CZ2-OE1 3.43Å; W137-E141 PolarHBondContact O-N 3.35Å; E141-N143 VanDerWaalsContact C-N 3.33Å; E141-N143 PolarHBondContact O-N 2.94Å; E141-Q144 PolarHBondContact O-N 3.2Å; E141-Q145 PolarHBondContact O-N 3.18Å
142R82.3Confident79.1Confident174 Ų174101.8 Ų101.866%0.65750%0.497SS*.Hα-helixtrans-62.7-39.9176.7-169.7-169.8-56.7164.6-1.2112.6R138 K139 Q145 A146R138-R142 PolarHBondContact O-N 2.83Å; K139-R142 PolarHBondContact O-N 3.44Å; R142-Q145 PolarHBondContact O-N 2.94Å; R142-A146 PolarHBondContact O-N 3.18Å
143N79.8Confident76.7Confident90 Ų90106.7 Ų106.748%0.48151%0.514SS..Hα-helixtrans-66.7-39.9-179.9-158.30.1000111.1K139 R140 E141 Q145 A146 E147K139-N143 PolarHBondContact O-N 3.49Å; K139-N143 VanDerWaalsContact O-N 3.08Å; R140-N143 PolarHBondContact O-N 3.38Å; E141-N143 VanDerWaalsContact C-N 3.33Å; E141-N143 PolarHBondContact O-N 2.94Å; N143-Q145 VanDerWaalsContact C-N 3.3Å; N143-Q145 PolarHBondContact O-N 3.42Å; N143-A146 PolarHBondContact O-N 3.3Å; N143-A146 VanDerWaalsContact O-N 3.14Å; N143-E147 WeakPolarHBondContact O-CG 3.29Å; N143-E147 PolarHBondContact O-N 3.48Å
144Q78.6Confident74Confident120 Ų120106.7 Ų106.756%0.56153%0.532SS*.Hα-helixtrans-60.4-39.1174.8-73.3-178.9102.600112.6R140 E141 L148R140-Q144 WeakPolarHBondContact O-CG 3.48Å; R140-Q144 PolarHBondContact O-N 2.9Å; E141-Q144 PolarHBondContact O-N 3.2Å; Q144-L148 WeakPolarHBondContact O-CG 3.2Å; Q144-L148 PolarHBondContact O-N 3.31Å; Q144-L148 VanDerWaalsContact O-N 3.16Å
145Q69.6Low71.8Confident130 Ų130110.1 Ų110.161%0.60756%0.56SS**Hα-helixtrans-66.9-38.2174.6-67.8172.815.600112.5E141 R142 N143 L148 C149E141-Q145 PolarHBondContact O-N 3.18Å; R142-Q145 PolarHBondContact O-N 2.94Å; N143-Q145 VanDerWaalsContact C-N 3.3Å; N143-Q145 PolarHBondContact O-N 3.42Å; Q145-L148 PolarHBondContact O-N 2.94Å; Q145-C149 PolarHBondContact O-N 2.97Å; Q145-C149 PolarHBondContact O-SG 2.65Å
146A70.1Confident69.6Low45 Ų45116.9 Ų116.937%0.37259%0.585SS.*Hα-helixtrans-67.2-36.8178.100000112.7R142 N143 C149 K150R142-A146 PolarHBondContact O-N 3.18Å; N143-A146 PolarHBondContact O-N 3.3Å; N143-A146 VanDerWaalsContact O-N 3.14Å; A146-C149 PolarHBondContact O-N 3.24Å; A146-K150 PolarHBondContact O-N 3.37Å; A146-K150 VanDerWaalsContact O-N 3.15Å
147E63.7Low66.9Low81 Ų81119.3 Ų119.338%0.37960%0.596SS.*Hα-helixtrans-69.1-40.5175.6-64.1-6012000110.9N143 C149 K150 N151N143-E147 WeakPolarHBondContact O-CG 3.29Å; N143-E147 PolarHBondContact O-N 3.48Å; E147-C149 VanDerWaalsContact C-N 3.28Å; E147-C149 PolarHBondContact O-N 3.08Å; E147-K150 WeakPolarHBondContact O-CB 2.93Å; E147-K150 PolarHBondContact O-N 2.85Å; E147-K150 IonicContact OE1-NZ 2.82Å; E147-K150 PolarHBondContact OE1-NZ 2.95Å; E147-N151 PolarHBondContact O-N 3.22Å; E147-N151 PolarHBondContact O-OD1 3.02Å
148L60.9Low64.7Low133 Ų133123.3 Ų123.370%0.69662%0.623SS**Hα-helixtrans-59.2-35.6173.5-70.4167.1000113.3Q144 Q145Q144-L148 WeakPolarHBondContact O-CG 3.2Å; Q144-L148 PolarHBondContact O-N 3.31Å; Q144-L148 VanDerWaalsContact O-N 3.16Å; Q145-L148 PolarHBondContact O-N 2.94Å
149C58.6Low62.4Low101 Ų101120.9 Ų120.968%0.68264%0.636SS**Hα-helixtrans-75.6-21.4174.1-64.80000114Q145 A146 E147Q145-C149 PolarHBondContact O-N 2.97Å; Q145-C149 PolarHBondContact O-SG 2.65Å; A146-C149 PolarHBondContact O-N 3.24Å; E147-C149 VanDerWaalsContact C-N 3.28Å; E147-C149 PolarHBondContact O-N 3.08Å
150K52.4Low60.4Low136 Ų136121.6 Ų121.659%0.59165%0.646SS**Hα-helixtrans-79.7-30.5172.6-78.7174.3-179.3170.80112.6A146 E147 G152A146-K150 PolarHBondContact O-N 3.37Å; A146-K150 VanDerWaalsContact O-N 3.15Å; E147-K150 WeakPolarHBondContact O-CB 2.93Å; E147-K150 PolarHBondContact O-N 2.85Å; E147-K150 IonicContact OE1-NZ 2.82Å; E147-K150 PolarHBondContact OE1-NZ 2.95Å; K150-G152 VanDerWaalsContact C-N 3.27Å; K150-G152 PolarHBondContact O-N 3.2Å
