A0A087YKS2_POEFO Loading...

Akirin-2

AlphaFold DB , UniProt , Accession A0A087YKS2, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 179 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
1M54Low51.7Low250 Ų250147.6 Ų147.6100%1.23286%0.855SS**  01100-71.6-167.7-173.900108.3
2A47.1Very low51.1Low100 Ų100147.3 Ų147.383%0.82685%0.848SS**  trans-164.6114.617200000109.7
3C47.1Very low50.2Low136 Ų136151.3 Ų151.392%0.91985%0.85SS**  trans-16089.9149.2-112.40000107.7A5C3-A5 PolarHBondContact O-N 3.34Å
4G50.1Low50Low77 Ų77149.9 Ų149.979%0.79484%0.839SS**  trans-75.4108.9166.600000108.7T6G4-T6 PolarHBondContact O-N 3.07Å
5A54.3Low49.8Very low94 Ų94147.1 Ų147.178%0.77783%0.831SS**  trans-75.8105.9169.500000108.7C3 L7C3-A5 PolarHBondContact O-N 3.34Å; A5-L7 PolarHBondContact O-N 2.83Å
6T57.8Low49.8Very low138 Ų138146.8 Ų146.885%0.84783%0.825SS**  trans-83.194.7167.142.60000108.4G4 K8G4-T6 PolarHBondContact O-N 3.07Å; T6-K8 PolarHBondContact O-N 2.73Å
7L50.6Low49.6Very low174 Ų174147.8 Ų147.891%0.91182%0.824SS**  trans-66.1114.6168.9-93.3156.9000108.8A5 R9A5-L7 PolarHBondContact O-N 2.83Å; L7-R9 PolarHBondContact O-N 3.28Å
8K58.8Low49Very low166 Ų166146.1 Ų146.172%0.72282%0.824SS**  trans-71.9108.5-173.3-166.4-175.3-178.5-174.70110.3T6T6-K8 PolarHBondContact O-N 2.73Å
9R53.6Low48.8Very low199 Ų199148.3 Ų148.375%0.75183%0.827SS**  trans51.9116.8149.9-62.6-174.2-119.9117.4-8.4118.9L7 L11L7-R9 PolarHBondContact O-N 3.28Å; R9-L11 PolarHBondContact O-N 3.14Å
10T48.4Very low48.2Very low124 Ų124145.6 Ų145.676%0.76182%0.824SS**  trans-47.3128.115033.50000110.3D12T10-D12 VanDerWaalsContact C-N 3.28Å; T10-D12 PolarHBondContact O-N 2.81Å
11L46.7Very low47.7Very low166 Ų166144.4 Ų144.487%0.86983%0.825SS**  trans-71.488.6164.8-82.5161.3000107.5R9 F13R9-L11 PolarHBondContact O-N 3.14Å; L11-F13 PolarHBondContact O-N 2.94Å
12D44.2Very low47.5Very low143 Ų143138.3 Ų138.377%0.76580%0.804SS**  trans-65114.7156.1-89.9-61.8000107.2T10 D14T10-D12 VanDerWaalsContact C-N 3.28Å; T10-D12 PolarHBondContact O-N 2.81Å; D12-D14 PolarHBondContact O-N 3.29Å
13F40.3Very low47.5Very low200 Ų200143 Ų14388%0.87781%0.806SS**  trans-63.7103.7166.5-99-98.5000107.6L11 P15L11-F13 PolarHBondContact O-N 2.94Å; F13-P15 WeakPolarHBondContact O-CD 3.29Å
14D46.8Very low47.9Very low131 Ų131148.4 Ų148.470%0.70181%0.807SS**  trans-64.8115.7173.3-174.214.4000110D12 L16D12-D14 PolarHBondContact O-N 3.29Å; D14-L16 PolarHBondContact O-N 3.3Å
15P46.5Very low48Very low109 Ų109156.5 Ų156.571%0.70881%0.813SS**  trans-70.197.2169.2-13.631000108.3F13 M17F13-P15 WeakPolarHBondContact O-CD 3.29Å; P15-M17 PolarHBondContact O-N 3.15Å
16L50.3Low48Very low141 Ų141163.9 Ų163.974%0.73882%0.821SS**SBendtrans-57.290.3160.7-73.5172.8000108.3D14D14-L16 PolarHBondContact O-N 3.3Å
17M46.2Very low47.2Very low164 Ų164163.5 Ų163.581%0.80882%0.823SS**  trans-177.952.6150.4-85.3-38.794.800109.9P15 Q19P15-M17 PolarHBondContact O-N 3.15Å; M17-Q19 VanDerWaalsContact C-N 3.29Å; M17-Q19 PolarHBondContact O-N 3.19Å; M17-Q19 VanDerWaalsContact O-N 3.09Å
18S39.7Very low47.5Very low118 Ų118159 Ų15983%0.82581%0.81SS**  trans-77.783.4158.8166.70000109.6
19Q44.3Very low46.8Very low188 Ų188157.1 Ų157.188%0.87982%0.816SS**  trans-13286.7153.2-78.4-156.915.200109.7M17M17-Q19 VanDerWaalsContact C-N 3.29Å; M17-Q19 PolarHBondContact O-N 3.19Å; M17-Q19 VanDerWaalsContact O-N 3.09Å
20A37.2Very low46.5Very low93 Ų93153.9 Ų153.977%0.76982%0.817SS**  trans-14876.8162.200000110.9
21S38.1Very low46.4Very low122 Ų122156.1 Ų156.185%0.85382%0.821SS**  trans-87.9114.3150.6-75.60000107.7K23S21-K23 PolarHBondContact O-N 3.23Å
22P49.8Very low46.6Very low121 Ų121153.2 Ų153.279%0.78682%0.815SS**  trans-87.297.1-172.331.3-31.2000111
23K46.1Very low46.8Very low199 Ų199152.2 Ų152.287%0.86582%0.816SS**SBendtrans-155.7107.6157.7-109.7144.7-175.1173.80111.9S21S21-K23 PolarHBondContact O-N 3.23Å
24R56.1Low47.2Very low250 Ų250148.5 Ų148.594%0.94381%0.81SS**  trans50.692.4163-66.1176.4114.9-160.54.7116.2
25R51.4Low47.4Very low246 Ų246147.9 Ų147.993%0.92882%0.815SS**  trans-125.5115.2145.9-108.1-180173.5-173-2.4109.8C27R25-C27 PolarHBondContact O-N 3.16Å
26R55.5Low47.4Very low249 Ų249146 Ų14694%0.9481%0.805SS**PPolyproline II helixtrans-51.3128.3171.2-127.8174.2-177.2177.6-0.8108.4A28R26-A28 PolarHBondContact O-N 3.41Å
27C40.8Very low47.2Very low130 Ų130144.4 Ų144.488%0.87880%0.803SS**PPolyproline II helixtrans-64.3120.3174.1-66.40000109.3R25R25-C27 PolarHBondContact O-N 3.16Å
28A56.2Low47.3Very low79 Ų79144 Ų14465%0.65380%0.799SS**PPolyproline II helixtrans-90.9142.8155.500000107.4R26 V30R26-A28 PolarHBondContact O-N 3.41Å; A28-V30 PolarHBondContact O-N 3.11Å; A28-V30 VanDerWaalsContact O-N 3.1Å
29P44Very low47.7Very low128 Ų128147.3 Ų147.383%0.83180%0.799SS**  trans-68113.8-179.328.8-32.3000108.7M31P29-M31 PolarHBondContact O-N 3.34Å; P29-M31 VanDerWaalsContact O-N 3.16Å
30V47.3Very low48.2Very low130 Ų130148.5 Ų148.579%0.78880%0.797SS**  trans-69.4109.1169.2177.10000106.3A28 S32A28-V30 PolarHBondContact O-N 3.11Å; A28-V30 VanDerWaalsContact O-N 3.1Å; V30-S32 PolarHBondContact O-N 3.36Å
31M47.6Very low48.7Very low172 Ų172151.3 Ų151.385%0.84780%0.798SS**  trans-60117.3166.2-62.4-118.474.800107.4P29P29-M31 PolarHBondContact O-N 3.34Å; P29-M31 VanDerWaalsContact O-N 3.16Å
32S50.8Low49.4Very low105 Ų105152.8 Ų152.873%0.73479%0.785SS**  trans-56.3126.9171.4-52.80000108.7V30 V34V30-S32 PolarHBondContact O-N 3.36Å; S32-V34 PolarHBondContact O-N 3.1Å
33P48.8Very low49.8Very low122 Ų122155 Ų15579%0.79279%0.787SS**  trans-68.5109169.227.2-28.2000106.9S35P33-S35 PolarHBondContact O-N 3.33Å; P33-S35 VanDerWaalsContact O-N 3.1Å
34V47.1Very low50.7Low122 Ų122150.8 Ų150.874%0.73977%0.77SS**  trans-47.5118.3159.9152.90000106.8S32 S36S32-V34 PolarHBondContact O-N 3.1Å; V34-S36 PolarHBondContact O-N 3.04Å
35S51.6Low51.4Low117 Ų117143.4 Ų143.482%0.81876%0.755SS**  trans-7077.6171.948.80000108.6P33P33-S35 PolarHBondContact O-N 3.33Å; P33-S35 VanDerWaalsContact O-N 3.1Å
36S47Very low52.5Low69 Ų69135.2 Ų135.248%0.48374%0.735SS.*  trans-62.7129.2164.6-67.30000108.4V34 Q38V34-S36 PolarHBondContact O-N 3.04Å; S36-Q38 PolarHBondContact O-N 3.5Å
37P46.8Very low52.8Low109 Ų109129 Ų12971%0.70873%0.727SS**G310 helixtrans-7517.9-175.930.7-33.5000113.4K39P37-K39 PolarHBondContact O-N 3.01Å
38Q47.9Very low53.5Low154 Ų154131 Ų13172%0.7272%0.721SS**G310 helixtrans-76-6.5-176.1-72.4-170.9-37.700114.2S36 Y40 L41S36-Q38 PolarHBondContact O-N 3.5Å; Q38-Y40 PolarHBondContact O-N 2.93Å; Q38-L41 PolarHBondContact O-N 3.38Å
39K48.3Very low53.9Low189 Ų189129.4 Ų129.482%0.82271%0.712SS**G310 helixtrans-73.1-11.6176.2-64.4-167.1-174.4-179.20113.9P37 L41 R42P37-K39 PolarHBondContact O-N 3.01Å; K39-L41 PolarHBondContact O-N 2.88Å; K39-R42 PolarHBondContact O-N 3.09Å
40Y53.1Low54.7Low213 Ų213130.7 Ų130.784%0.83571%0.707SS**G310 helixtrans-72.2-9.1173.7-84.2-85.2000114.4Q38Q38-Y40 PolarHBondContact O-N 2.93Å
41L49.5Very low55.4Low151 Ų151131.1 Ų131.179%0.79171%0.71SS**G310 helixtrans-88.9-2.1174.1-68.1176.2000113.6Q38 K39 M43Q38-L41 PolarHBondContact O-N 3.38Å; K39-L41 PolarHBondContact O-N 2.88Å; L41-M43 PolarHBondContact O-N 3.08Å
