A0A3Q0KHD9_SCHMA Loading...

Vps16_C domain-containing protein

AlphaFold DB , UniProt , Accession A0A3Q0KHD9, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 438 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
1M39.1Very low36.1Very low239 Ų239156.8 Ų156.8100%1.17784%0.842SS**  01220-85171.9161.400104.7D3M1-D3 PolarHBondContact O-N 2.84Å
2S36Very low35.5Very low118 Ų118160.3 Ų160.383%0.82584%0.844SS**  trans-56.6123.6-161.543.30000112.7D4S2-D4 PolarHBondContact O-N 3.04Å
3D37.3Very low34.8Very low149 Ų149153.7 Ų153.780%0.79784%0.838SS**  trans-71109.8165.3-68.3-45.8000108.2M1M1-D3 PolarHBondContact O-N 2.84Å
4D35.9Very low34.3Very low131 Ų131156.1 Ų156.170%0.70184%0.837SS**  trans-158.6151.3154.8-91.5-35.7000105.9S2S2-D4 PolarHBondContact O-N 3.04Å
5I38.4Very low33.7Very low147 Ų147157.1 Ų157.175%0.75483%0.834SS**  trans91.949.1-174.8-38.3156.3000114.8
6W40.7Very low33.4Very low213 Ų213158.4 Ų158.481%0.80783%0.831SS**  trans-136.556.7153.5-65.4103.6000110.4
7E36.4Very low33.2Very low191 Ų191157.2 Ų157.289%0.89383%0.825SS**  trans-102.2126.1163.8-75.7-154.1164.600111.2S9E7-S9 PolarHBondContact O-N 3.27Å
8E32.3Very low33.2Very low194 Ų194157.4 Ų157.491%0.90783%0.827SS**  trans-15.2101.3167.5-62.6177.3156.300116.1A10E8-A10 PolarHBondContact O-N 3.3Å
9S36.6Very low33.3Very low115 Ų115159.2 Ų159.280%0.80483%0.83SS**  trans-80.6102.8156.176.20000109E7 V11E7-S9 PolarHBondContact O-N 3.27Å; S9-V11 PolarHBondContact O-N 3.12Å; S9-V11 VanDerWaalsContact O-N 3.14Å
10A29.7Very low33.1Very low99 Ų99161 Ų16182%0.81883%0.834SS**  trans-52.3107.8176.800000113.5E8E8-A10 PolarHBondContact O-N 3.3Å
11V34.7Very low33.2Very low129 Ų129158.1 Ų158.178%0.78283%0.834SS**  trans-137.6120.9153.2-172.90000108.6S9S9-V11 PolarHBondContact O-N 3.12Å; S9-V11 VanDerWaalsContact O-N 3.14Å
12K29.6Very low32.9Very low199 Ų199153.3 Ų153.387%0.86581%0.813SS**  trans-28.4124.8-173.4-74.9169172.2175.90116
13G26Very low32.5Very low74 Ų74153.9 Ų153.976%0.76381%0.807SS**  trans-63.6151176.600000114.7
14F27.5Very low32.1Very low187 Ų187153.2 Ų153.282%0.8281%0.808SS**  trans-106.5121.5150.9-85.2-85.6000108.5F16F14-F16 HydrophobicContact CB-CE2 4.24Å
15Q25Very low31.8Very low171 Ų171152.7 Ų152.780%0.79982%0.815SS**  trans-81111.4165.6-172.1166.2-21.700106.1
16F30.1Very low31.4Very low178 Ų178151.9 Ų151.978%0.78182%0.817SS**  trans-87.4106.2166.9-81.8-84000107.5F14 L18F14-F16 HydrophobicContact CB-CE2 4.24Å; F16-L18 VanDerWaalsContact C-N 3.27Å; F16-L18 PolarHBondContact O-N 3.12Å