151N51.4Low58.3Low135 Ų135123.5 Ų123.572%0.72266%0.663SS**THydrogen-bonded Turntrans-78.9-5.3179.6-71.577.3000113.8E147E147-N151 PolarHBondContact O-N 3.22Å; E147-N151 PolarHBondContact O-OD1 3.02Å
152G45.1Very low56.7Low56 Ų56127.6 Ų127.658%0.57768%0.681SS**THydrogen-bonded Turntrans-95.8-13.2-179.600000116.4K150K150-G152 VanDerWaalsContact C-N 3.27Å; K150-G152 PolarHBondContact O-N 3.2Å
153F47.9Very low55.2Low191 Ų191124.1 Ų124.184%0.83868%0.681SS**SBendtrans-135.6102.1176.1-79.5-89.3000108.8
154G43.1Very low53.6Low57 Ų57128.5 Ų128.559%0.58869%0.693SS**  trans-62.9167.9-174.500000115.1Q156G154-Q156 PolarHBondContact O-N 3.26Å
155P50Low52.5Low121 Ų121129.4 Ų129.479%0.78670%0.701SS**SBendtrans-81.346.6-177.337.6-36.6000112.1
156Q51.4Low51.7Low184 Ų184131.3 Ų131.386%0.8672%0.716SS**  trans-95.8-4.6-179.5-62.8-70.762.600113.4G154G154-Q156 PolarHBondContact O-N 3.26Å
157F41Very low51Low194 Ų194135.3 Ų135.385%0.85173%0.728SS**SBendtrans-111.730.1-179.9-160.9-101.1000113.1
158N48.2Very low50Low156 Ų156140.6 Ų140.683%0.83475%0.746SS**  trans-108.318.6-179-131.965.3000113.6
159G47.3Very low49.2Very low72 Ų72140.3 Ų140.374%0.74275%0.752SS**SBendtrans-112.90.2-168.700000117.9
160L51.8Low48.4Very low165 Ų165140 Ų14086%0.86475%0.751SS**SBendtrans-122.5-2-173.6-94.5173000116.8
161M46.3Very low48.1Very low174 Ų174144.7 Ų144.786%0.85777%0.767SS**  trans-107.699.3171.6-84.9-108.262.900109.5
162Q50.8Low48Very low164 Ų164143.1 Ų143.177%0.76676%0.762SS**  trans-55.6136.1164.5-70.7-79.7-39.200109.4Y164Q162-Y164 PolarHBondContact O-N 2.9Å
163P52.1Low47.8Very low101 Ų101150.5 Ų150.566%0.65677%0.774SS**  trans-73.5110.1175.412.5-2.2000109.4D165P163-D165 VanDerWaalsContact C-N 3.29Å; P163-D165 PolarHBondContact O-N 2.86Å
164Y45.8Very low47.8Very low182 Ų182146.7 Ų146.771%0.71476%0.763SS**  trans-95.953.7172.1-152.9-89.5000109.7Q162 M167Q162-Y164 PolarHBondContact O-N 2.9Å; Y164-M167 HydrophobicContact CD1-CB 4.49Å; Y164-M167 HydrophobicContact CE1-CB 3.87Å; Y164-M167 HydrophobicContact CE1-CE 4.37Å; Y164-M167 HydrophobicContact CE1-SD 4.23Å; Y164-M167 PolarHBondContact OH-SD 3.43Å; Y164-M167 VanDerWaalsContact OH-SD 3.33Å
165D55.3Low48.2Very low139 Ų139148.7 Ų148.774%0.74376%0.76SS**  trans-100.9-7.4-177.6-81.4-75.2000113.4P163P163-D165 VanDerWaalsContact C-N 3.29Å; P163-D165 PolarHBondContact O-N 2.86Å
166D52.3Low48.3Very low170 Ų170152.6 Ų152.691%0.90976%0.759SS**THydrogen-bonded Turntrans-90.5-3.3-175.4-73-40.5000115.1
167M54.8Low48.2Very low129 Ų129147.8 Ų147.864%0.63575%0.751SS**THydrogen-bonded Turntrans-10914.5-175-147.6-165.982.800115.2Y164Y164-M167 HydrophobicContact CD1-CB 4.49Å; Y164-M167 HydrophobicContact CE1-CB 3.87Å; Y164-M167 HydrophobicContact CE1-CE 4.37Å; Y164-M167 HydrophobicContact CE1-SD 4.23Å; Y164-M167 PolarHBondContact OH-SD 3.43Å; Y164-M167 VanDerWaalsContact OH-SD 3.33Å
168Y43Very low48.4Very low193 Ų193141.9 Ų141.976%0.75774%0.738SS**  trans-155.1111.1171.4-136.6-96.4000112.4S170Y168-S170 VanDerWaalsContact C-N 3.28Å; Y168-S170 PolarHBondContact O-N 3.35Å
169P45Very low48.2Very low127 Ų127143 Ų14383%0.82574%0.735SS**  trans-71.385.8168.9-7.823.5000109.1Y171P169-Y171 PolarHBondContact O-N 3.45Å
170S41.9Very low48.3Very low95 Ų95142.5 Ų142.566%0.66473%0.73SS**  trans-77.4119.3173.1-1560000109.4Y168 T172Y168-S170 VanDerWaalsContact C-N 3.28Å; Y168-S170 PolarHBondContact O-N 3.35Å; S170-T172 PolarHBondContact O-N 2.96Å
171Y46.1Very low48.1Very low233 Ų233142.9 Ų142.991%0.91473%0.732SS**  trans-50.3106.6176.3-94.4-98.5000110.8P169 Y173P169-Y171 PolarHBondContact O-N 3.45Å; Y171-Y173 PolarHBondContact O-N 3.14Å; Y171-Y173 VanDerWaalsContact O-N 3.08Å
172T49.1Very low48Very low103 Ų103140.7 Ų140.763%0.63273%0.728SS**  trans-80.688.9176-70.80000109.5S170 N175S170-T172 PolarHBondContact O-N 2.96Å; T172-N175 HydrophobicContact CG2-CB 3.66Å; T172-N175 VanDerWaalsContact CG2-ND2 3.28Å; T172-N175 WeakPolarHBondContact CG2-ND2 3.11Å