42R52.7Low56.1Low153 Ų153126.9 Ų126.958%0.57770%0.697SS**  trans-77.7108.5170.5-147.6-65-165.915720.1106.6K39 E44K39-R42 PolarHBondContact O-N 3.09Å; R42-E44 VanDerWaalsContact CZ-CG 3.45Å; R42-E44 IonicContact CZ-OE1 2.69Å; R42-E44 VanDerWaalsContact NH1-CA 3.25Å; R42-E44 VanDerWaalsContact NH1-CD 3.32Å; R42-E44 IonicContact NH1-OE1 2.97Å; R42-E44 PolarHBondContact NH1-OE1 3.44Å; R42-E44 IonicContact NH2-OE1 3.05Å; R42-E44 PolarHBondContact NH2-OE1 3.44Å; R42-E44 PolarHBondContact O-N 2.91Å
43M57Low56.7Low169 Ų169126.6 Ų126.683%0.83370%0.695SS**  trans-62.671.4159.7-65.9-82.196.600108.1L41L41-M43 PolarHBondContact O-N 3.08Å
44E66.2Low57.6Low109 Ų109130.1 Ų130.151%0.50969%0.692SS.*PPolyproline II helixtrans-85.3121.1168.1-124.6-60.1110.900106.8R42R42-E44 VanDerWaalsContact CZ-CG 3.45Å; R42-E44 IonicContact CZ-OE1 2.69Å; R42-E44 VanDerWaalsContact NH1-CA 3.25Å; R42-E44 VanDerWaalsContact NH1-CD 3.32Å; R42-E44 IonicContact NH1-OE1 2.97Å; R42-E44 PolarHBondContact NH1-OE1 3.44Å; R42-E44 IonicContact NH2-OE1 3.05Å; R42-E44 PolarHBondContact NH2-OE1 3.44Å; R42-E44 PolarHBondContact O-N 2.91Å
45P70.6Confident59.1Low96 Ų96128.6 Ų128.662%0.62368%0.679SS**PPolyproline II helixtrans-56143167.624.9-31.8000109
46S73.7Confident60.7Low74 Ų74126 Ų12652%0.51766%0.658SS.*PPolyproline II helixtrans-49133.4-175.4177.90000112F48 G49S46-F48 CarbonylContact O-C 3.59Å; S46-F48 PolarHBondContact O-N 3.29Å; S46-F48 VanDerWaalsContact O-N 3.14Å; S46-F48 PolarHBondContact OG-N 3.36Å; S46-G49 PolarHBondContact O-N 3.23Å; S46-G49 VanDerWaalsContact O-N 3.12Å
47P62.8Low62.5Low119 Ų119128 Ų12877%0.77367%0.668SS**SBendtrans-65.3-14.2174.526.5-33.1000112.6G49P47-G49 PolarHBondContact O-N 3.31Å
48F54Low64.5Low172 Ų172129 Ų12975%0.75466%0.663SS**SBendtrans-90.256.5164.4-56.4-80.6000110S46S46-F48 CarbonylContact O-C 3.59Å; S46-F48 PolarHBondContact O-N 3.29Å; S46-F48 VanDerWaalsContact O-N 3.14Å; S46-F48 PolarHBondContact OG-N 3.36Å
49G66.3Low66.5Low44 Ų44126.1 Ų126.145%0.45465%0.65SS.*  trans-53.4159.7170.300000111S46 P47 V51S46-G49 PolarHBondContact O-N 3.23Å; S46-G49 VanDerWaalsContact O-N 3.12Å; P47-G49 PolarHBondContact O-N 3.31Å; G49-V51 PolarHBondContact O-N 3.03Å
50E59.7Low68.6Low156 Ų156120.9 Ų120.973%0.72963%0.63SS**  trans-44.790.1-169.6-151168.9-163.900113.1S52 R54E50-S52 PolarHBondContact O-N 3.38Å; E50-R54 VanDerWaalsContact OE1-CD 3.25Å; E50-R54 WeakPolarHBondContact OE1-CD 3.43Å
51V63.3Low70.6Confident139 Ų139115.1 Ų115.184%0.84261%0.613SS**  trans-82.361.7-177.8-93.80000110.1G49G49-V51 PolarHBondContact O-N 3.03Å
52S61.2Low72.7Confident82 Ų82112.9 Ų112.957%0.57360%0.598SS**SBendtrans-178.8128.4157.6-1670000104.3E50 R54E50-S52 PolarHBondContact O-N 3.38Å; S52-R54 PolarHBondContact O-N 3.49Å
53S63.5Low74.6Confident99 Ų99109.2 Ų109.269%0.69259%0.59SS**  trans-58.796.4162.253.40000106.4L55S53-L55 VanDerWaalsContact C-N 3.3Å; S53-L55 PolarHBondContact O-N 3.35Å
54R68.2Low76.4Confident197 Ų197106.1 Ų106.174%0.74358%0.576SS**  trans-58.9102.1177-73.5-16497.9-169.79.4105.7E50 S52 T56E50-R54 VanDerWaalsContact OE1-CD 3.25Å; E50-R54 WeakPolarHBondContact OE1-CD 3.43Å; S52-R54 PolarHBondContact O-N 3.49Å; R54-T56 PolarHBondContact O-N 2.94Å; R54-T56 VanDerWaalsContact O-N 3.12Å
55L77.5Confident77.8Confident89 Ų89107 Ų10747%0.46658%0.578SS.*  trans-56.9124177.8-66.8174.8000106.3S53 Q59 I60S53-L55 VanDerWaalsContact C-N 3.3Å; S53-L55 PolarHBondContact O-N 3.35Å; L55-Q59 HydrophobicContact CB-CB 4.48Å; L55-I60 HydrophobicContact CB-CD1 4.16Å; L55-I60 HydrophobicContact CB-CG1 3.69Å; L55-I60 HydrophobicContact CD1-CG1 4.47Å
56T85.9Confident78.9Confident62 Ų62107.4 Ų107.438%0.3857%0.572SS.*  trans-64.5155.2178.878.30000108.7R54 E58 Q59 I60R54-T56 PolarHBondContact O-N 2.94Å; R54-T56 VanDerWaalsContact O-N 3.12Å; T56-E58 WeakPolarHBondContact CB-OE2 3.29Å; T56-E58 PolarHBondContact O-N 3.36Å; T56-E58 VanDerWaalsContact O-N 3.1Å; T56-E58 PolarHBondContact OG1-OE2 2.85Å; T56-Q59 WeakPolarHBondContact O-CB 3.47Å; T56-Q59 PolarHBondContact O-N 3.49Å; T56-Q59 WeakPolarHBondContact OG1-CG 3.26Å; T56-Q59 PolarHBondContact OG1-N 3.35Å; T56-I60 WeakPolarHBondContact O-CG1 3.43Å; T56-I60 PolarHBondContact O-N 3Å
57T84.1Confident79.8Confident111 Ų111108.2 Ų108.268%0.68157%0.567SS**Hα-helixtrans-53.2-36178.5-51.90000111.3I60 L61T57-I60 PolarHBondContact O-N 3.49Å; T57-L61 WeakPolarHBondContact O-CB 3.4Å; T57-L61 PolarHBondContact O-N 3.39Å
58E89.8Confident81.2Confident132 Ų132108 Ų10862%0.61755%0.552SS**Hα-helixtrans-66.3-40.9176.8-55.274.6-155.400112.1T56 L61 H62T56-E58 WeakPolarHBondContact CB-OE2 3.29Å; T56-E58 PolarHBondContact O-N 3.36Å; T56-E58 VanDerWaalsContact O-N 3.1Å; T56-E58 PolarHBondContact OG1-OE2 2.85Å; E58-L61 PolarHBondContact O-N 3.18Å; E58-H62 VanDerWaalsContact O-CB 3.3Å; E58-H62 WeakPolarHBondContact O-CB 3.46Å; E58-H62 PolarHBondContact O-N 3.5Å
59Q89.1Confident83Confident93 Ų93107 Ų10744%0.43555%0.547SS..Hα-helixtrans-68.1-39.1177.7-71.5175.2-10.900111.9L55 T56 H62 N63L55-Q59 HydrophobicContact CB-CB 4.48Å; T56-Q59 WeakPolarHBondContact O-CB 3.47Å; T56-Q59 PolarHBondContact O-N 3.49Å; T56-Q59 WeakPolarHBondContact OG1-CG 3.26Å; T56-Q59 PolarHBondContact OG1-N 3.35Å; Q59-H62 PolarHBondContact O-N 3.44Å; Q59-N63 WeakPolarHBondContact O-CB 3.37Å; Q59-N63 PolarHBondContact O-N 2.86Å; Q59-N63 PolarHBondContact O-ND2 2.84Å
60I93Very high84.3Confident78 Ų78108.8 Ų108.840%0.454%0.54SS..Hα-helixtrans-63.1-48.5174.8-63.4170.6000109.4L55 T56 T57 H62 N63 I64L55-I60 HydrophobicContact CB-CD1 4.16Å; L55-I60 HydrophobicContact CB-CG1 3.69Å; L55-I60 HydrophobicContact CD1-CG1 4.47Å; T56-I60 WeakPolarHBondContact O-CG1 3.43Å; T56-I60 PolarHBondContact O-N 3Å; T57-I60 PolarHBondContact O-N 3.49Å; I60-H62 VanDerWaalsContact C-N 3.28Å; I60-H62 PolarHBondContact O-N 2.92Å; I60-N63 PolarHBondContact O-N 3.34Å; I60-I64 HydrophobicContact CG2-CD1 3.75Å; I60-I64 HydrophobicContact CG2-CG1 4.42Å; I60-I64 VanDerWaalsContact O-CG1 3.28Å; I60-I64 WeakPolarHBondContact O-CG1 3.45Å; I60-I64 PolarHBondContact O-N 2.95Å
61L94.7Very high85.8Confident92 Ų92104 Ų10448%0.48252%0.519SS..Hα-helixtrans-59.1-41.5177.1-179.464000111.9T57 E58 I64 K65T57-L61 WeakPolarHBondContact O-CB 3.4Å; T57-L61 PolarHBondContact O-N 3.39Å; E58-L61 PolarHBondContact O-N 3.18Å; L61-I64 PolarHBondContact O-N 3.44Å; L61-K65 WeakPolarHBondContact O-CB 3.34Å; L61-K65 WeakPolarHBondContact O-CG 3.37Å; L61-K65 PolarHBondContact O-N 2.86Å
62H94.3Very high86.8Confident105 Ų105101.5 Ų101.549%0.48650%0.498SS..Hα-helixtrans-62.5-48.4177.2-172.379.1000111.8E58 Q59 I60 I64 K65 Q66E58-H62 VanDerWaalsContact O-CB 3.3Å; E58-H62 WeakPolarHBondContact O-CB 3.46Å; E58-H62 PolarHBondContact O-N 3.5Å; Q59-H62 PolarHBondContact O-N 3.44Å; I60-H62 VanDerWaalsContact C-N 3.28Å; I60-H62 PolarHBondContact O-N 2.92Å; H62-I64 PolarHBondContact O-N 3.19Å; H62-K65 PolarHBondContact O-N 3.46Å; H62-Q66 PolarHBondContact CD2-NE2 2.61Å; H62-Q66 PolarHBondContact NE2-NE2 3.19Å; H62-Q66 WeakPolarHBondContact O-CG 3.32Å; H62-Q66 PolarHBondContact O-N 3.28Å