17D29.8Very low30.9Very low138 Ų138152.3 Ų152.374%0.73882%0.82SS**  trans-62.193.5162-68.6-33.8000107.6E19D17-E19 PolarHBondContact O-N 3.24Å
18L32.8Very low30.6Very low162 Ų162147.2 Ų147.285%0.84881%0.805SS**  trans-79.6107.8158.7-82.8165.4000106.3F16 E20F16-L18 VanDerWaalsContact C-N 3.27Å; F16-L18 PolarHBondContact O-N 3.12Å; L18-E20 PolarHBondContact O-N 3.43Å
19E35.3Very low30.4Very low190 Ų190144.5 Ų144.589%0.88880%0.797SS**  trans-44.4134.9172.4-71.9-179.4155.400111.3D17D17-E19 PolarHBondContact O-N 3.24Å
20E29.4Very low30Very low196 Ų196146 Ų14692%0.91680%0.795SS**  trans-51.9128.2-175.2-63.2168.6147.100113L18L18-E20 PolarHBondContact O-N 3.43Å
21A35.1Very low30.1Very low100 Ų100149.2 Ų149.283%0.82680%0.797SS**  trans-139.584.315200000109.2
22D31.6Very low29.7Very low138 Ų138146.4 Ų146.474%0.73879%0.794SS**  trans33.5110.2148.7-82.2-29.7000120.5
23N29.2Very low29.7Very low131 Ų131145 Ų14570%0.70180%0.796SS**  77.8120.3122.9-65.1-34.1000120.8
24T28Very low29.8Very low134 Ų134146.1 Ų146.182%0.82279%0.792SS**  trans95.791.6143.165.80000118.1
25S30.6Very low29.9Very low121 Ų121147 Ų14785%0.84680%0.796SS**  -147.1101.1129.266.80000111.1Y27S25-Y27 PolarHBondContact O-N 3.4Å
26T28.6Very low30Very low130 Ų130142.2 Ų142.280%0.79879%0.793SS**  trans-57.8116.7159.7-44.90000109.2
27Y31.9Very low30Very low222 Ų222142.8 Ų142.887%0.87180%0.798SS**  trans-17185138.3-122.6-88.4000108.2S25S25-Y27 PolarHBondContact O-N 3.4Å
28S28.3Very low29.9Very low83 Ų83143 Ų14358%0.5880%0.804SS**  trans-82.3160.4157.255.70000109.1
29D28.1Very low29.7Very low137 Ų137142.5 Ų142.573%0.73380%0.802SS**  trans100140.9158.3-50.6-30.9000116.7
30I29.2Very low29.4Very low147 Ų147139.1 Ų139.175%0.75480%0.798SS**  trans99.479.6171.6-46.3157.9000112.7
31L31.4Very low29.3Very low167 Ų167137.3 Ų137.387%0.87480%0.795SS**  179.1118.794.2-84.2169.7000110.6
32G27.2Very low29.2Very low70 Ų70141.7 Ų141.772%0.72280%0.798SS**  trans-95.4161.7171.900000113.1
33D27.7Very low29.2Very low168 Ų168139.2 Ų139.290%0.89879%0.791SS**  trans67.2128.8149.9-74.7-10.6000122.8
34S28.2Very low29.8Very low98 Ų98140 Ų14069%0.68579%0.794SS**  trans101.4110.2141.9-143.50000114.7
35F30.6Very low30Very low206 Ų206139.6 Ų139.690%0.90479%0.791SS**  -173.4111.1118.1-94.5-71.8000108.6
36G26.6Very low30.7Very low71 Ų71137.4 Ų137.473%0.73277%0.773SS**  trans-91130.8160.400000108.9
37E30.1Very low31.3Very low189 Ų189137.1 Ų137.188%0.88377%0.766SS**  trans-160.7115.8149.9-114.7173.4-165.600110.4
38T29.1Very low32Very low142 Ų142135 Ų13587%0.87176%0.762SS**  trans-39.8118.6173.6-13.50000115.1