173Y40.2Very low47.8Very low210 Ų210138.8 Ų138.882%0.82473%0.734SS**  trans-101.8110165.3-158.2-108.4000108.6Y171Y171-Y173 PolarHBondContact O-N 3.14Å; Y171-Y173 VanDerWaalsContact O-N 3.08Å
174N49Very low47.3Very low112 Ų112137.9 Ų137.960%0.59974%0.735SS**  trans86.982179.1-52.5-70.7000117.3
175N50.5Low47.1Very low98 Ų98134.5 Ų134.552%0.52474%0.737SS.*  trans-11550.2175.5-134.2-49.9000113.4T172 A178T172-N175 HydrophobicContact CG2-CB 3.66Å; T172-N175 VanDerWaalsContact CG2-ND2 3.28Å; T172-N175 WeakPolarHBondContact CG2-ND2 3.11Å; N175-A178 WeakPolarHBondContact OD1-CB 3.39Å
176W51.8Low46.5Very low204 Ų204135.5 Ų135.577%0.77374%0.742SS**SBendtrans-83.7-15.5174.854.9-86.6000113.5
177A49.7Very low46.1Very low82 Ų82131.3 Ų131.368%0.67873%0.726SS**SBendtrans-111.9-9.9-170.600000116.4
178A45.4Very low45.6Very low71 Ų71131.2 Ų131.259%0.58773%0.733SS**  trans-99.59.3-174.800000115.9N175 G180N175-A178 WeakPolarHBondContact OD1-CB 3.39Å; A178-G180 PolarHBondContact O-N 2.83Å; A178-G180 VanDerWaalsContact O-N 3.1Å
179K45.1Very low45.8Very low179 Ų179130.1 Ų130.178%0.77873%0.732SS**THydrogen-bonded Turntrans-82.678.816853.7164.5-176-65.40110.7
180G48.9Very low45.4Very low61 Ų61128 Ų12863%0.62972%0.72SS**THydrogen-bonded Turntrans-169.8-6.7175.900000119.4A178A178-G180 PolarHBondContact O-N 2.83Å; A178-G180 VanDerWaalsContact O-N 3.1Å
181L47.3Very low45.8Very low174 Ų174131.7 Ų131.791%0.91172%0.724SS**SBendtrans-131.66.3-174.4-67.9173.7000115.8
182T44.5Very low46.3Very low127 Ų127126.1 Ų126.178%0.77972%0.717SS**SBendtrans-97.3123.2161.2600000107.7A184T182-A184 VanDerWaalsContact C-N 3.31Å; T182-A184 PolarHBondContact O-N 3.33Å
183S45.8Very low46.5Very low125 Ų125130.1 Ų130.187%0.87473%0.726SS**  trans-57.497.9166.9-52.10000107.6S185S183-S185 PolarHBondContact O-N 3.04Å
184A41.8Very low46.7Very low82 Ų82128.7 Ų128.768%0.67872%0.724SS**  trans-67.699.9173.200000107.4T182 L186T182-A184 VanDerWaalsContact C-N 3.31Å; T182-A184 PolarHBondContact O-N 3.33Å; A184-L186 PolarHBondContact O-N 3.08Å
185S41.2Very low46.5Very low110 Ų110129.1 Ų129.177%0.76973%0.726SS**  trans-49.7129.3146.2-174.40000106.3S183 S187S183-S185 PolarHBondContact O-N 3.04Å; S185-S187 PolarHBondContact O-N 3.32Å
186L43.3Very low46.4Very low161 Ų161129.5 Ų129.584%0.84374%0.737SS**  trans-6477.8-173.7-66.7166000110.4A184 T188A184-L186 PolarHBondContact O-N 3.08Å; L186-T188 PolarHBondContact O-N 3.42Å
187S43.9Very low46.2Very low82 Ų82127.6 Ų127.657%0.57374%0.739SS**  trans-75.5102.7162175.30000106.2S185 K189S185-S187 PolarHBondContact O-N 3.32Å; S187-K189 VanDerWaalsContact C-N 3.28Å; S187-K189 PolarHBondContact O-N 3.5Å
188T43.5Very low46.2Very low127 Ų127130.4 Ų130.478%0.77974%0.742SS**  trans-63.687.8174.444.50000109.3L186 S190L186-T188 PolarHBondContact O-N 3.42Å; T188-S190 PolarHBondContact O-N 3.32Å
189K47.2Very low46.4Very low169 Ų169133.1 Ų133.174%0.73575%0.751SS**  trans-68.586163.6-37.1-79.8177.2165.10106.3S187 F191S187-K189 VanDerWaalsContact C-N 3.28Å; S187-K189 PolarHBondContact O-N 3.5Å; K189-F191 PolarHBondContact O-N 3.27Å
190S38.1Very low46.5Very low82 Ų82131.2 Ų131.257%0.57375%0.749SS**  trans-61.3123.2178.3-174.50000109.6T188T188-S190 PolarHBondContact O-N 3.32Å
191F48.5Very low46.2Very low173 Ų173134.4 Ų134.476%0.75976%0.759SS**  trans-82.4133.6167.1-77.8-86.1000108.3K189 F193 F194K189-F191 PolarHBondContact O-N 3.27Å; F191-F193 PolarHBondContact O-N 3.12Å; F191-F194 PolarHBondContact O-N 3.49Å
192P57.1Low45.7Very low117 Ų117133.1 Ų133.176%0.7675%0.752SS**G310 helixtrans-65.7-9.7-170.924.4-33.5000114.7F194P192-F194 PolarHBondContact O-N 3.1Å
193F54Low45.9Very low187 Ų187132 Ų13282%0.8275%0.75SS**G310 helixtrans-74.8-20.4-177.4-170.6-103.8000114.5F191F191-F193 PolarHBondContact O-N 3.12Å
194F44.5Very low45.6Very low179 Ų179131.4 Ų131.479%0.78575%0.746SS**G310 helixtrans-106.25.8-173-108.6-90.2000115.3F191 P192 S196F191-F194 PolarHBondContact O-N 3.49Å; P192-F194 PolarHBondContact O-N 3.1Å; F194-S196 PolarHBondContact O-N 2.85Å; F194-S196 VanDerWaalsContact O-N 3.14Å