63N92.9Very high88Confident75 Ų75106.5 Ų106.540%0.40151%0.51SS..Hα-helixtrans-58.9-46.8176.2-83.4-58.7000111.7Q59 I60 K65 Q66 E67Q59-N63 WeakPolarHBondContact O-CB 3.37Å; Q59-N63 PolarHBondContact O-N 2.86Å; Q59-N63 PolarHBondContact O-ND2 2.84Å; I60-N63 PolarHBondContact O-N 3.34Å; N63-K65 VanDerWaalsContact C-N 3.34Å; N63-K65 PolarHBondContact O-N 3.18Å; N63-Q66 PolarHBondContact O-N 3.47Å; N63-E67 WeakPolarHBondContact O-CB 3.23Å; N63-E67 VanDerWaalsContact O-CG 3.23Å; N63-E67 WeakPolarHBondContact O-CG 3.35Å; N63-E67 PolarHBondContact O-N 2.69Å
64I94.9Very high89.2Confident104 Ų104108.8 Ų108.853%0.53350%0.503SS..Hα-helixtrans-59-45.2177.6-66.7167.2000110.9I60 L61 H62 Q66 E67 Y68I60-I64 HydrophobicContact CG2-CD1 3.75Å; I60-I64 HydrophobicContact CG2-CG1 4.42Å; I60-I64 VanDerWaalsContact O-CG1 3.28Å; I60-I64 WeakPolarHBondContact O-CG1 3.45Å; I60-I64 PolarHBondContact O-N 2.95Å; L61-I64 PolarHBondContact O-N 3.44Å; H62-I64 PolarHBondContact O-N 3.19Å; I64-Q66 PolarHBondContact O-N 3.39Å; I64-E67 PolarHBondContact O-N 2.92Å; I64-Y68 VanDerWaalsContact O-CB 3.31Å; I64-Y68 WeakPolarHBondContact O-CB 3.29Å; I64-Y68 PolarHBondContact O-N 3.25Å
65K94.3Very high89.7Confident127 Ų127110 Ų11055%0.55251%0.508SS*.Hα-helixtrans-62-41.7177.5-78.4-179.2178.1179.70112.4L61 H62 N63 K69L61-K65 WeakPolarHBondContact O-CB 3.34Å; L61-K65 WeakPolarHBondContact O-CG 3.37Å; L61-K65 PolarHBondContact O-N 2.86Å; H62-K65 PolarHBondContact O-N 3.46Å; N63-K65 VanDerWaalsContact C-N 3.34Å; N63-K65 PolarHBondContact O-N 3.18Å; K65-K69 PolarHBondContact O-N 2.94Å
66Q94.2Very high89.2Confident106 Ų106112.4 Ų112.450%0.49552%0.517SS..Hα-helixtrans-66.4-45.6177.5-72.2-165.2-100111.7H62 N63 I64 Y68 K69 R70H62-Q66 PolarHBondContact CD2-NE2 2.61Å; H62-Q66 PolarHBondContact NE2-NE2 3.19Å; H62-Q66 WeakPolarHBondContact O-CG 3.32Å; H62-Q66 PolarHBondContact O-N 3.28Å; N63-Q66 PolarHBondContact O-N 3.47Å; I64-Q66 PolarHBondContact O-N 3.39Å; Q66-Y68 VanDerWaalsContact C-N 3.34Å; Q66-Y68 PolarHBondContact O-N 2.94Å; Q66-K69 PolarHBondContact O-N 2.99Å; Q66-R70 WeakPolarHBondContact O-CB 3.31Å; Q66-R70 PolarHBondContact O-N 3.38Å
67E92.1Very high88.1Confident90 Ų90112.5 Ų112.542%0.42151%0.514SS..Hα-helixtrans-62.8-41178.4-72.4-70.790.500111.5N63 I64 R70 L71N63-E67 WeakPolarHBondContact O-CB 3.23Å; N63-E67 VanDerWaalsContact O-CG 3.23Å; N63-E67 WeakPolarHBondContact O-CG 3.35Å; N63-E67 PolarHBondContact O-N 2.69Å; I64-E67 PolarHBondContact O-N 2.92Å; E67-R70 WeakPolarHBondContact O-CB 3.44Å; E67-R70 PolarHBondContact O-N 3.3Å; E67-R70 IonicContact OE1-CZ 3.54Å; E67-R70 IonicContact OE1-NE 3.7Å; E67-R70 PolarHBondContact OE1-NE 2.94Å; E67-R70 IonicContact OE1-NH2 2.61Å; E67-R70 PolarHBondContact OE1-NH2 3.25Å; E67-R70 IonicContact OE2-CZ 3.43Å; E67-R70 IonicContact OE2-NE 2.7Å; E67-R70 IonicContact OE2-NH2 3.52Å; E67-R70 PolarHBondContact OE2-NH2 3.18Å; E67-L71 VanDerWaalsContact O-CD1 3.29Å; E67-L71 WeakPolarHBondContact O-CD1 3.43Å; E67-L71 PolarHBondContact O-N 3.32Å
68Y92.5Very high86.8Confident115 Ų115114 Ų11445%0.45152%0.518SS..Hα-helixtrans-58-49.9173.9-178.6-95.1000111.7I64 Q66 R70 L71 Q72 L77I64-Y68 VanDerWaalsContact O-CB 3.31Å; I64-Y68 WeakPolarHBondContact O-CB 3.29Å; I64-Y68 PolarHBondContact O-N 3.25Å; Q66-Y68 VanDerWaalsContact C-N 3.34Å; Q66-Y68 PolarHBondContact O-N 2.94Å; Y68-R70 VanDerWaalsContact C-N 3.29Å; Y68-R70 PolarHBondContact O-N 2.83Å; Y68-L71 PolarHBondContact O-N 3.17Å; Y68-Q72 WeakPolarHBondContact O-CB 3.48Å; Y68-Q72 PolarHBondContact O-N 3.27Å; Y68-L77 HydrophobicContact CD2-CD1 3.85Å; Y68-L77 HydrophobicContact CE2-CD1 3.72Å; Y68-L77 HydrophobicContact CE2-CD2 3.86Å; Y68-L77 HydrophobicContact CE2-CG 4.46Å
69K92.6Very high85Confident151 Ų151112.2 Ų112.266%0.65752%0.52SS*.Hα-helixtrans-59.7-40.4175.4-74.4-176177.9-175.90111.9K65 Q66 Q72 K73K65-K69 PolarHBondContact O-N 2.94Å; Q66-K69 PolarHBondContact O-N 2.99Å; K69-Q72 PolarHBondContact O-N 3.39Å; K69-K73 PolarHBondContact O-N 3.48Å
70R92.8Very high83.3Confident81 Ų81111.8 Ų111.831%0.30653%0.532SS..Hα-helixtrans-65-39.8178.6-168.8-173.455.961.4-2.5111.7Q66 E67 Y68 R74Q66-R70 WeakPolarHBondContact O-CB 3.31Å; Q66-R70 PolarHBondContact O-N 3.38Å; E67-R70 WeakPolarHBondContact O-CB 3.44Å; E67-R70 PolarHBondContact O-N 3.3Å; E67-R70 IonicContact OE1-CZ 3.54Å; E67-R70 IonicContact OE1-NE 3.7Å; E67-R70 PolarHBondContact OE1-NE 2.94Å; E67-R70 IonicContact OE1-NH2 2.61Å; E67-R70 PolarHBondContact OE1-NH2 3.25Å; E67-R70 IonicContact OE2-CZ 3.43Å; E67-R70 IonicContact OE2-NE 2.7Å; E67-R70 IonicContact OE2-NH2 3.52Å; E67-R70 PolarHBondContact OE2-NH2 3.18Å; Y68-R70 VanDerWaalsContact C-N 3.29Å; Y68-R70 PolarHBondContact O-N 2.83Å; R70-R74 VanDerWaalsContact NH1-CZ 3.31Å; R70-R74 VanDerWaalsContact NH1-NH1 3.18Å; R70-R74 WeakPolarHBondContact O-CG 3.35Å; R70-R74 PolarHBondContact O-N 3.2Å
71L91.4Very high81.2Confident55 Ų55116.8 Ų116.829%0.28855%0.552SS.*Hα-helixtrans-69.5-42.1176-97.770.6000111.9E67 Y68 K73 R74 R75 H76 L77E67-L71 VanDerWaalsContact O-CD1 3.29Å; E67-L71 WeakPolarHBondContact O-CD1 3.43Å; E67-L71 PolarHBondContact O-N 3.32Å; Y68-L71 PolarHBondContact O-N 3.17Å; L71-K73 VanDerWaalsContact C-N 3.33Å; L71-K73 PolarHBondContact O-N 2.92Å; L71-R74 CarbonylContact O-C 3.59Å; L71-R74 PolarHBondContact O-N 3.35Å; L71-R74 VanDerWaalsContact O-N 3.08Å; L71-R75 PolarHBondContact O-N 2.99Å; L71-H76 PolarHBondContact O-N 3.18Å; L71-L77 HydrophobicContact CB-CD1 4.1Å; L71-L77 HydrophobicContact CD2-CD1 4.26Å
72Q84Confident79Confident87 Ų87118.9 Ų118.941%0.40756%0.559SS.*Hα-helixtrans-60-43.4177-165.2178.531.400111.2Y68 K69 R74 R75Y68-Q72 WeakPolarHBondContact O-CB 3.48Å; Y68-Q72 PolarHBondContact O-N 3.27Å; K69-Q72 PolarHBondContact O-N 3.39Å; Q72-R74 VanDerWaalsContact C-N 3.28Å; Q72-R74 PolarHBondContact O-N 3.48Å; Q72-R75 PolarHBondContact O-N 2.97Å; Q72-R75 VanDerWaalsContact O-N 3.11Å
73K86.8Confident76.5Confident188 Ų188122.7 Ų122.782%0.81758%0.577SS**Hα-helixtrans-61.7-33.5174.4-173.8177.9178.5-179.50112.9K69 L71 R75K69-K73 PolarHBondContact O-N 3.48Å; L71-K73 VanDerWaalsContact C-N 3.33Å; L71-K73 PolarHBondContact O-N 2.92Å; K73-R75 PolarHBondContact O-N 3.28Å
74R88.4Confident74Confident147 Ų147124.8 Ų124.856%0.55559%0.593SS**THydrogen-bonded Turntrans-800.1178.5-69.4177.6-175.9-168.41.8113.2R70 L71 Q72 H76R70-R74 VanDerWaalsContact NH1-CZ 3.31Å; R70-R74 VanDerWaalsContact NH1-NH1 3.18Å; R70-R74 WeakPolarHBondContact O-CG 3.35Å; R70-R74 PolarHBondContact O-N 3.2Å; L71-R74 CarbonylContact O-C 3.59Å; L71-R74 PolarHBondContact O-N 3.35Å; L71-R74 VanDerWaalsContact O-N 3.08Å; Q72-R74 VanDerWaalsContact C-N 3.28Å; Q72-R74 PolarHBondContact O-N 3.48Å; R74-H76 PolarHBondContact O-CD2 2.97Å; R74-H76 PolarHBondContact O-N 3.3Å
75R78.3Confident71.3Confident221 Ų221127.1 Ų127.183%0.83461%0.606SS**THydrogen-bonded Turntrans5229-171.1-57.5-149.8-57.9-104.32.9113.6L71 Q72 K73 L77L71-R75 PolarHBondContact O-N 2.99Å; Q72-R75 PolarHBondContact O-N 2.97Å; Q72-R75 VanDerWaalsContact O-N 3.11Å; K73-R75 PolarHBondContact O-N 3.28Å; R75-L77 VanDerWaalsContact C-N 3.32Å