39L28.2Very low33Very low152 Ų152136.9 Ų136.980%0.79677%0.766SS**  trans-145104.3159.4-84168.5000112.5
40C28.3Very low34.4Very low119 Ų119135.8 Ų135.880%0.80476%0.76SS**  trans40.198.2145.9-60.70000120.7E42C40-E42 PolarHBondContact O-N 2.9Å
41D27.6Very low36.4Very low159 Ų159131.5 Ų131.585%0.8574%0.738SS**  trans-52.4117.8157.9-93.3-40.4000113.1
42E32.8Very low38.8Very low192 Ų192129.3 Ų129.390%0.89772%0.722SS**  trans-10485.5145.7-79-172.1167.300107.9C40 I44C40-E42 PolarHBondContact O-N 2.9Å; E42-I44 PolarHBondContact O-N 3Å
43S32.3Very low41.6Very low85 Ų85126 Ų12659%0.59469%0.687SS**  trans-60.6122.7176.659.10000110.9T45S43-T45 PolarHBondContact O-N 3.17Å
44I41Very low44.3Very low147 Ų147119.4 Ų119.475%0.75466%0.656SS**  trans-64.597.8165.7-60170.6000107.6E42 V46E42-I44 PolarHBondContact O-N 3Å; I44-V46 HydrophobicContact CG2-CG2 3.86Å; I44-V46 PolarHBondContact O-N 3.4Å
45T33.3Very low47Very low126 Ų126116.6 Ų116.677%0.77363%0.633SS**  trans-80.392.1172.5420000109.3S43 D47S43-T45 PolarHBondContact O-N 3.17Å; T45-D47 PolarHBondContact O-N 2.66Å
46V44.1Very low49.6Very low76 Ų76108.9 Ų108.946%0.46161%0.605SS.*  trans-78.3115.1165.9-1740000107.8I44 F48 L51I44-V46 HydrophobicContact CG2-CG2 3.86Å; I44-V46 PolarHBondContact O-N 3.4Å; V46-F48 VanDerWaalsContact O-CD2 3.29Å; V46-F48 WeakPolarHBondContact O-CD2 3.25Å; V46-F48 PolarHBondContact O-N 2.67Å; V46-L51 HydrophobicContact CG1-CD1 4.39Å
47D41.4Very low52.3Low123 Ų123112.1 Ų112.166%0.65860%0.6SS**  trans-65.9110.3175.9-157.7-15.7000109T45 N49T45-D47 PolarHBondContact O-N 2.66Å; D47-N49 PolarHBondContact O-N 3.12Å; D47-N49 PolarHBondContact OD1-ND2 2.85Å
48F47Very low54.8Low178 Ų178107.9 Ų107.978%0.78158%0.584SS**  trans-69.417.6-171.1-76.6-85.8000115V46 N50V46-F48 VanDerWaalsContact O-CD2 3.29Å; V46-F48 WeakPolarHBondContact O-CD2 3.25Å; V46-F48 PolarHBondContact O-N 2.67Å; F48-N50 PolarHBondContact O-N 2.8Å
49N47.8Very low57.2Low122 Ų122106.2 Ų106.265%0.65257%0.569SS**SBendtrans-86.3100.8-175.2-75.8-47.8000111.4D47D47-N49 PolarHBondContact O-N 3.12Å; D47-N49 PolarHBondContact OD1-ND2 2.85Å
50N58.8Low59.2Low115 Ų115100 Ų10062%0.61554%0.538SS*.  trans52.463.5168-61.5-30.4000115.8F48 F52 L59F48-N50 PolarHBondContact O-N 2.8Å; N50-F52 HydrophobicContact CB-CE2 4.39Å; N50-F52 WeakPolarHBondContact O-CD2 3.31Å; N50-F52 PolarHBondContact O-N 2.98Å; N50-L59 HydrophobicContact CB-CD1 4.19Å