195N45.4Very low45.6Very low121 Ų121136.3 Ų136.365%0.64776%0.755SS**THydrogen-bonded Turntrans-72.3-0.3-176.1-100.2-58.6000115.5
196S48.2Very low45.5Very low107 Ų107138 Ų13875%0.74876%0.761SS**THydrogen-bonded Turntrans-94.97.3-173.1-154.40000115.7F194F194-S196 PolarHBondContact O-N 2.85Å; F194-S196 VanDerWaalsContact O-N 3.14Å
197M46.4Very low45.4Very low163 Ų163138.5 Ų138.580%0.80376%0.76SS**SBendtrans-123.285.8170.3-74.8-86.5128.300108.6V199M197-V199 PolarHBondContact O-N 2.85Å; M197-V199 VanDerWaalsContact O-N 3.16Å
198N49.6Very low45.3Very low142 Ų142144.5 Ų144.576%0.75978%0.777SS**  trans-62.3104.6171.3-179.816.4000109.7
199V49.9Very low45.4Very low127 Ų127143.6 Ų143.677%0.7778%0.776SS**  trans-123.4104.4161.6-67.40000108.6M197M197-V199 PolarHBondContact O-N 2.85Å; M197-V199 VanDerWaalsContact O-N 3.16Å
200N46.4Very low45.4Very low139 Ų139141.3 Ų141.374%0.74378%0.778SS**  trans-54130171.3-1037.8000111.1L202N200-L202 PolarHBondContact O-N 3.18Å
201P44Very low46Very low128 Ų128143.1 Ų143.183%0.83179%0.788SS**  trans-87.597.915631.2-26.6000109.1S203P201-S203 PolarHBondContact O-N 3.16Å
202L36.7Very low45.9Very low147 Ų147142.7 Ų142.777%0.7779%0.793SS**  trans-65.7124.4169.2-175.663.9000109.4N200N200-L202 PolarHBondContact O-N 3.18Å
203S48.3Very low44.9Very low103 Ų103142.4 Ų142.472%0.7279%0.794SS**  trans-39.1128.6164.8410000113.3P201P201-S203 PolarHBondContact O-N 3.16Å
204S39.8Very low44.4Very low113 Ų113141 Ų14179%0.7979%0.794SS**  trans-144.9133.7161.5-74.90000111
205Q41Very low44Very low186 Ų186137.6 Ų137.687%0.86979%0.792SS**  trans-76150.9-165.5-55.7-170.263.500112.1M207Q205-M207 PolarHBondContact O-N 3.08Å
206T40.6Very low43.5Very low146 Ų146137.5 Ų137.590%0.89680%0.801SS**  trans-75.8107.4168.950.60000109.7
207M39.9Very low43.1Very low170 Ų170140.7 Ų140.784%0.83781%0.806SS**  trans-113106.7164.5-72.5-105-92.900107.3Q205Q205-M207 PolarHBondContact O-N 3.08Å
208F42.6Very low42.8Very low208 Ų208139.9 Ų139.991%0.91281%0.81SS**  trans168.7106.7138.5-109.3-89.2000109.9
209S45.4Very low42.3Very low109 Ų109138.3 Ų138.376%0.76281%0.811SS**PPolyproline II helixtrans-95.9143.6158-61.70000108.4
210P47Very low41.5Very low120 Ų120137.3 Ų137.378%0.77981%0.81SS**PPolyproline II helixtrans-80.9143169.430.4-29.5000111.3
211P51.3Low41Very low121 Ų121139 Ų13979%0.78682%0.815SS**PPolyproline II helixtrans-86.3140.9-177.232.6-32.4000113.4
212N44.8Very low40.7Very low163 Ų163139.1 Ų139.187%0.87281%0.813SS**PPolyproline II helixtrans-83.7137.4160-75.7-39.8000110
213S37.9Very low41.2Very low112 Ų112137.5 Ų137.578%0.78381%0.812SS**  trans-142.6101.9161.8-67.30000107.2
214I42.3Very low40.7Very low156 Ų156138.4 Ų138.480%0.882%0.817SS**  59115.388.5-53.6173.4000114.6
215S36Very low40.6Very low108 Ų108137.2 Ų137.276%0.75582%0.815SS**  trans157.2142131-72.10000108.6
216S36.4Very low40.4Very low119 Ų119134.2 Ų134.283%0.83281%0.809SS**  cis-174.1167.60.931.80000107.8
217M39.4Very low40.1Very low175 Ų175133.7 Ų133.786%0.86281%0.806SS**  trans-64.4147-170.3-54.6-169.9152.800115.7
218T39.7Very low39.9Very low145 Ų145129 Ų12989%0.8980%0.801SS**  trans-140.5127137.362.90000110.2
219S39.7Very low40Very low109 Ų109125.9 Ų125.976%0.76280%0.799SS**  trans-80.5149.5174.3-51.90000110.5
220S32.3Very low40Very low107 Ų107126.7 Ų126.775%0.74880%0.801SS**  178146.3121.837.40000114
221M37.1Very low39.4Very low174 Ų174124.6 Ų124.686%0.85780%0.801SS**  trans-56.7152.7179.947.9-98.516600117.3
222V36.6Very low39.1Very low131 Ų131124.8 Ų124.879%0.79481%0.806SS**  trans-53.6161.1158.7116.90000111.3
223P47.6Very low38.7Very low113 Ų113123 Ų12373%0.73481%0.806SS**  cis-148.2158.14831.7-7000120.2
224S38.1Very low38.9Very low121 Ų121125.2 Ų125.285%0.84681%0.808SS**  trans33.5123.3131.5-131.70000122.2
225A37.1Very low38.9Very low89 Ų89125.3 Ų125.374%0.73681%0.81SS**  trans177.3108.2140.700000108.8