76H67.4Low68.7Low141 Ų141126.8 Ų126.865%0.65362%0.62SS**  trans-90.1-0.4176-70.3-176.1000112.7L71 R74L71-H76 PolarHBondContact O-N 3.18Å; R74-H76 PolarHBondContact O-CD2 2.97Å; R74-H76 PolarHBondContact O-N 3.3Å
77L62.1Low65.6Low64 Ų64127.4 Ų127.434%0.33564%0.635SS.*SBendtrans-113.6112.7173.3-132.9132.7000105.9Y68 L71 R75 S79Y68-L77 HydrophobicContact CD2-CD1 3.85Å; Y68-L77 HydrophobicContact CE2-CD1 3.72Å; Y68-L77 HydrophobicContact CE2-CD2 3.86Å; Y68-L77 HydrophobicContact CE2-CG 4.46Å; L71-L77 HydrophobicContact CB-CD1 4.1Å; L71-L77 HydrophobicContact CD2-CD1 4.26Å; R75-L77 VanDerWaalsContact C-N 3.32Å; L77-S79 PolarHBondContact O-N 3.43Å; L77-S79 VanDerWaalsContact O-N 3.15Å
78D56.5Low62.7Low142 Ų142128.8 Ų128.876%0.75965%0.653SS**  trans-57.3121.5176.2-76.5-42.8000108.5A80D78-A80 PolarHBondContact O-N 2.7Å
79S52.4Low60.4Low95 Ų95128.7 Ų128.766%0.66467%0.667SS**THydrogen-bonded Turntrans-71.431.9179.3-172.60000112.3L77L77-S79 PolarHBondContact O-N 3.43Å; L77-S79 VanDerWaalsContact O-N 3.15Å
80A53.6Low58.1Low83 Ų83129.3 Ų129.369%0.68668%0.676SS**THydrogen-bonded Turntrans-85-12.2179.700000112.7D78D78-A80 PolarHBondContact O-N 2.7Å
81F49.6Very low55.2Low184 Ų184133.4 Ų133.481%0.80770%0.704SS**THydrogen-bonded Turntrans-87.3-3.3-176.3-148-95.3000114.8
82Q47.5Very low53.1Low136 Ų136138.1 Ų138.164%0.63673%0.729SS**THydrogen-bonded Turntrans-97.74.3-178.5-72.7-171.2104.100114.3
83Q42.8Very low50.8Low184 Ų184142.7 Ų142.786%0.8675%0.75SS**SBendtrans-103.515.5-175.9-147.617356.900114.8
84T39.8Very low48.4Very low120 Ų120141 Ų14174%0.73675%0.75SS**  trans-124.952.2174.163.30000111.7
85D38.5Very low46Very low153 Ų153141 Ų14182%0.81876%0.759SS**  trans-98.485.1157.8-80.9-38.6000108.8
86S39.1Very low44.2Very low120 Ų120139.1 Ų139.184%0.83976%0.76SS**  trans-169.3117.2150-980000112.4
87C29.4Very low42.7Very low118 Ų118137.3 Ų137.380%0.79777%0.77SS**  trans92.391153-137.70000119
88C31.7Very low41.3Very low119 Ų119138 Ų13880%0.80479%0.793SS**  80.8157122.4-73.20000121.7
89P43.9Very low40.3Very low114 Ų114136.6 Ų136.674%0.7479%0.793SS**  trans-109175.7-13343.1-38.2000115
90L44.7Very low40.1Very low164 Ų164137.6 Ų137.686%0.85980%0.798SS**  trans10.6115.2154.9-115.176.2000116.5
91D31.7Very low39.5Very low167 Ų167141.5 Ų141.589%0.89381%0.806SS**  trans-159.7143.8130.7-110.1-33.2000113.7
92L46.1Very low39.6Very low153 Ų153138.8 Ų138.880%0.80181%0.807SS**  trans-103.1118.3-174.8-174.382.6000107.9
93Q35.8Very low39Very low183 Ų183136.1 Ų136.186%0.85582%0.816SS**  trans172.6104.5160-96.3149.874.500108.6
94N37.8Very low39Very low152 Ų152132.4 Ų132.481%0.81382%0.817SS**  53127.483.5-157.211.6000115.6
95I38Very low38.9Very low147 Ų147132.2 Ų132.275%0.75482%0.821SS**  trans107.1114.6163.7-50.5-165.9000118.4
96Q40.5Very low39.3Very low183 Ų183130.6 Ų130.686%0.85582%0.821SS**  trans-25.2143.1159.9-71.3167-400118
97A35.5Very low39.2Very low103 Ų103132.6 Ų132.685%0.85182%0.822SS**  161.3132.6100.200000113.2
98G32.8Very low40.3Very low79 Ų79131.7 Ų131.781%0.81482%0.823SS**  trans86.9105.1135.300000120.9
99S34.8Very low41Very low111 Ų111131.2 Ų131.278%0.77682%0.822SS**  142.3130.8120.5-165.10000113.5
100P48Very low40.8Very low117 Ų117130.2 Ų130.276%0.7682%0.817SS**  trans-97.3140.6173.835.9-26.8000111.6
101L41.5Very low41Very low164 Ų164128.8 Ų128.886%0.85982%0.818SS**  trans-122.9138.5159.7-113.598.4000110.1
102P52.3Low41.9Very low127 Ų127125.7 Ų125.783%0.82581%0.805SS**  trans-93.8136.917535.6-28.1000110.6
103G34.9Very low42.3Very low80 Ų80130 Ų13083%0.82581%0.811SS**  trans-169.5112.217500000111.2
104A42.8Very low43Very low106 Ų106130.6 Ų130.688%0.87681%0.81SS**  trans-68.1146.7-172.300000114.4
105S36Very low43.8Very low117 Ų117132.9 Ų132.982%0.81882%0.816SS**  trans-167.2132.7133.255.30000110.8
106S47.7Very low44.4Very low118 Ų118133 Ų13383%0.82581%0.813SS**  trans-37.5135.6171.3-50.70000114.2
107D36.8Very low45.5Very low162 Ų162129.3 Ų129.387%0.86681%0.805SS**  trans-146.9125.5134.6-131.8-13.2000110.8S109D107-S109 PolarHBondContact O-N 2.87Å
108A52.7Low47.5Very low99 Ų99131.3 Ų131.382%0.81880%0.801SS**  trans-71.3116.6176.800000108.4
109S46.8Very low49.9Very low110 Ų110133.4 Ų133.477%0.76979%0.788SS**  trans-123.9108.916259.70000110.2D107D107-S109 PolarHBondContact O-N 2.87Å
110S40.2Very low52.7Low93 Ų93130.9 Ų130.965%0.6577%0.77SS**  trans-46133.517043.90000113.6T112S110-T112 VanDerWaalsContact C-N 3.27Å; S110-T112 PolarHBondContact O-N 3.21Å
111P47.5Very low54.8Low134 Ų134132.7 Ų132.787%0.8777%0.773SS**  trans-86.467171.536-31.5000109.4
112T50.8Low57.3Low101 Ų101134.6 Ų134.662%0.6277%0.768SS**  trans-134.458.8-178.758.80000112.3S110S110-T112 VanDerWaalsContact C-N 3.27Å; S110-T112 PolarHBondContact O-N 3.21Å
113R54.3Low59.4Low244 Ų244132.9 Ų132.992%0.92175%0.749SS**SBendtrans-13576.7151.8-64.3-72.7-172155.73.5107.5E115R113-E115 PolarHBondContact O-N 3.37Å
114K52Low62.3Low195 Ų195132 Ų13285%0.84873%0.728SS**  trans23.889147.4-63177.6179.1-178.50114.7Q116K114-Q116 VanDerWaalsContact C-N 3.27Å; K114-Q116 PolarHBondContact O-N 3.02Å
115E53.1Low64.8Low201 Ų201128.8 Ų128.894%0.93971%0.705SS**  14.970.5123.1-163.3172.3-174.800115.2R113R113-E115 PolarHBondContact O-N 3.37Å
116Q52.3Low67.7Low149 Ų149127.5 Ų127.570%0.69669%0.687SS**  trans-124.2117.5159.7-150.7167.432.600104K114 L118K114-Q116 VanDerWaalsContact C-N 3.27Å; K114-Q116 PolarHBondContact O-N 3.02Å; Q116-L118 PolarHBondContact O-N 3.43Å
117P63.6Low70.1Confident105 Ų105125 Ų12568%0.68266%0.664SS**  trans-66.989.2172.227.1-30.9000106.9F119P117-F119 PolarHBondContact O-N 2.86Å; P117-F119 VanDerWaalsContact O-N 3.14Å
118L76.9Confident72.9Confident145 Ų145120.2 Ų120.276%0.75964%0.643SS**  trans-70.6108.1171.1-71.3168.1000106Q116 S120Q116-L118 PolarHBondContact O-N 3.43Å; L118-S120 PolarHBondContact O-N 3.16Å
119F83.1Confident75.1Confident123 Ų123122.1 Ų122.154%0.53964%0.635SS.*  trans-61.7127174.5-63.7-75.2000109.1P117 Q123 V124 I127P117-F119 PolarHBondContact O-N 2.86Å; P117-F119 VanDerWaalsContact O-N 3.14Å; F119-Q123 HydrophobicContact CB-CB 4.07Å; F119-Q123 HydrophobicContact CD1-CB 4.07Å; F119-V124 HydrophobicContact CB-CG2 3.65Å; F119-I127 HydrophobicContact CD1-CD1 4.09Å; F119-I127 HydrophobicContact CE1-CD1 4.15Å; F119-I127 HydrophobicContact CG-CD1 4.37Å; F119-I127 HydrophobicContact CZ-CD1 4.49Å
120S92.8Very high77.5Confident58 Ų58124.6 Ų124.641%0.40663%0.627SS.*  trans-57.6152.316564.30000110.1L118 R122 Q123 V124L118-S120 PolarHBondContact O-N 3.16Å; S120-R122 PolarHBondContact O-N 3.47Å; S120-R122 VanDerWaalsContact O-N 3.09Å; S120-Q123 WeakPolarHBondContact O-CA 3.41Å; S120-Q123 WeakPolarHBondContact O-CB 3.29Å; S120-Q123 PolarHBondContact O-N 3.07Å; S120-Q123 VanDerWaalsContact OG-CD 3.31Å; S120-Q123 VanDerWaalsContact OG-CG 3.29Å; S120-Q123 WeakPolarHBondContact OG-CG 3.44Å; S120-Q123 PolarHBondContact OG-N 3.46Å; S120-Q123 PolarHBondContact OG-OE1 2.99Å; S120-V124 PolarHBondContact O-N 2.87Å
121L93.1Very high80.3Confident155 Ų155124.3 Ų124.381%0.81262%0.618SS**Hα-helixtrans-52.1-36.3176.7-177.761.9000112.2V124 G125L121-V124 PolarHBondContact O-N 3.38Å; L121-G125 PolarHBondContact O-N 2.96Å