51L71Confident61.1Low56 Ų5696.7 Ų96.729%0.29352%0.523SS..PPolyproline II helixtrans-69.4131.6168.4-92.588.4000111.1V46 V60 Y66 A71V46-L51 HydrophobicContact CG1-CD1 4.39Å; L51-V60 HydrophobicContact CB-CB 4.33Å; L51-V60 HydrophobicContact CB-CG2 4.38Å; L51-V60 WeakPolarHBondContact O-CB 3.33Å; L51-V60 WeakPolarHBondContact O-CG2 3.49Å; L51-V60 PolarHBondContact O-N 2.8Å; L51-Y66 HydrophobicContact CD2-CE1 4.15Å; L51-A71 HydrophobicContact CD2-CB 3.47Å; L51-A71 VanDerWaalsContact CD2-CB 3.47Å
52F81.9Confident62.8Low122 Ų12297.1 Ų97.154%0.53553%0.525SS..BIsolated β-bridgetrans-102.3143172.8-67.2-80.7000110.1N50 A54 H57 N58 L59N50-F52 HydrophobicContact CB-CE2 4.39Å; N50-F52 WeakPolarHBondContact O-CD2 3.31Å; N50-F52 PolarHBondContact O-N 2.98Å; F52-A54 PolarHBondContact O-N 3.32Å; F52-H57 VanDerWaalsContact CD1-O 3.29Å; F52-H57 WeakPolarHBondContact CD1-O 3.38Å; F52-N58 CarbonylContact C-O 3.6Å; F52-N58 WeakPolarHBondContact CA-O 3.43Å; F52-L59 HydrophobicContact CE1-CD1 4.31Å
53C84.7Confident64.1Low0 Ų095 Ų950%052%0.515CS..PPolyproline II helixtrans-63130.2175.3174.20000109.2I55 C56 H57 N58 V60 A71 C73C53-I55 PolarHBondContact O-N 3.47Å; C53-I55 VanDerWaalsContact O-N 3.09Å; C53-C56 VanDerWaalsContact SG-SG 3.65Å; C53-H57 WeakPolarHBondContact O-CA 3.42Å; C53-H57 PolarHBondContact O-N 3.4Å; C53-N58 PolarHBondContact N-O 3.18Å; C53-V60 HydrophobicContact CB-CG2 4.13Å; C53-V60 VanDerWaalsContact N-CG2 3.33Å; C53-A71 WeakPolarHBondContact CA-O 3.46Å; C53-C73 HydrophobicContact CB-CB 3.85Å
54A84.6Confident65.8Low30 Ų3092.7 Ų92.725%0.24850%0.498CS..THydrogen-bonded Turntrans-72.2-6-174.300000115.2F52 A71 F72 W97F52-A54 PolarHBondContact O-N 3.32Å; A54-A71 PolarHBondContact N-O 3.03Å; A54-F72 HydrophobicContact CB-CE1 4.21Å; A54-W97 HydrophobicContact CB-CH2 3.31Å; A54-W97 HydrophobicContact CB-CZ2 3.65Å; A54-W97 HydrophobicContact CB-CZ3 4.44Å
55I85.1Confident67.5Low38 Ų3889.3 Ų89.320%0.19548%0.476CS..THydrogen-bonded Turntrans-107.5-51.1178-65.9-64000112.2C53 F72 C77 K80 A81 I84 W97C53-I55 PolarHBondContact O-N 3.47Å; C53-I55 VanDerWaalsContact O-N 3.09Å; I55-F72 HydrophobicContact CG1-CD1 3.94Å; I55-F72 HydrophobicContact CG1-CE1 3.86Å; I55-C77 HydrophobicContact CB-CB 4.15Å; I55-C77 HydrophobicContact CG2-CB 4.46Å; I55-K80 HydrophobicContact CG2-CD 4.02Å; I55-A81 HydrophobicContact CD1-CB 3.82Å; I55-A81 HydrophobicContact CG1-CB 3.97Å; I55-I84 HydrophobicContact CD1-CD1 4.46Å; I55-W97 HydrophobicContact CD1-CZ2 4.15Å
56C86.2Confident69.6Low45 Ų4589.2 Ų89.230%0.30446%0.462SS..THydrogen-bonded Turntrans-103-3.1-175.671.90000114C53 N58 C73C53-C56 VanDerWaalsContact SG-SG 3.65Å; C56-N58 PolarHBondContact O-N 3.49Å; C56-N58 PolarHBondContact SG-ND2 3Å; C56-C73 PolarHBondContact SG-SG 3.35Å