226V37.2Very low38.8Very low123 Ų123125 Ų12575%0.74581%0.808SS**  86.4118.992.788.50000114.7
227T33.6Very low38.8Very low135 Ų135126.2 Ų126.283%0.82880%0.804SS**  trans58.6131.2147.949.60000122.3
228G35.8Very low38.8Very low71 Ų71124.2 Ų124.273%0.73280%0.797SS**  trans140.778.9137.500000117.4
229V44.8Very low38.7Very low143 Ų143123.4 Ų123.487%0.86779%0.787SS**  trans38140.8132.6-175.40000120.7
230P45.7Very low38.8Very low126 Ų126125.9 Ų125.982%0.81879%0.791SS**  trans-94.4160.6-160.737.6-28.9000114.1
231G35Very low39.1Very low75 Ų75128.4 Ų128.477%0.77380%0.796SS**  trans-144.1111.4175.300000112
232S43.7Very low39.1Very low126 Ų126127.2 Ų127.288%0.88179%0.793SS**  trans-56.2144.4177.6-43.80000114.1
233S37.7Very low39.2Very low125 Ų125128.2 Ų128.287%0.87479%0.794SS**  trans-165.8149.9144.440.40000112.2
234L40.4Very low38.7Very low159 Ų159128 Ų12883%0.83279%0.794SS**  trans-79.8158-163-64150.1000113.3
235N42.4Very low38.7Very low157 Ų157129.2 Ų129.284%0.8479%0.792SS**  trans152.397.4141.6-79.7-38.6000107.9
236S34.2Very low39.2Very low101 Ų101130.9 Ų130.971%0.70680%0.795SS**  46.8101.587.7-159.40000112.9
237L35.9Very low39.4Very low145 Ų145129.8 Ų129.876%0.75979%0.793SS**  171.2126.4122.3-86.5151000110.6
238N41.4Very low39.7Very low134 Ų134131.1 Ų131.172%0.71779%0.794SS**  trans70.6103.6145.1-66-34.2000120.8
239N36.2Very low40.1Very low128 Ų128135.1 Ų135.168%0.68480%0.798SS**  74.7101.4112-150.6-4.6000116.7
240L41.3Very low39.7Very low161 Ų161134 Ų13484%0.84380%0.797SS**  -172.7118.6106.7-113.777.2000109.5N242L240-N242 PolarHBondContact O-N 2.82Å
241N39.5Very low39.3Very low159 Ų159131.3 Ų131.385%0.8579%0.792SS**  trans-65.9116.2173.6-72.6-65.9000111.4
242N37.4Very low39.8Very low150 Ų150133.6 Ų133.680%0.80279%0.791SS**  trans-17398.5139-137.2-38000111.5L240L240-N242 PolarHBondContact O-N 2.82Å
243L38.7Very low40.1Very low152 Ų152133.4 Ų133.480%0.79679%0.787SS**  trans175140.9132.4-122.865.1000110.9
244S36.7Very low40.7Very low107 Ų107133.1 Ų133.175%0.74878%0.78SS**  trans92.7108.1153.3-34.30000118.3
245N39.1Very low41.1Very low148 Ų148131.7 Ų131.779%0.79178%0.78SS**  trans19.9141.1141.3-98.610.5000120
246P45.8Very low41.2Very low124 Ų124128.9 Ų128.981%0.80578%0.779SS**  -139.6147.893.234.9-20.4000115.3
247S41.2Very low41.5Very low100 Ų100129.4 Ų129.470%0.69978%0.781SS**  trans-42.8138.4153.6-51.30000111.4
248L40.4Very low42.3Very low162 Ų162128.3 Ų128.385%0.84878%0.783SS**  trans-174.8122.1140.8-96.4167.7000109.9
249N45.3Very low42.8Very low155 Ų155132.6 Ų132.683%0.82979%0.79SS**  trans13.5124.9153.8-80.4-29.3000120.3
250S36.5Very low43.4Very low119 Ų119130.7 Ų130.783%0.83279%0.793SS**  trans-153.896.5132.1-164.90000110.2
251G37.4Very low44.3Very low70 Ų70128.1 Ų128.172%0.72279%0.785SS**PPolyproline II helixtrans-81.8123.2168.100000109.4
252V45.3Very low44.9Very low124 Ų124126.9 Ų126.975%0.75279%0.786SS**PPolyproline II helixtrans-82.9124.7167.7178.90000107.7
253P49.2Very low45.9Very low122 Ų122125.7 Ų125.779%0.79278%0.784SS**PPolyproline II helixtrans-85117.5172.230.9-26.9000109.6
254T50.3Low46.8Very low119 Ų119123.9 Ų123.973%0.7378%0.782SS**PPolyproline II helixtrans-95.4142.615951.50000108.9A256T254-A256 PolarHBondContact O-N 3.35Å
255P49.3Very low47.5Very low128 Ų128124.7 Ų124.783%0.83178%0.784SS**PPolyproline II helixtrans-74.9124.7-175.928.5-31.5000110.9
256A43.2Very low47.8Very low99 Ų99126.5 Ų126.582%0.81878%0.781SS**PPolyproline II helixtrans-83.5134.517500000111T254T254-A256 PolarHBondContact O-N 3.35Å
257C42.4Very low47.9Very low111 Ų111126.5 Ų126.575%0.7578%0.779SS**PPolyproline II helixtrans-70.7146.3176.7-52.40000111.6Y259C257-Y259 PolarHBondContact O-N 2.9Å
258P52.3Low48.1Very low123 Ų123129 Ų12980%0.79977%0.774SS**SBendtrans-82.57.3-164.3-1027.9000116.8
259Y51.4Low48.4Very low223 Ų223131.5 Ų131.588%0.87577%0.772SS**  trans-135.444.1-169-83.8-83000114.7C257C257-Y259 PolarHBondContact O-N 2.9Å