122R93.6Very high82.7Confident205 Ų205124.1 Ų124.177%0.77461%0.609SS**Hα-helixtrans-62.8-43.8174.8-174.4-179.7174.2-140.7-1.4112.3S120 G125 M126S120-R122 PolarHBondContact O-N 3.47Å; S120-R122 VanDerWaalsContact O-N 3.09Å; R122-G125 PolarHBondContact O-N 3.38Å; R122-M126 WeakPolarHBondContact O-CG 3.27Å; R122-M126 PolarHBondContact O-N 3.21Å; R122-M126 VanDerWaalsContact O-N 3.1Å
123Q95.9Very high85Confident91 Ų91125.4 Ų125.443%0.42561%0.606SS.*Hα-helixtrans-65-40.8176.6-74.1162.7-39.200111.4F119 S120 G125 M126 I127F119-Q123 HydrophobicContact CB-CB 4.07Å; F119-Q123 HydrophobicContact CD1-CB 4.07Å; S120-Q123 WeakPolarHBondContact O-CA 3.41Å; S120-Q123 WeakPolarHBondContact O-CB 3.29Å; S120-Q123 PolarHBondContact O-N 3.07Å; S120-Q123 VanDerWaalsContact OG-CD 3.31Å; S120-Q123 VanDerWaalsContact OG-CG 3.29Å; S120-Q123 WeakPolarHBondContact OG-CG 3.44Å; S120-Q123 PolarHBondContact OG-N 3.46Å; S120-Q123 PolarHBondContact OG-OE1 2.99Å; Q123-G125 VanDerWaalsContact C-N 3.34Å; Q123-G125 PolarHBondContact O-N 3.44Å; Q123-M126 PolarHBondContact O-N 2.98Å; Q123-I127 WeakPolarHBondContact O-CD1 3.47Å; Q123-I127 VanDerWaalsContact O-CG1 3.26Å; Q123-I127 WeakPolarHBondContact O-CG1 3.5Å; Q123-I127 PolarHBondContact O-N 3.47Å
124V96.4Very high87.1Confident61 Ų61119.1 Ų119.137%0.3759%0.587SS.*Hα-helixtrans-63.2-42175.6-179.80000111F119 S120 L121 M126 I127 C128F119-V124 HydrophobicContact CB-CG2 3.65Å; S120-V124 PolarHBondContact O-N 2.87Å; L121-V124 PolarHBondContact O-N 3.38Å; V124-M126 PolarHBondContact O-N 2.93Å; V124-I127 PolarHBondContact O-N 3.49Å; V124-C128 PolarHBondContact O-N 3.49Å; V124-C128 PolarHBondContact O-SG 2.95Å
125G95.7Very high89.3Confident39 Ų39116 Ų11640%0.40257%0.573SS.*Hα-helixtrans-55.7-48.5174.300000112.4L121 R122 Q123 I127 C128 E129L121-G125 PolarHBondContact O-N 2.96Å; R122-G125 PolarHBondContact O-N 3.38Å; Q123-G125 VanDerWaalsContact C-N 3.34Å; Q123-G125 PolarHBondContact O-N 3.44Å; G125-I127 VanDerWaalsContact C-N 3.32Å; G125-I127 PolarHBondContact O-N 2.77Å; G125-C128 PolarHBondContact O-N 2.74Å; G125-E129 WeakPolarHBondContact O-CB 3.26Å; G125-E129 PolarHBondContact O-N 2.82Å
126M97.3Very high91.4Very high90 Ų90111.7 Ų111.744%0.44355%0.553SS.*Hα-helixtrans-61.5-38.1176.8-68.9177.161.800113R122 Q123 V124 R130R122-M126 WeakPolarHBondContact O-CG 3.27Å; R122-M126 PolarHBondContact O-N 3.21Å; R122-M126 VanDerWaalsContact O-N 3.1Å; Q123-M126 PolarHBondContact O-N 2.98Å; V124-M126 PolarHBondContact O-N 2.93Å; M126-R130 WeakPolarHBondContact O-CB 3.42Å; M126-R130 PolarHBondContact O-N 3.47Å
127I96.8Very high93.6Very high64 Ų64107.1 Ų107.133%0.32853%0.533SS..Hα-helixtrans-66.4-48.5178.5-67.9162.4000110F119 Q123 V124 G125 E129 R130 L131F119-I127 HydrophobicContact CD1-CD1 4.09Å; F119-I127 HydrophobicContact CE1-CD1 4.15Å; F119-I127 HydrophobicContact CG-CD1 4.37Å; F119-I127 HydrophobicContact CZ-CD1 4.49Å; Q123-I127 WeakPolarHBondContact O-CD1 3.47Å; Q123-I127 VanDerWaalsContact O-CG1 3.26Å; Q123-I127 WeakPolarHBondContact O-CG1 3.5Å; Q123-I127 PolarHBondContact O-N 3.47Å; V124-I127 PolarHBondContact O-N 3.49Å; G125-I127 VanDerWaalsContact C-N 3.32Å; G125-I127 PolarHBondContact O-N 2.77Å; I127-E129 PolarHBondContact O-N 2.91Å; I127-R130 PolarHBondContact O-N 3.35Å; I127-L131 HydrophobicContact CG2-CD1 3.85Å; I127-L131 HydrophobicContact CG2-CG 4.39Å; I127-L131 WeakPolarHBondContact O-CB 3.28Å; I127-L131 VanDerWaalsContact O-CG 3.29Å; I127-L131 WeakPolarHBondContact O-CG 3.41Å; I127-L131 PolarHBondContact O-N 3.48Å
128C97.2Very high95.3Very high63 Ų63107.7 Ų107.743%0.42653%0.525SS..Hα-helixtrans-61.6-44.1177.9-69.20000111.8V124 G125 R130 L131 L132V124-C128 PolarHBondContact O-N 3.49Å; V124-C128 PolarHBondContact O-SG 2.95Å; G125-C128 PolarHBondContact O-N 2.74Å; C128-R130 PolarHBondContact O-N 3.41Å; C128-L131 PolarHBondContact O-N 3.49Å; C128-L132 WeakPolarHBondContact O-CB 3.48Å; C128-L132 VanDerWaalsContact O-CG 3.26Å; C128-L132 WeakPolarHBondContact O-CG 3.43Å; C128-L132 PolarHBondContact O-N 3Å
129E97.2Very high96.3Very high139 Ų139106.8 Ų106.865%0.6552%0.52SS*.Hα-helixtrans-58.3-48.4176.3-176-175.717300111.4G125 I127 L131 L132 K133G125-E129 WeakPolarHBondContact O-CB 3.26Å; G125-E129 PolarHBondContact O-N 2.82Å; I127-E129 PolarHBondContact O-N 2.91Å; E129-L131 PolarHBondContact O-N 2.91Å; E129-L132 PolarHBondContact O-N 2.89Å; E129-K133 WeakPolarHBondContact O-CB 3.12Å; E129-K133 PolarHBondContact O-N 3.1Å
130R98.1Very high97.1Very high162 Ų162106.5 Ų106.561%0.61152%0.515SS*.Hα-helixtrans-62.2-44.5178.1-173.7-177.5-65.5145.6-1.1112.1M126 I127 C128 L132 K133 E134M126-R130 WeakPolarHBondContact O-CB 3.42Å; M126-R130 PolarHBondContact O-N 3.47Å; I127-R130 PolarHBondContact O-N 3.35Å; C128-R130 PolarHBondContact O-N 3.41Å; R130-L132 VanDerWaalsContact C-N 3.35Å; R130-L132 PolarHBondContact O-N 3.49Å; R130-K133 PolarHBondContact O-N 3.36Å; R130-E134 VanDerWaalsContact O-CB 3.32Å; R130-E134 WeakPolarHBondContact O-CB 3.36Å; R130-E134 PolarHBondContact O-N 3.01Å
131L98.3Very high97.4Very high87 Ų87110 Ų11046%0.45553%0.525SS..Hα-helixtrans-64.3-39.7179.6-74.5172.2000112.1I127 C128 E129 K135I127-L131 HydrophobicContact CG2-CD1 3.85Å; I127-L131 HydrophobicContact CG2-CG 4.39Å; I127-L131 WeakPolarHBondContact O-CB 3.28Å; I127-L131 VanDerWaalsContact O-CG 3.29Å; I127-L131 WeakPolarHBondContact O-CG 3.41Å; I127-L131 PolarHBondContact O-N 3.48Å; C128-L131 PolarHBondContact O-N 3.49Å; E129-L131 PolarHBondContact O-N 2.91Å; L131-K135 VanDerWaalsContact O-CG 3.27Å; L131-K135 WeakPolarHBondContact O-CG 3.5Å; L131-K135 PolarHBondContact O-N 3.35Å
132L98.3Very high97.6Very high129 Ų129107.1 Ų107.168%0.67551%0.507SS*.Hα-helixtrans-66.4-45.6176.2-71.8171.6000110.7C128 E129 R130 K135 E136C128-L132 WeakPolarHBondContact O-CB 3.48Å; C128-L132 VanDerWaalsContact O-CG 3.26Å; C128-L132 WeakPolarHBondContact O-CG 3.43Å; C128-L132 PolarHBondContact O-N 3Å; E129-L132 PolarHBondContact O-N 2.89Å; R130-L132 VanDerWaalsContact C-N 3.35Å; R130-L132 PolarHBondContact O-N 3.49Å; L132-K135 PolarHBondContact O-N 2.93Å; L132-E136 PolarHBondContact O-N 3.28Å
133K98.4Very high97.9Very high128 Ų128104.4 Ų104.456%0.55750%0.498SS*.Hα-helixtrans-60.3-46.3177.1-175.2174.4-179.2-1790112E129 R130 K135 E136 D137E129-K133 WeakPolarHBondContact O-CB 3.12Å; E129-K133 PolarHBondContact O-N 3.1Å; R130-K133 PolarHBondContact O-N 3.36Å; K133-K135 VanDerWaalsContact C-N 3.28Å; K133-K135 PolarHBondContact O-N 2.69Å; K133-E136 PolarHBondContact O-N 2.74Å; K133-E136 VanDerWaalsContact O-N 3.17Å; K133-D137 WeakPolarHBondContact CG-OD2 3.28Å; K133-D137 WeakPolarHBondContact O-CB 3.3Å; K133-D137 VanDerWaalsContact O-CG 3.3Å; K133-D137 PolarHBondContact O-N 3.12Å
134E98.3Very high98Very high113 Ų113103.9 Ų103.953%0.52850%0.498SS..Hα-helixtrans-58.4-39.7177.1-177.4-175.7-178.200112.1R130 K138R130-E134 VanDerWaalsContact O-CB 3.32Å; R130-E134 WeakPolarHBondContact O-CB 3.36Å; R130-E134 PolarHBondContact O-N 3.01Å; E134-K138 VanDerWaalsContact O-CB 3.29Å; E134-K138 WeakPolarHBondContact O-CB 3.25Å; E134-K138 PolarHBondContact O-N 2.78Å