57H83.3Confident71.6Confident138 Ų13886.3 Ų86.364%0.63944%0.443SS*.  trans56.519.2-178.5-54-68.4000115.2F52 C53F52-H57 VanDerWaalsContact CD1-O 3.29Å; F52-H57 WeakPolarHBondContact CD1-O 3.38Å; C53-H57 WeakPolarHBondContact O-CA 3.42Å; C53-H57 PolarHBondContact O-N 3.4Å
58N82.3Confident73.6Confident100 Ų10086 Ų8654%0.53544%0.437SS..PPolyproline II helixtrans-78.3151172.7-71.1-29.7000110F52 C53 C56 V60F52-N58 CarbonylContact C-O 3.6Å; F52-N58 WeakPolarHBondContact CA-O 3.43Å; C53-N58 PolarHBondContact N-O 3.18Å; C56-N58 PolarHBondContact O-N 3.49Å; C56-N58 PolarHBondContact SG-ND2 3Å; N58-V60 PolarHBondContact O-N 3.27Å
59L78.7Confident75.2Confident107 Ų10785.2 Ų85.256%0.5644%0.44SS*.BIsolated β-bridgetrans-58.9126.9172-167.276.6000109.2N50 F52 G61N50-L59 HydrophobicContact CB-CD1 4.19Å; F52-L59 HydrophobicContact CE1-CD1 4.31Å; L59-G61 PolarHBondContact O-N 3.46Å
60V71.2Confident77Confident23 Ų2379.9 Ų79.914%0.13941%0.413CS..PPolyproline II helixtrans-74.8117.4-179175.40000108.6L51 C53 N58 V64 A71 C73L51-V60 HydrophobicContact CB-CB 4.33Å; L51-V60 HydrophobicContact CB-CG2 4.38Å; L51-V60 WeakPolarHBondContact O-CB 3.33Å; L51-V60 WeakPolarHBondContact O-CG2 3.49Å; L51-V60 PolarHBondContact O-N 2.8Å; C53-V60 HydrophobicContact CB-CG2 4.13Å; C53-V60 VanDerWaalsContact N-CG2 3.33Å; N58-V60 PolarHBondContact O-N 3.27Å; V60-V64 HydrophobicContact CG1-CB 3.98Å; V60-V64 HydrophobicContact CG1-CG1 3.54Å; V60-V64 HydrophobicContact CG1-CG2 3.31Å; V60-A71 HydrophobicContact CG2-CB 4.28Å; V60-C73 HydrophobicContact CG2-CB 4.33Å
61G68.4Low78.3Confident48 Ų4874.6 Ų74.650%0.49539%0.385SS..  trans-87-150175.800000112.6L59 E63 V64L59-G61 PolarHBondContact O-N 3.46Å; G61-E63 PolarHBondContact O-N 3.02Å; G61-V64 WeakPolarHBondContact O-CG2 3.34Å
62N62.5Low79.1Confident168 Ų16871.9 Ų71.990%0.89837%0.371SS*.SBendtrans-73.1-22.1-171.7-67.4-13.2000115.2
63E59.6Low79.3Confident148 Ų14867.7 Ų67.769%0.69236%0.356SS*.  trans-99.3109177.3-72.3-176.817800109.7G61 C73G61-E63 PolarHBondContact O-N 3.02Å; E63-C73 CarbonylContact O-C 3.59Å
64V69.3Low79.5Confident37 Ų3769.4 Ų69.422%0.22437%0.368CS..  trans-131125.4-171.7-163.40000110.8V60 G61 Y66 A71 F72V60-V64 HydrophobicContact CG1-CB 3.98Å; V60-V64 HydrophobicContact CG1-CG1 3.54Å; V60-V64 HydrophobicContact CG1-CG2 3.31Å; G61-V64 WeakPolarHBondContact O-CG2 3.34Å; V64-Y66 HydrophobicContact CB-CD2 4.03Å; V64-Y66 HydrophobicContact CB-CE1 4.42Å; V64-Y66 HydrophobicContact CB-CE2 3.42Å; V64-Y66 VanDerWaalsContact CB-CE2 3.42Å; V64-Y66 HydrophobicContact CG1-CD1 3.91Å; V64-Y66 HydrophobicContact CG1-CD2 3.79Å; V64-Y66 HydrophobicContact CG1-CE1 3.51Å; V64-Y66 HydrophobicContact CG1-CE2 3.38Å; V64-Y66 HydrophobicContact CG1-CG 4.04Å; V64-Y66 HydrophobicContact CG2-CE2 4.2Å; V64-A71 HydrophobicContact CG1-CB 3.94Å; V64-F72 WeakPolarHBondContact CA-O 3.4Å