260A49.3Very low48.2Very low89 Ų89127.8 Ų127.874%0.73675%0.752SS**  trans-103123.1168.200000110.7
261P58.8Low49Very low106 Ų106128.8 Ų128.869%0.68875%0.754SS**  trans-69.1153.9174.228.1-32.4000111.2T263P261-T263 PolarHBondContact O-N 2.97Å; P261-T263 VanDerWaalsContact O-N 3.08Å
262P52.2Low49.7Very low133 Ų133131.3 Ų131.386%0.86476%0.759SS**  trans-63.7113-174.624.3-32.4000111.3
263T59.4Low50.1Low125 Ų125130.1 Ų130.177%0.76775%0.749SS**PPolyproline II helixtrans-70.313416948.80000109.8P261P261-T263 PolarHBondContact O-N 2.97Å; P261-T263 VanDerWaalsContact O-N 3.08Å
264P57.3Low50.3Low115 Ų115128.3 Ų128.375%0.74774%0.738SS**PPolyproline II helixtrans-62.8149.8176.225.9-33000111.3Y266P264-Y266 PolarHBondContact O-N 2.89Å
265P52.1Low51Low123 Ų123125.3 Ų125.380%0.79972%0.723SS**SBendtrans-68.1125.8-172.928.9-33.2000109.9V267P265-V267 PolarHBondContact O-N 3.39Å
266Y45.2Very low51.9Low186 Ų186124.2 Ų124.273%0.72971%0.709SS**  trans43.977.3150.8-157.4-105.5000115.6P264 Y268P264-Y266 PolarHBondContact O-N 2.89Å; Y266-Y268 VanDerWaalsContact C-N 3.34Å; Y266-Y268 AromaticContact CE1-CD2 3.54Å; Y266-Y268 HydrophobicContact CE1-CD2 3.54Å; Y266-Y268 HydrophobicContact CE1-CE2 4.47Å; Y266-Y268 HydrophobicContact CE1-CG 4.26Å; Y266-Y268 AromaticContact CZ-CD2 3.9Å; Y266-Y268 PolarHBondContact O-N 3.05Å
267V46.5Very low53Low124 Ų124121.9 Ų121.975%0.75269%0.69SS**  trans-67.2103.2151.2-75.50000107P265 R269P265-V267 PolarHBondContact O-N 3.39Å; V267-R269 VanDerWaalsContact C-N 3.29Å; V267-R269 PolarHBondContact O-N 3.14Å
268Y45.7Very low54.4Low152 Ų152119.5 Ų119.560%0.59667%0.674SS**  trans-54.399.8163.1-166.6-116.3000107.1Y266 D270Y266-Y268 VanDerWaalsContact C-N 3.34Å; Y266-Y268 AromaticContact CE1-CD2 3.54Å; Y266-Y268 HydrophobicContact CE1-CD2 3.54Å; Y266-Y268 HydrophobicContact CE1-CE2 4.47Å; Y266-Y268 HydrophobicContact CE1-CG 4.26Å; Y266-Y268 AromaticContact CZ-CD2 3.9Å; Y266-Y268 PolarHBondContact O-N 3.05Å; Y268-D270 HydrophobicContact CD1-CB 4.42Å; Y268-D270 VanDerWaalsContact CD1-CG 3.44Å; Y268-D270 WeakPolarHBondContact CD1-OD1 3.47Å; Y268-D270 WeakPolarHBondContact CD1-OD2 3.45Å; Y268-D270 VanDerWaalsContact CE1-CG 3.44Å; Y268-D270 WeakPolarHBondContact CE1-OD1 3.49Å; Y268-D270 PolarHBondContact O-N 3.21Å
269R46.5Very low55.5Low215 Ų215118.5 Ų118.581%0.81166%0.662SS**  trans-75.287.6165.9-82.4-71.7-176.1170.51.3105.5V267 T271V267-R269 VanDerWaalsContact C-N 3.29Å; V267-R269 PolarHBondContact O-N 3.14Å; R269-T271 VanDerWaalsContact C-N 3.29Å; R269-T271 PolarHBondContact O-N 3.35Å
270D42.3Very low56.6Low77 Ų77116 Ų11641%0.41265%0.651SS.*  trans-54101.1156-84.5-59.2000107.5Y268 C272 N273Y268-D270 HydrophobicContact CD1-CB 4.42Å; Y268-D270 VanDerWaalsContact CD1-CG 3.44Å; Y268-D270 WeakPolarHBondContact CD1-OD1 3.47Å; Y268-D270 WeakPolarHBondContact CD1-OD2 3.45Å; Y268-D270 VanDerWaalsContact CE1-CG 3.44Å; Y268-D270 WeakPolarHBondContact CE1-OD1 3.49Å; Y268-D270 PolarHBondContact O-N 3.21Å; D270-C272 PolarHBondContact O-N 3.36Å; D270-N273 HydrophobicContact CB-CB 3.49Å; D270-N273 VanDerWaalsContact CB-CB 3.49Å; D270-N273 PolarHBondContact O-N 3.33Å
271T52Low57.6Low141 Ų141117.6 Ų117.687%0.86565%0.646SS**THydrogen-bonded Turntrans-60.1-4.7172.8-54.40000111.6R269R269-T271 VanDerWaalsContact C-N 3.29Å; R269-T271 PolarHBondContact O-N 3.35Å
272C52.1Low58.1Low122 Ų122119 Ų11982%0.82464%0.642SS**THydrogen-bonded Turntrans-127.57-177-61.50000116D270D270-C272 PolarHBondContact O-N 3.36Å
273N53.9Low58.7Low100 Ų100115.9 Ų115.954%0.53563%0.627SS.*  trans-106.346-177.8-162.43000114.2D270 S275D270-N273 HydrophobicContact CB-CB 3.49Å; D270-N273 VanDerWaalsContact CB-CB 3.49Å; D270-N273 PolarHBondContact O-N 3.33Å; N273-S275 VanDerWaalsContact C-N 3.27Å; N273-S275 PolarHBondContact O-N 3.07Å
274S53Low58.7Low83 Ų83118.7 Ų118.758%0.5863%0.628SS**  trans-92.468.9158.266.20000108.6L276S274-L276 PolarHBondContact O-N 2.98Å