135K98.4Very high98.1Very high128 Ų128106.9 Ų106.956%0.55751%0.508SS*.Hα-helixtrans-70.3-38.9177-67.1-67.1169.1660112.5L131 L132 K133 I139L131-K135 VanDerWaalsContact O-CG 3.27Å; L131-K135 WeakPolarHBondContact O-CG 3.5Å; L131-K135 PolarHBondContact O-N 3.35Å; L132-K135 PolarHBondContact O-N 2.93Å; K133-K135 VanDerWaalsContact C-N 3.28Å; K133-K135 PolarHBondContact O-N 2.69Å; K135-I139 VanDerWaalsContact O-CG1 3.25Å; K135-I139 WeakPolarHBondContact O-CG1 3.35Å; K135-I139 PolarHBondContact O-N 2.91Å; K135-I139 VanDerWaalsContact O-N 3.07Å
136E98.4Very high98.2Very high111 Ų111109.7 Ų109.752%0.51951%0.513SS..Hα-helixtrans-63.5-47.9174.4-173.8-174.3116.700111.2L132 K133 K138 I139 R140L132-E136 PolarHBondContact O-N 3.28Å; K133-E136 PolarHBondContact O-N 2.74Å; K133-E136 VanDerWaalsContact O-N 3.17Å; E136-K138 VanDerWaalsContact C-N 3.35Å; E136-K138 PolarHBondContact O-N 3.02Å; E136-I139 PolarHBondContact O-N 3.1Å; E136-R140 PolarHBondContact O-N 3.13Å; E136-R140 IonicContact OE1-CZ 2.72Å; E136-R140 IonicContact OE1-NH1 3.19Å; E136-R140 PolarHBondContact OE1-NH1 3.29Å; E136-R140 IonicContact OE1-NH2 3.4Å; E136-R140 PolarHBondContact OE1-NH2 2.92Å
137D98.5Very high98.3Very high53 Ų53108.9 Ų108.928%0.28351%0.51SS..Hα-helixtrans-61-45.3179.2-71.1-19.7000110.4K133 I139 R140 E141K133-D137 WeakPolarHBondContact CG-OD2 3.28Å; K133-D137 WeakPolarHBondContact O-CB 3.3Å; K133-D137 VanDerWaalsContact O-CG 3.3Å; K133-D137 PolarHBondContact O-N 3.12Å; D137-I139 PolarHBondContact O-N 3.3Å; D137-R140 WeakPolarHBondContact O-CB 3.39Å; D137-R140 PolarHBondContact O-N 3.32Å; D137-R140 VanDerWaalsContact O-N 3.16Å; D137-R140 IonicContact OD1-NH1 3.34Å; D137-R140 PolarHBondContact OD1-NH1 2.95Å; D137-E141 WeakPolarHBondContact O-CG 3.48Å; D137-E141 PolarHBondContact O-N 3.46Å
138K98.6Very high98.4Very high118 Ų118110.3 Ų110.351%0.51352%0.522SS..Hα-helixtrans-58.8-44.2175.1-175.1172.2-176.6173.30112.8E134 E136 R140 E141 E142E134-K138 VanDerWaalsContact O-CB 3.29Å; E134-K138 WeakPolarHBondContact O-CB 3.25Å; E134-K138 PolarHBondContact O-N 2.78Å; E136-K138 VanDerWaalsContact C-N 3.35Å; E136-K138 PolarHBondContact O-N 3.02Å; K138-R140 VanDerWaalsContact C-N 3.3Å; K138-R140 PolarHBondContact O-N 2.87Å; K138-E141 PolarHBondContact O-N 3.31Å; K138-E142 HydrophobicContact CG-CG 4.35Å; K138-E142 WeakPolarHBondContact O-CG 3.45Å; K138-E142 PolarHBondContact O-N 2.88Å
139I98.8Very high98.5Very high125 Ų125110.4 Ų110.464%0.64152%0.521SS*.Hα-helixtrans-63.4-40.5178.4-71.9167.8000110.8K135 E136 D137 Y143K135-I139 VanDerWaalsContact O-CG1 3.25Å; K135-I139 WeakPolarHBondContact O-CG1 3.35Å; K135-I139 PolarHBondContact O-N 2.91Å; K135-I139 VanDerWaalsContact O-N 3.07Å; E136-I139 PolarHBondContact O-N 3.1Å; D137-I139 PolarHBondContact O-N 3.3Å; I139-Y143 PolarHBondContact O-N 3.48Å; I139-Y143 VanDerWaalsContact O-N 3.1Å
140R98.7Very high98.5Very high117 Ų117108.7 Ų108.744%0.44251%0.511SS..Hα-helixtrans-65.1-45.8178-172.5-178.2-68.8111.7-1.2111.3E136 D137 K138 Y143 D144E136-R140 PolarHBondContact O-N 3.13Å; E136-R140 IonicContact OE1-CZ 2.72Å; E136-R140 IonicContact OE1-NH1 3.19Å; E136-R140 PolarHBondContact OE1-NH1 3.29Å; E136-R140 IonicContact OE1-NH2 3.4Å; E136-R140 PolarHBondContact OE1-NH2 2.92Å; D137-R140 WeakPolarHBondContact O-CB 3.39Å; D137-R140 PolarHBondContact O-N 3.32Å; D137-R140 VanDerWaalsContact O-N 3.16Å; D137-R140 IonicContact OD1-NH1 3.34Å; D137-R140 PolarHBondContact OD1-NH1 2.95Å; K138-R140 VanDerWaalsContact C-N 3.3Å; K138-R140 PolarHBondContact O-N 2.87Å; R140-Y143 WeakPolarHBondContact O-CB 3.21Å; R140-Y143 PolarHBondContact O-N 2.72Å; R140-D144 PolarHBondContact O-N 2.74Å
141E98.7Very high98.6Very high133 Ų133105.6 Ų105.662%0.62151%0.506SS*.Hα-helixtrans-59.4-47.8176.9-74.2173.9-177.500112D137 K138 Y143 D144 E145D137-E141 WeakPolarHBondContact O-CG 3.48Å; D137-E141 PolarHBondContact O-N 3.46Å; K138-E141 PolarHBondContact O-N 3.31Å; E141-Y143 VanDerWaalsContact C-N 3.29Å; E141-Y143 PolarHBondContact O-N 2.95Å; E141-D144 PolarHBondContact O-N 3.45Å; E141-E145 WeakPolarHBondContact O-CB 3.33Å; E141-E145 PolarHBondContact O-N 3.26Å
142E98.6Very high98.6Very high93 Ų93103.8 Ų103.844%0.43550%0.504SS..Hα-helixtrans-61.3-38.8178.2-65.7-88.2174.100111.7K138 I146K138-E142 HydrophobicContact CG-CG 4.35Å; K138-E142 WeakPolarHBondContact O-CG 3.45Å; K138-E142 PolarHBondContact O-N 2.88Å; E142-I146 WeakPolarHBondContact O-CB 3.5Å; E142-I146 WeakPolarHBondContact O-CD1 3.47Å; E142-I146 WeakPolarHBondContact O-CG1 3.45Å; E142-I146 PolarHBondContact O-N 2.87Å
143Y98.8Very high98.6Very high149 Ų149102.1 Ų102.158%0.58449%0.492SS*.Hα-helixtrans-63.2-47.9175.3175.9-93.7000111.7I139 R140 E141 E145 I146 L147I139-Y143 PolarHBondContact O-N 3.48Å; I139-Y143 VanDerWaalsContact O-N 3.1Å; R140-Y143 WeakPolarHBondContact O-CB 3.21Å; R140-Y143 PolarHBondContact O-N 2.72Å; E141-Y143 VanDerWaalsContact C-N 3.29Å; E141-Y143 PolarHBondContact O-N 2.95Å; Y143-E145 VanDerWaalsContact C-N 3.33Å; Y143-E145 PolarHBondContact O-N 2.89Å; Y143-I146 PolarHBondContact O-N 3.43Å; Y143-L147 HydrophobicContact CE1-CD2 4.09Å; Y143-L147 WeakPolarHBondContact O-CB 3.45Å; Y143-L147 PolarHBondContact O-N 3.4Å
144D98.7Very high98.6Very high80 Ų80102.4 Ų102.443%0.42850%0.496SS..Hα-helixtrans-65.4-37.7-179.5-72.5-18.6000111.6R140 E141 L147 T148R140-D144 PolarHBondContact O-N 2.74Å; E141-D144 PolarHBondContact O-N 3.45Å; D144-L147 PolarHBondContact O-N 2.98Å; D144-T148 VanDerWaalsContact O-CB 3.28Å; D144-T148 WeakPolarHBondContact O-CB 3.35Å; D144-T148 PolarHBondContact O-N 3.07Å; D144-T148 PolarHBondContact O-OG1 3.48Å
145E98.7Very high98.6Very high124 Ų124104.6 Ų104.658%0.57950%0.5SS*.Hα-helixtrans-62.3-49.4174.3-176.5178.7178.900111.4E141 Y143 L147 T148 T149E141-E145 WeakPolarHBondContact O-CB 3.33Å; E141-E145 PolarHBondContact O-N 3.26Å; Y143-E145 VanDerWaalsContact C-N 3.33Å; Y143-E145 PolarHBondContact O-N 2.89Å; E145-L147 PolarHBondContact O-N 3.22Å; E145-T148 PolarHBondContact O-N 3.47Å; E145-T149 WeakPolarHBondContact O-CB 3.1Å; E145-T149 PolarHBondContact O-N 3.15Å; E145-T149 PolarHBondContact O-OG1 3.42Å
146I98.7Very high98.6Very high98 Ų98102.4 Ų102.450%0.50350%0.495SS..Hα-helixtrans-61.7-46.4178-69.8166.8000110.2E142 Y143 T148 T149 K150E142-I146 WeakPolarHBondContact O-CB 3.5Å; E142-I146 WeakPolarHBondContact O-CD1 3.47Å; E142-I146 WeakPolarHBondContact O-CG1 3.45Å; E142-I146 PolarHBondContact O-N 2.87Å; Y143-I146 PolarHBondContact O-N 3.43Å; I146-T148 PolarHBondContact O-N 2.93Å; I146-T149 PolarHBondContact O-N 3.02Å; I146-K150 HydrophobicContact CG2-CG 4.2Å; I146-K150 WeakPolarHBondContact O-CB 3.42Å; I146-K150 WeakPolarHBondContact O-CG 3.25Å; I146-K150 PolarHBondContact O-N 2.96Å
147L98.7Very high98.6Very high73 Ų7399.9 Ų99.938%0.38249%0.493SS..Hα-helixtrans-59.5-48.6179.817760.6000111Y143 D144 E145 T149 K150 L151Y143-L147 HydrophobicContact CE1-CD2 4.09Å; Y143-L147 WeakPolarHBondContact O-CB 3.45Å; Y143-L147 PolarHBondContact O-N 3.4Å; D144-L147 PolarHBondContact O-N 2.98Å; E145-L147 PolarHBondContact O-N 3.22Å; L147-T149 VanDerWaalsContact C-N 3.35Å; L147-T149 PolarHBondContact O-N 2.91Å; L147-K150 PolarHBondContact O-N 3.01Å; L147-L151 HydrophobicContact CD1-CD1 4.15Å; L147-L151 HydrophobicContact CD1-CG 4.27Å; L147-L151 HydrophobicContact CG-CD1 4.17Å; L147-L151 WeakPolarHBondContact O-CG 3.35Å; L147-L151 PolarHBondContact O-N 3.11Å