65Y76.1Confident79.7Confident76 Ų7672.9 Ų72.930%0.29838%0.379SS..EExtended strand (participates in β ladder)trans-95116.5164.3-63.7-100.9000107.2A71 F72 E75 W78Y65-A71 WeakPolarHBondContact O-CA 3.43Å; Y65-F72 PolarHBondContact N-O 3.28Å; Y65-F72 VanDerWaalsContact N-O 3.13Å; Y65-F72 WeakPolarHBondContact O-CD2 3.46Å; Y65-F72 PolarHBondContact O-N 3.05Å; Y65-E75 HydrophobicContact CE2-CB 3.93Å; Y65-E75 VanDerWaalsContact CE2-N 3.34Å; Y65-E75 WeakPolarHBondContact OH-CB 3.3Å; Y65-W78 HydrophobicContact CD1-CB 4.48Å; Y65-W78 AromaticContact CD1-CD2 3.82Å; Y65-W78 HydrophobicContact CD1-CD2 3.82Å; Y65-W78 AromaticContact CD1-CE3 3.97Å; Y65-W78 HydrophobicContact CD1-CE3 3.97Å; Y65-W78 HydrophobicContact CD1-CG 4.08Å; Y65-W78 HydrophobicContact CD1-CZ3 4.44Å; Y65-W78 HydrophobicContact CD2-CB 4.42Å; Y65-W78 HydrophobicContact CE1-CD2 4.38Å; Y65-W78 HydrophobicContact CE1-CE3 4.06Å; Y65-W78 HydrophobicContact CE1-CZ3 4.31Å; Y65-W78 HydrophobicContact CG-CB 4.08Å; Y65-W78 HydrophobicContact CG-CD2 4.26Å; Y65-W78 HydrophobicContact CG-CG 4.03Å
66Y76.8Confident79.8Confident124 Ų12474.5 Ų74.549%0.48640%0.399SS..EExtended strand (participates in β ladder)trans-99.7131.2176.2-66.3-79.5000109.8L51 V64 A71L51-Y66 HydrophobicContact CD2-CE1 4.15Å; V64-Y66 HydrophobicContact CB-CD2 4.03Å; V64-Y66 HydrophobicContact CB-CE1 4.42Å; V64-Y66 HydrophobicContact CB-CE2 3.42Å; V64-Y66 VanDerWaalsContact CB-CE2 3.42Å; V64-Y66 HydrophobicContact CG1-CD1 3.91Å; V64-Y66 HydrophobicContact CG1-CD2 3.79Å; V64-Y66 HydrophobicContact CG1-CE1 3.51Å; V64-Y66 HydrophobicContact CG1-CE2 3.38Å; V64-Y66 HydrophobicContact CG1-CG 4.04Å; V64-Y66 HydrophobicContact CG2-CE2 4.2Å; Y66-A71 HydrophobicContact CD1-CB 4.08Å; Y66-A71 HydrophobicContact CE1-CB 4.06Å
67E87.3Confident79.9Confident14 Ų1473 Ų737%0.06539%0.389CS..EExtended strand (participates in β ladder)trans-129.4176.6169.1-65.7-63.6175.200107.6D69 A70 F72 W78 T101 F102 V103 S104 S107E67-D69 PolarHBondContact O-N 2.99Å; E67-A70 PolarHBondContact N-O 2.96Å; E67-A70 PolarHBondContact O-N 3.46Å; E67-A70 VanDerWaalsContact O-N 3.08Å; E67-A70 VanDerWaalsContact O-O 3.06Å; E67-F72 HydrophobicContact CB-CE2 4.14Å; E67-F72 HydrophobicContact CG-CE2 3.95Å; E67-W78 PolarHBondContact