275S66.4Low58.8Low57 Ų57120.7 Ų120.740%0.39963%0.628SS.*  trans-51136.3164.7175.10000108.1N273 A277 S278 L279N273-S275 VanDerWaalsContact C-N 3.27Å; N273-S275 PolarHBondContact O-N 3.07Å; S275-A277 PolarHBondContact O-N 2.82Å; S275-A277 PolarHBondContact OG-N 2.86Å; S275-S278 WeakPolarHBondContact O-CA 3.41Å; S275-S278 WeakPolarHBondContact O-CB 2.98Å; S275-S278 PolarHBondContact O-N 2.94Å; S275-L279 PolarHBondContact O-N 3.33Å
276L67.5Low58.9Low104 Ų104120.7 Ų120.755%0.54562%0.617SS.*Hα-helixtrans-58.3-24.4-178.3-142.8151000111S274 R280S274-L276 PolarHBondContact O-N 2.98Å; L276-R280 HydrophobicContact CD2-CG 4.39Å; L276-R280 VanDerWaalsContact O-CG 3.29Å; L276-R280 WeakPolarHBondContact O-CG 3.36Å; L276-R280 PolarHBondContact O-N 3.41Å
277A67.3Low59.2Low50 Ų50117 Ų11741%0.41362%0.618SS.*Hα-helixtrans-63.6-48.6168.700000112.6S275 L279 R280 L281S275-A277 PolarHBondContact O-N 2.82Å; S275-A277 PolarHBondContact OG-N 2.86Å; A277-L279 VanDerWaalsContact C-N 3.34Å; A277-L279 PolarHBondContact O-N 3.33Å; A277-R280 PolarHBondContact O-N 2.68Å; A277-L281 PolarHBondContact O-N 3.24Å
278S72Confident59.4Low61 Ų61116 Ų11643%0.42762%0.617SS.*Hα-helixtrans-61.6-40.6179.3-50.70000112.2S275 L281 K282S275-S278 WeakPolarHBondContact O-CA 3.41Å; S275-S278 WeakPolarHBondContact O-CB 2.98Å; S275-S278 PolarHBondContact O-N 2.94Å; S278-L281 PolarHBondContact O-N 3.41Å; S278-K282 WeakPolarHBondContact O-CB 3.48Å; S278-K282 PolarHBondContact O-N 3.46Å
279L74.8Confident59.7Low102 Ų102117.4 Ų117.453%0.53463%0.626SS.*Hα-helixtrans-64.3-41.7175.4-75.3164.8000112.1S275 A277 K282 A283S275-L279 PolarHBondContact O-N 3.33Å; A277-L279 VanDerWaalsContact C-N 3.34Å; A277-L279 PolarHBondContact O-N 3.33Å; L279-K282 PolarHBondContact O-N 3.04Å; L279-A283 WeakPolarHBondContact O-CB 3.37Å; L279-A283 PolarHBondContact O-N 3.25Å
280R74.3Confident59.6Low171 Ų171110.4 Ų110.465%0.64562%0.621SS**Hα-helixtrans-67.2-41.1176.8-75.8176.1177.6136.3-2.3112.5L276 A277 A283 K284L276-R280 HydrophobicContact CD2-CG 4.39Å; L276-R280 VanDerWaalsContact O-CG 3.29Å; L276-R280 WeakPolarHBondContact O-CG 3.36Å; L276-R280 PolarHBondContact O-N 3.41Å; A277-R280 PolarHBondContact O-N 2.68Å; R280-A283 PolarHBondContact O-N 3.43Å; R280-K284 PolarHBondContact O-N 3.41Å; R280-K284 VanDerWaalsContact O-N 3.17Å
281L70.3Confident59.7Low122 Ų122117.9 Ų117.964%0.63965%0.645SS**Hα-helixtrans-62-44.8174.1-95.4136.1000111.3A277 S278 A283 K284 Q285A277-L281 PolarHBondContact O-N 3.24Å; S278-L281 PolarHBondContact O-N 3.41Å; L281-A283 PolarHBondContact O-N 3.31Å; L281-K284 PolarHBondContact O-N 3.16Å; L281-Q285 WeakPolarHBondContact O-CG 3.48Å; L281-Q285 PolarHBondContact O-N 2.98Å
282K70.2Confident59.1Low137 Ų137115.7 Ų115.760%0.59664%0.641SS**Hα-helixtrans-62.4-41.3176-163.884.6173.4179.80111.9S278 L279 K284 Q285 H286S278-K282 WeakPolarHBondContact O-CB 3.48Å; S278-K282 PolarHBondContact O-N 3.46Å; L279-K282 PolarHBondContact O-N 3.04Å; K282-K284 VanDerWaalsContact C-N 3.29Å; K282-K284 PolarHBondContact O-N 3.46Å; K282-Q285 PolarHBondContact O-N 3.19Å; K282-H286 PolarHBondContact O-CD2 3.02Å; K282-H286 PolarHBondContact O-N 3.15Å
283A63.3Low58.6Low67 Ų67113.4 Ų113.455%0.55464%0.639SS**Hα-helixtrans-63.8-33.6178.300000112.8L279 R280 L281 Q285 H286L279-A283 WeakPolarHBondContact O-CB 3.37Å; L279-A283 PolarHBondContact O-N 3.25Å; R280-A283 PolarHBondContact O-N 3.43Å; L281-A283 PolarHBondContact O-N 3.31Å; A283-Q285 VanDerWaalsContact C-N 3.33Å; A283-H286 PolarHBondContact O-N 2.77Å
284K60.7Low58.1Low183 Ų183115.5 Ų115.580%0.79666%0.655SS**Hα-helixtrans-71-28.8177.3-134.5173.6167.1-157.60112.7R280 L281 K282R280-K284 PolarHBondContact O-N 3.41Å; R280-K284 VanDerWaalsContact O-N 3.17Å; L281-K284 PolarHBondContact O-N 3.16Å; K282-K284 VanDerWaalsContact C-N 3.29Å; K282-K284 PolarHBondContact O-N 3.46Å