148T98.6Very high98.6Very high94 Ų94103.9 Ų103.958%0.57751%0.508SS*.Hα-helixtrans-60.2-46.4179-58.80000111D144 E145 I146 K150 L151 A152D144-T148 VanDerWaalsContact O-CB 3.28Å; D144-T148 WeakPolarHBondContact O-CB 3.35Å; D144-T148 PolarHBondContact O-N 3.07Å; D144-T148 PolarHBondContact O-OG1 3.48Å; E145-T148 PolarHBondContact O-N 3.47Å; I146-T148 PolarHBondContact O-N 2.93Å; T148-K150 PolarHBondContact O-N 3.35Å; T148-L151 PolarHBondContact O-N 3.12Å; T148-A152 WeakPolarHBondContact O-CB 3.2Å; T148-A152 PolarHBondContact O-N 3.33Å
149T98.7Very high98.5Very high64 Ų64101.2 Ų101.239%0.39350%0.501SS..Hα-helixtrans-59.9-45.5177.3-590000111.2E145 I146 L147 L151 A152 E153E145-T149 WeakPolarHBondContact O-CB 3.1Å; E145-T149 PolarHBondContact O-N 3.15Å; E145-T149 PolarHBondContact O-OG1 3.42Å; I146-T149 PolarHBondContact O-N 3.02Å; L147-T149 VanDerWaalsContact C-N 3.35Å; L147-T149 PolarHBondContact O-N 2.91Å; T149-L151 PolarHBondContact O-N 3.39Å; T149-A152 PolarHBondContact O-N 3.24Å; T149-E153 WeakPolarHBondContact O-CG 3.19Å; T149-E153 PolarHBondContact O-N 3.5Å
150K98.7Very high98.5Very high103 Ų103101.6 Ų101.645%0.44850%0.498SS..Hα-helixtrans-65-38.6179.5-69.5-71.7153.7-145.20112.5I146 L147 T148 E153 Q154I146-K150 HydrophobicContact CG2-CG 4.2Å; I146-K150 WeakPolarHBondContact O-CB 3.42Å; I146-K150 WeakPolarHBondContact O-CG 3.25Å; I146-K150 PolarHBondContact O-N 2.96Å; L147-K150 PolarHBondContact O-N 3.01Å; T148-K150 PolarHBondContact O-N 3.35Å; K150-E153 IonicContact NZ-OE1 2.67Å; K150-E153 PolarHBondContact NZ-OE1 2.87Å; K150-E153 IonicContact NZ-OE2 3.16Å; K150-E153 PolarHBondContact NZ-OE2 2.93Å; K150-Q154 WeakPolarHBondContact O-CG 3.42Å; K150-Q154 PolarHBondContact O-N 3.16Å; K150-Q154 VanDerWaalsContact O-N 3.11Å
151L98.8Very high98.4Very high98 Ų98101.8 Ų101.851%0.51350%0.502SS..Hα-helixtrans-66.9-40.7175.6-71.2174.2000111.7L147 T148 T149 Q154 Y155L147-L151 HydrophobicContact CD1-CD1 4.15Å; L147-L151 HydrophobicContact CD1-CG 4.27Å; L147-L151 HydrophobicContact CG-CD1 4.17Å; L147-L151 WeakPolarHBondContact O-CG 3.35Å; L147-L151 PolarHBondContact O-N 3.11Å; T148-L151 PolarHBondContact O-N 3.12Å; T149-L151 PolarHBondContact O-N 3.39Å; L151-Q154 PolarHBondContact O-N 3.4Å; L151-Y155 PolarHBondContact O-N 3.16Å
152A98.6Very high98.2Very high48 Ų4898.8 Ų98.840%0.39749%0.493SS..Hα-helixtrans-63.9-45.6175.600000111.8T148 T149 Q154 Y155 D156T148-A152 WeakPolarHBondContact O-CB 3.2Å; T148-A152 PolarHBondContact O-N 3.33Å; T149-A152 PolarHBondContact O-N 3.24Å; A152-Q154 VanDerWaalsContact C-N 3.28Å; A152-Q154 PolarHBondContact O-N 3.14Å; A152-Y155 WeakPolarHBondContact O-CB 3.45Å; A152-Y155 PolarHBondContact O-N 2.75Å; A152-Y155 VanDerWaalsContact O-N 3.13Å; A152-D156 PolarHBondContact O-N 2.76Å
153E98.6Very high98.1Very high95 Ų9599.5 Ų99.544%0.44450%0.496SS..Hα-helixtrans-56.6-41.8175.2-75.2173.3178.300111.9T149 K150 A157T149-E153 WeakPolarHBondContact O-CG 3.19Å; T149-E153 PolarHBondContact O-N 3.5Å; K150-E153 IonicContact NZ-OE1 2.67Å; K150-E153 PolarHBondContact NZ-OE1 2.87Å; K150-E153 IonicContact NZ-OE2 3.16Å; K150-E153 PolarHBondContact NZ-OE2 2.93Å; E153-A157 VanDerWaalsContact O-CB 3.32Å; E153-A157 WeakPolarHBondContact O-CB 3.31Å; E153-A157 PolarHBondContact O-N 3.39Å
154Q98.6Very high97.9Very high134 Ų13496 Ų9663%0.62649%0.488SS*.Hα-helixtrans-64.2-44.4176.2-75.4-177.71.400112K150 L151 A152 A157 F158K150-Q154 WeakPolarHBondContact O-CG 3.42Å; K150-Q154 PolarHBondContact O-N 3.16Å; K150-Q154 VanDerWaalsContact O-N 3.11Å; L151-Q154 PolarHBondContact O-N 3.4Å; A152-Q154 VanDerWaalsContact C-N 3.28Å; A152-Q154 PolarHBondContact O-N 3.14Å; Q154-A157 PolarHBondContact O-N 3.4Å; Q154-F158 PolarHBondContact O-N 2.83Å
155Y98.5Very high97.6Very high158 Ų15895.2 Ų95.262%0.6248%0.482SS*.Hα-helixtrans-60.2-49.3176.6176.7-97.8000111.3L151 A152 A157 F158 V159L151-Y155 PolarHBondContact O-N 3.16Å; A152-Y155 WeakPolarHBondContact O-CB 3.45Å; A152-Y155 PolarHBondContact O-N 2.75Å; A152-Y155 VanDerWaalsContact O-N 3.13Å; Y155-A157 VanDerWaalsContact C-N 3.33Å; Y155-A157 PolarHBondContact O-N 2.94Å; Y155-F158 WeakPolarHBondContact O-CB 3.41Å; Y155-F158 PolarHBondContact O-N 3.27Å; Y155-F158 VanDerWaalsContact O-N 3.15Å; Y155-V159 HydrophobicContact CD1-CG2 4.21Å; Y155-V159 HydrophobicContact CD2-CG2 4.44Å; Y155-V159 HydrophobicContact CE1-CG2 3.75Å; Y155-V159 HydrophobicContact CE2-CG2 4Å; Y155-V159 WeakPolarHBondContact O-CG2 3.36Å; Y155-V159 PolarHBondContact O-N 2.88Å
156D98.3Very high97.3Very high82 Ų8293.7 Ų93.744%0.43948%0.477SS..Hα-helixtrans-60.7-42.1179-78.5-5.1000111.9A152 F158 V159 K160A152-D156 PolarHBondContact O-N 2.76Å; D156-F158 VanDerWaalsContact C-N 3.34Å; D156-F158 PolarHBondContact O-N 3.03Å; D156-V159 PolarHBondContact O-N 3.38Å; D156-K160 VanDerWaalsContact O-CB 3.31Å; D156-K160 WeakPolarHBondContact O-CB 3.25Å; D156-K160 VanDerWaalsContact O-CG 3.25Å; D156-K160 WeakPolarHBondContact O-CG 3.31Å; D156-K160 PolarHBondContact O-N 3.48Å
157A97.9Very high96.8Very high58 Ų5893.9 Ų93.948%0.47948%0.477SS..Hα-helixtrans-61.9-41.8176.300000111.7E153 Q154 Y155 F161E153-A157 VanDerWaalsContact O-CB 3.32Å; E153-A157 WeakPolarHBondContact O-CB 3.31Å; E153-A157 PolarHBondContact O-N 3.39Å; Q154-A157 PolarHBondContact O-N 3.4Å; Y155-A157 VanDerWaalsContact C-N 3.33Å; Y155-A157 PolarHBondContact O-N 2.94Å; A157-F161 VanDerWaalsContact O-CB 3.31Å; A157-F161 WeakPolarHBondContact O-CB 3.48Å; A157-F161 PolarHBondContact O-N 3.41Å
158F97.9Very high96.4Very high138 Ų13897.3 Ų97.361%0.60549%0.485SS*.Hα-helixtrans-65.5-44.7177.2174.9-98.6000112.3Q154 Y155 D156 F161 T162Q154-F158 PolarHBondContact O-N 2.83Å; Y155-F158 WeakPolarHBondContact O-CB 3.41Å; Y155-F158 PolarHBondContact O-N 3.27Å; Y155-F158 VanDerWaalsContact O-N 3.15Å; D156-F158 VanDerWaalsContact C-N 3.34Å; D156-F158 PolarHBondContact O-N 3.03Å; F158-F161 PolarHBondContact O-N 3.09Å; F158-T162 PolarHBondContact O-N 3.02Å; F158-T162 PolarHBondContact O-OG1 2.77Å
159V97.9Very high95.7Very high61 Ų61101.8 Ų101.837%0.3749%0.491SS..Hα-helixtrans-63.3-47.6177.5172.50000110.5Y155 D156 F161 T162 H163Y155-V159 HydrophobicContact CD1-CG2 4.21Å; Y155-V159 HydrophobicContact CD2-CG2 4.44Å; Y155-V159 HydrophobicContact CE1-CG2 3.75Å; Y155-V159 HydrophobicContact CE2-CG2 4Å; Y155-V159 WeakPolarHBondContact O-CG2 3.36Å; Y155-V159 PolarHBondContact O-N 2.88Å; D156-V159 PolarHBondContact O-N 3.38Å; V159-F161 PolarHBondContact O-N 2.98Å; V159-T162 PolarHBondContact O-N 3.43Å; V159-H163 WeakPolarHBondContact O-CB 3.41Å; V159-H163 PolarHBondContact O-N 2.88Å
160K97.4Very high94.7Very high134 Ų134105.2 Ų105.258%0.58350%0.501SS*.Hα-helixtrans-58.5-47176.1-75.8173.6-177.7173.10111.7D156 T162 H163 D164D156-K160 VanDerWaalsContact O-CB 3.31Å; D156-K160 WeakPolarHBondContact O-CB 3.25Å; D156-K160 VanDerWaalsContact O-CG 3.25Å; D156-K160 WeakPolarHBondContact O-CG 3.31Å; D156-K160 PolarHBondContact O-N 3.48Å; K160-T162 VanDerWaalsContact C-N 3.32Å; K160-T162 PolarHBondContact O-N 2.76Å; K160-H163 PolarHBondContact O-N 3.26Å; K160-D164 WeakPolarHBondContact O-CB 3.32Å; K160-D164 VanDerWaalsContact O-CG 3.24Å; K160-D164 PolarHBondContact O-N 3.12Å