OE1-NE1 3.06Å; E67-T101 HydrophobicContact CB-CG2 4.25Å; E67-T101 WeakPolarHBondContact CB-O 3.23Å; E67-F102 HydrophobicContact CG-CD1 3.95Å; E67-F102 WeakPolarHBondContact OE2-CA 3.48Å; E67-V103 PolarHBondContact OE2-N 3.45Å; E67-S104 WeakPolarHBondContact OE1-CB 3.48Å; E67-S104 PolarHBondContact OE1-OG 3.37Å; E67-S104 PolarHBondContact OE2-N 3.37Å; E67-S104 VanDerWaalsContact OE2-N 3.1Å; E67-S107 VanDerWaalsContact OE1-CB 3.28Å; E67-S107 WeakPolarHBondContact OE1-CB 3.35Å
68K83.8Confident80.3Confident118 Ų11866.9 Ų66.951%0.51336%0.36SS..THydrogen-bonded Turntrans-58.5118.1-176.4-173.2-178.9177.7179.70110.5A70 T101 V103K68-A70 PolarHBondContact O-N 2.87Å; K68-A70 VanDerWaalsContact O-N 3.16Å; K68-T101 WeakPolarHBondContact CB-O 3.36Å; K68-T101 PolarHBondContact N-O 3.32Å; K68-V103 HydrophobicContact CB-CG1 3.98Å; K68-V103 HydrophobicContact CB-CG2 4.42Å
69D80.6Confident80.7Confident161 Ų16164.8 Ų64.886%0.86135%0.348SS*.THydrogen-bonded Turntrans58.321-179.7-50.4-47.1000114.7E67E67-D69 PolarHBondContact O-N 2.99Å
70A85.3Confident81.3Confident10 Ų1065.6 Ų65.68%0.08335%0.347CS..EExtended strand (participates in β ladder)trans-144.3144-176.400000113.4E67 K68 F72 W97 T101E67-A70 PolarHBondContact N-O 2.96Å; E67-A70 PolarHBondContact O-N 3.46Å; E67-A70 VanDerWaalsContact O-N 3.08Å; E67-A70 VanDerWaalsContact O-O 3.06Å; K68-A70 PolarHBondContact O-N 2.87Å; K68-A70 VanDerWaalsContact O-N 3.16Å; A70-F72 HydrophobicContact CB-CE2 4.1Å; A70-F72 HydrophobicContact CB-CZ 4Å; A70-W97 HydrophobicContact CB-CH2 4.1Å; A70-W97 HydrophobicContact CB-CZ3 3.72Å; A70-T101 HydrophobicContact CB-CG2 4.39Å
71A85.8Confident82.2Confident3 Ų364.5 Ų64.53%0.02534%0.341CS..EExtended strand (participates in β ladder)trans-127.7143.1172.100000111.1L51 C53 A54 V60 V64 Y65 Y66L51-A71 HydrophobicContact CD2-CB 3.47Å; L51-A71 VanDerWaalsContact CD2-CB 3.47Å; C53-A71 WeakPolarHBondContact CA-O 3.46Å; A54-A71 PolarHBondContact N-O 3.03Å; V60-A71 HydrophobicContact CG2-CB 4.28Å; V64-A71 HydrophobicContact CG1-CB 3.94Å; Y65-A71 WeakPolarHBondContact O-CA 3.43Å; Y66-A71 HydrophobicContact CD1-CB 4.08Å; Y66-A71 HydrophobicContact CE1-CB 4.06Å
72F88Confident83.3Confident0 Ų062.2 Ų62.20%032%0.317CS..EExtended strand (participates in β ladder)trans-124.4132.7178-49-86.3000110.4A54 I55 V64 Y65 E67 A70 S74 C77 W78 A81 W97 F102A54-F72 HydrophobicContact CB-CE1 4.21Å; I55-F72 HydrophobicContact CG1-CD1 3.94Å; I55-F72 HydrophobicContact CG1-CE1 3.86Å; V64-F72 WeakPolarHBondContact CA-O 3.4Å; Y65-F72 PolarHBondContact N-O 3.28Å; Y65-F72 