285Q59.3Low57.6Low157 Ų157120.6 Ų120.673%0.73467%0.669SS**Hα-helixtrans-74.1-24.5178.3-66.1-94.7-51.500113L281 K282 A283L281-Q285 WeakPolarHBondContact O-CG 3.48Å; L281-Q285 PolarHBondContact O-N 2.98Å; K282-Q285 PolarHBondContact O-N 3.19Å; A283-Q285 VanDerWaalsContact C-N 3.33Å
286H53.8Low56.1Low123 Ų123125.1 Ų125.157%0.56969%0.689SS**THydrogen-bonded Turntrans-93.83.3178.1-71.8-80000114.2K282 A283 S288K282-H286 PolarHBondContact O-CD2 3.02Å; K282-H286 PolarHBondContact O-N 3.15Å; A283-H286 PolarHBondContact O-N 2.77Å; H286-S288 PolarHBondContact O-N 3.22Å
287S50.7Low55.1Low108 Ų108125.6 Ų125.676%0.75570%0.699SS**THydrogen-bonded Turntrans-77.7-2.2175.2-171.30000113.9
288S51.7Low54.1Low105 Ų105127.6 Ų127.673%0.73472%0.715SS**  trans-119.752.9-178.3-172.20000111.5H286H286-S288 PolarHBondContact O-N 3.22Å
289F52.6Low52.9Low180 Ų180131.6 Ų131.679%0.78974%0.737SS**  trans-96.688.8152.9-103.3-91.1000107Y291F289-Y291 PolarHBondContact O-N 3.44Å
290G44.2Very low52.1Low68 Ų68134.3 Ų134.370%0.70175%0.752SS**PPolyproline II helixtrans-64.1125.4167.100000108.7A292G290-A292 PolarHBondContact O-N 3.43Å
291Y42.9Very low51Low235 Ų235134.6 Ų134.692%0.92277%0.766SS**PPolyproline II helixtrans-65.8118.9161.4-79.2-90.1000107.3F289 G293F289-Y291 PolarHBondContact O-N 3.44Å; Y291-G293 PolarHBondContact O-N 3.42Å
292A39.9Very low49.8Very low94 Ų94134.1 Ų134.178%0.77777%0.772SS**PPolyproline II helixtrans-56.5125.7170.500000109G290 V294G290-A292 PolarHBondContact O-N 3.43Å; A292-V294 PolarHBondContact O-N 2.94Å
293G43Very low48.4Very low75 Ų75132.5 Ų132.577%0.77379%0.785SS**PPolyproline II helixtrans-62.9122.6176.300000110.6Y291 Q295Y291-G293 PolarHBondContact O-N 3.42Å; G293-Q295 PolarHBondContact O-N 3.33Å
294V42.7Very low48Very low143 Ų143134.3 Ų134.387%0.86779%0.792SS**  trans-81.5112162.5-1670000106A292 N296A292-V294 PolarHBondContact O-N 2.94Å; V294-N296 PolarHBondContact O-N 3.41Å
295Q42.2Very low47.5Very low190 Ų190133.3 Ų133.389%0.88879%0.79SS**  trans-62.6130169.9-69.3-170.510.200109G293G293-Q295 PolarHBondContact O-N 3.33Å
296N35.4Very low46.6Very low153 Ų153137.2 Ų137.282%0.81880%0.8SS**  trans-128126.4166.1-153.915.6000107.4V294V294-N296 PolarHBondContact O-N 3.41Å
297P46Very low46.5Very low114 Ų114134.7 Ų134.774%0.7480%0.8SS**  trans-82132.5-177.631.7-29.5000110.8
298A47.1Very low46.7Very low91 Ų91135.3 Ų135.375%0.75280%0.799SS**  trans48.1107.1150.900000119.4
299T45.5Very low46.5Very low146 Ų146137.3 Ų137.390%0.89680%0.801SS**  -151.9110.9122.145.40000109.5
300N57.6Low46.1Very low159 Ų159140.2 Ų140.285%0.8581%0.807SS**  trans-58.1123.5165.8-108-84.4000109.8
301L51.9Low46.9Very low177 Ų177142.8 Ų142.893%0.92781%0.811SS**  trans-154.7119.7144.2-82.1-173.7000110.1
302S45.3Very low47.5Very low112 Ų112141.9 Ų141.978%0.78383%0.83SS**  trans-70.5135.4177.3-175.20000111.1
303A41.7Very low47.9Very low103 Ų103144.3 Ų144.385%0.85183%0.833SS**  trans-108.174.617600000110.2
304C54Low48.2Very low105 Ų105147.9 Ų147.971%0.70984%0.836SS**  trans-131.7147.1158.5-74.20000107
305Q51Low48.5Very low161 Ų161148.2 Ų148.275%0.75283%0.834SS**  trans85.496-179-122.567.424.600115.3
306Y39.9Very low48.9Very low240 Ų240145.8 Ų145.894%0.94183%0.831SS**  -154.6110.3116.6-104.8-77.4000108.6
307A50.8Low49.7Very low69 Ų69145.3 Ų145.357%0.5783%0.832SS**  trans-113151.2167.600000107.9
308V54.8Low49.9Very low122 Ų122147.4 Ų147.474%0.73984%0.838SS**  trans69.6112.4158.8-141.20000117.1
309D48.9Very low50.1Low146 Ų146151.4 Ų151.478%0.78184%0.844SS**  159.2128107.9-97.1-51.7000111.1
310R42.4Very low50.5Low242 Ų242151.8 Ų151.891%0.91384%0.84SS**  trans-139.8113.1164.5-130.1177.4-171.7-171.51107.8
311P61.4Low49.9Very low121 Ų121151.3 Ų151.379%0.78684%0.839SS**  trans-83.8163.5179.133.9-31.6000111.9
312V56.6Low49.7Very low217 Ų217148.9 Ų148.9100%1.31583%0.831SS**  trans-43.20-176.3-178.90000115.3

Retrieved 312 of 312 residues in 327 ms (Link to these results)