161F97.5Very high93Very high120 Ų120103 Ų10353%0.52651%0.507SS..Hα-helixtrans-57.8-46176.6176.5-98.8000111.7A157 F158 V159 D164 Q165A157-F161 VanDerWaalsContact O-CB 3.31Å; A157-F161 WeakPolarHBondContact O-CB 3.48Å; A157-F161 PolarHBondContact O-N 3.41Å; F158-F161 PolarHBondContact O-N 3.09Å; V159-F161 PolarHBondContact O-N 2.98Å; F161-D164 PolarHBondContact O-N 3.33Å; F161-Q165 HydrophobicContact CD1-CG 4.16Å; F161-Q165 HydrophobicContact CD2-CG 4.3Å; F161-Q165 HydrophobicContact CE1-CG 3.79Å; F161-Q165 HydrophobicContact CE2-CG 3.94Å; F161-Q165 HydrophobicContact CG-CG 4.42Å; F161-Q165 HydrophobicContact CZ-CG 3.67Å; F161-Q165 WeakPolarHBondContact O-CB 3.17Å; F161-Q165 WeakPolarHBondContact O-CG 3.43Å; F161-Q165 PolarHBondContact O-N 3.35Å
162T94.9Very high91Very high70 Ų70106.1 Ų106.143%0.42952%0.519SS..Hα-helixtrans-64.2-43.4179.4-550000111.6F158 V159 K160 Q165 L166F158-T162 PolarHBondContact O-N 3.02Å; F158-T162 PolarHBondContact O-OG1 2.77Å; V159-T162 PolarHBondContact O-N 3.43Å; K160-T162 VanDerWaalsContact C-N 3.32Å; K160-T162 PolarHBondContact O-N 2.76Å; T162-Q165 PolarHBondContact O-N 3.33Å; T162-L166 PolarHBondContact O-N 3.21Å
163H94.8Very high88.9Confident108 Ų108110.4 Ų110.450%0.553%0.531SS..Hα-helixtrans-61.3-47.8176-176.572.2000111.7V159 K160 Q165 L166 M167V159-H163 WeakPolarHBondContact O-CB 3.41Å; V159-H163 PolarHBondContact O-N 2.88Å; K160-H163 PolarHBondContact O-N 3.26Å; H163-Q165 VanDerWaalsContact C-N 3.32Å; H163-Q165 PolarHBondContact O-N 2.73Å; H163-L166 WeakPolarHBondContact O-CB 3.39Å; H163-L166 PolarHBondContact O-N 2.67Å; H163-L166 VanDerWaalsContact O-N 3.16Å; H163-M167 WeakPolarHBondContact O-CG 3.38Å; H163-M167 PolarHBondContact O-N 3.42Å
164D94.8Very high86.8Confident75 Ų75111.2 Ų111.240%0.40155%0.545SS..Hα-helixtrans-64-36.4179.1-72.1-6.6000112.4K160 F161 L166 M167 R168K160-D164 WeakPolarHBondContact O-CB 3.32Å; K160-D164 VanDerWaalsContact O-CG 3.24Å; K160-D164 PolarHBondContact O-N 3.12Å; F161-D164 PolarHBondContact O-N 3.33Å; D164-L166 VanDerWaalsContact C-N 3.35Å; D164-M167 PolarHBondContact O-N 2.92Å; D164-R168 WeakPolarHBondContact O-CB 3.14Å; D164-R168 PolarHBondContact O-N 3.1Å; D164-R168 PolarHBondContact O-NE 2.82Å
165Q92.1Very high84.7Confident64 Ų64108.9 Ų108.930%0.29955%0.548SS..Hα-helixtrans-67.4-37.7175.5-72.4-70.887.700111.5F161 T162 H163 R169F161-Q165 HydrophobicContact CD1-CG 4.16Å; F161-Q165 HydrophobicContact CD2-CG 4.3Å; F161-Q165 HydrophobicContact CE1-CG 3.79Å; F161-Q165 HydrophobicContact CE2-CG 3.94Å; F161-Q165 HydrophobicContact CG-CG 4.42Å; F161-Q165 HydrophobicContact CZ-CG 3.67Å; F161-Q165 WeakPolarHBondContact O-CB 3.17Å; F161-Q165 WeakPolarHBondContact O-CG 3.43Å; F161-Q165 PolarHBondContact O-N 3.35Å; T162-Q165 PolarHBondContact O-N 3.33Å; H163-Q165 VanDerWaalsContact C-N 3.32Å; H163-Q165 PolarHBondContact O-N 2.73Å; Q165-R169 WeakPolarHBondContact O-CG 3.39Å; Q165-R169 PolarHBondContact O-N 2.99Å; Q165-R169 VanDerWaalsContact O-N 3.12Å
166L92.6Very high82.7Confident93 Ų93106.4 Ų106.449%0.48755%0.554SS.*Hα-helixtrans-65.8-49.3173.6-171.573.3000110.5T162 H163 D164 R168 R169 F170T162-L166 PolarHBondContact O-N 3.21Å; H163-L166 WeakPolarHBondContact O-CB 3.39Å; H163-L166 PolarHBondContact O-N 2.67Å; H163-L166 VanDerWaalsContact O-N 3.16Å; D164-L166 VanDerWaalsContact C-N 3.35Å; L166-R168 VanDerWaalsContact C-N 3.34Å; L166-R168 PolarHBondContact O-N 3.05Å; L166-R169 PolarHBondContact O-N 3.25Å; L166-R169 VanDerWaalsContact O-N 3.16Å; L166-F170 HydrophobicContact CD1-CD2 3.44Å; L166-F170 VanDerWaalsContact CD1-CD2 3.44Å; L166-F170 HydrophobicContact CD1-CE2 3.46Å; L166-F170 VanDerWaalsContact CD1-CE2 3.46Å; L166-F170 HydrophobicContact CG-CD2 4Å; L166-F170 HydrophobicContact CG-CE2 4.48Å; L166-F170 WeakPolarHBondContact O-CD2 3.37Å; L166-F170 PolarHBondContact O-N 3.27Å
167M88.9Confident80.8Confident102 Ų102113 Ų11350%0.50257%0.574SS.*Hα-helixtrans-63.6-36.1180-72.3-54.6-56.200112.9H163 D164 G171H163-M167 WeakPolarHBondContact O-CG 3.38Å; H163-M167 PolarHBondContact O-N 3.42Å; D164-M167 PolarHBondContact O-N 2.92Å; M167-G171 WeakPolarHBondContact O-CA 3.39Å; M167-G171 PolarHBondContact O-N 3.17Å
168R89.8Confident78.6Confident145 Ų145115.8 Ų115.855%0.54759%0.585SS.*Hα-helixtrans-66.7-42.4171.6-95.8175.2-82.7-169.1-9.7112.7D164 L166D164-R168 WeakPolarHBondContact O-CB 3.14Å; D164-R168 PolarHBondContact O-N 3.1Å; D164-R168 PolarHBondContact O-NE 2.82Å; L166-R168 VanDerWaalsContact C-N 3.34Å; L166-R168 PolarHBondContact O-N 3.05Å
169R84.6Confident76.1Confident188 Ų188118.5 Ų118.571%0.70962%0.621SS**Hα-helixtrans-70.2-34.6-179.9-74.5-165.8-158.3-113.99.8113.7Q165 L166Q165-R169 WeakPolarHBondContact O-CG 3.39Å; Q165-R169 PolarHBondContact O-N 2.99Å; Q165-R169 VanDerWaalsContact O-N 3.12Å; L166-R169 PolarHBondContact O-N 3.25Å; L166-R169 VanDerWaalsContact O-N 3.16Å
170F76.6Confident75Confident135 Ų135121.4 Ų121.459%0.59263%0.634SS**Hα-helixtrans-112.3-19.3-171.8-66.8-77.9000114.5L166L166-F170 HydrophobicContact CD1-CD2 3.44Å; L166-F170 VanDerWaalsContact CD1-CD2 3.44Å; L166-F170 HydrophobicContact CD1-CE2 3.46Å; L166-F170 VanDerWaalsContact CD1-CE2 3.46Å; L166-F170 HydrophobicContact CG-CD2 4Å; L166-F170 HydrophobicContact CG-CE2 4.48Å; L166-F170 WeakPolarHBondContact O-CD2 3.37Å; L166-F170 PolarHBondContact O-N 3.27Å
171G63.4Low73.9Confident56 Ų56120.7 Ų120.758%0.57764%0.636SS**Hα-helixtrans-79.7-16.8175.100000113.9M167M167-G171 WeakPolarHBondContact O-CA 3.39Å; M167-G171 PolarHBondContact O-N 3.17Å
172E57.2Low72.6Confident165 Ų165120.8 Ų120.877%0.77164%0.643SS**SBendtrans-100.91.2178.7-144.9166.5-148.200113P174E172-P174 WeakPolarHBondContact O-CD 3.19Å
173Q55.5Low71.2Confident138 Ų138123.8 Ų123.865%0.64566%0.655SS**SBendtrans-71.9114.3164.5-83.5-153.7-1.100108.2A175Q173-A175 PolarHBondContact O-N 3.46Å
174P53.6Low69.8Low112 Ų112124.8 Ų124.873%0.72767%0.665SS**  trans-56.2133.7167.224.7-31.2000107E172 S176E172-P174 WeakPolarHBondContact O-CD 3.19Å; P174-S176 PolarHBondContact O-N 3.16Å
175A54.3Low68.1Low84 Ų84128.1 Ų128.169%0.69468%0.682SS**  trans-49.5104.8172.100000107.7Q173 Y177Q173-A175 PolarHBondContact O-N 3.46Å; A175-Y177 HydrophobicContact CB-CD2 4.28Å; A175-Y177 PolarHBondContact O-N 3.1Å
176S55.5Low66.4Low106 Ų106132.6 Ų132.674%0.74171%0.71SS**  trans-71.579.2179.5177.10000107.6P174 V178P174-S176 PolarHBondContact O-N 3.16Å; S176-V178 PolarHBondContact O-N 3.28Å
177Y58.6Low64.4Low220 Ų220135.7 Ų135.786%0.86373%0.727SS**  trans-7962.9172.8-112.8-83.2000109.3A175A175-Y177 HydrophobicContact CB-CD2 4.28Å; A175-Y177 PolarHBondContact O-N 3.1Å
178V52.1Low62.3Low118 Ų118138.5 Ų138.572%0.71575%0.746SS**  trans-149.8109.8159.5-170.80000108.5S176S176-V178 PolarHBondContact O-N 3.28Å
179S46.7Very low59.8Low195 Ų195137.9 Ų137.9100%1.36476%0.764SS**  trans-124.60142.5-67.30000106.5

Retrieved 179 of 179 residues in 220.2 ms (Link to these results)