VanDerWaalsContact N-O 3.13Å; Y65-F72 WeakPolarHBondContact O-CD2 3.46Å; Y65-F72 PolarHBondContact O-N 3.05Å; E67-F72 HydrophobicContact CB-CE2 4.14Å; E67-F72 HydrophobicContact CG-CE2 3.95Å; A70-F72 HydrophobicContact CB-CE2 4.1Å; A70-F72 HydrophobicContact CB-CZ 4Å; F72-S74 VanDerWaalsContact C-N 3.26Å; F72-S74 PolarHBondContact O-N 2.97Å; F72-C77 HydrophobicContact CB-CB 4.19Å; F72-C77 HydrophobicContact CD1-CB 4.43Å; F72-W78 HydrophobicContact CB-CB 3.96Å; F72-W78 HydrophobicContact CD2-CB 4.1Å; F72-W78 AromaticContact CD2-CD1 3.6Å; F72-W78 HydrophobicContact CD2-CG 4.24Å; F72-W78 AromaticContact CE2-CD1 3.79Å; F72-W78 HydrophobicContact CG-CB 3.98Å; F72-A81 HydrophobicContact CD1-CB 4.32Å; F72-A81 HydrophobicContact CE1-CB 3.48Å; F72-A81 VanDerWaalsContact CE1-CB 3.48Å; F72-A81 HydrophobicContact CZ-CB 3.81Å; F72-W97 HydrophobicContact CE1-CH2 4.38Å; F72-W97 HydrophobicContact CZ-CH2 4.37Å; F72-W97 HydrophobicContact CZ-CZ3 4.19Å; F72-F102 HydrophobicContact CZ-CE1 4.46Å
73C86.7Confident84.6Confident33 Ų3357.1 Ų57.122%0.22329%0.292CS..SBendtrans-80.5-2.8-176.268.70000114.4C53 C56 V60 E63C53-C73 HydrophobicContact CB-CB 3.85Å; C56-C73 PolarHBondContact SG-SG 3.35Å; V60-C73 HydrophobicContact CG2-CB 4.33Å; E63-C73 CarbonylContact O-C 3.59Å
74S87.8Confident85.9Confident36 Ų3652.5 Ų52.525%0.25227%0.272SS..SBendtrans-163.2158.4179.764.50000110.3F72 A76 C77 W78F72-S74 VanDerWaalsContact C-N 3.26Å; F72-S74 PolarHBondContact O-N 2.97Å; S74-A76 PolarHBondContact O-N 3.41Å; S74-C77 PolarHBondContact O-N 3.41Å; S74-C77 PolarHBondContact OG-N 2.89Å; S74-C77 PolarHBondContact OG-SG 2.95Å; S74-W78 PolarHBondContact O-N 3.23Å; S74-W78 VanDerWaalsContact O-N 3.11Å
75E88.1Confident86.8Confident103 Ų10350.8 Ų50.848%0.48126%0.262SS..Hα-helixtrans-57.6-39.5172.3-167.3-179.6178.400111.4Y65 C77 W78 L79Y65-E75 HydrophobicContact CE2-CB 3.93Å; Y65-E75 VanDerWaalsContact CE2-N 3.34Å; Y65-E75 WeakPolarHBondContact OH-CB 3.3Å; E75-C77 VanDerWaalsContact C-N 3.33Å; E75-C77 PolarHBondContact O-N 3.32Å; E75-W78 HydrophobicContact CG-CE3 4.22Å; E75-W78 PolarHBondContact O-N 3Å; E75-W78 VanDerWaalsContact O-N 3.15Å; E75-L79 HydrophobicContact CG-CD1 3.93Å; E75-L79 HydrophobicContact CG-CG 4.13Å; E75-L79 WeakPolarHBondContact O-CB 3.43Å; E75-L79 WeakPolarHBondContact O-CG 3.39Å; E75-L79 PolarHBondContact O-N 2.73Å
76A88.4Confident87.4Confident72 Ų7247.9 Ų47.960%0.59525%0.251SS*.Hα-helixtrans-60.2-41.3178.500000112.4S74 K80S74-A76 PolarHBondContact O-N 3.41Å; A76-K80 VanDerWaalsContact O-CB 3.26Å; A76-K80 WeakPolarHBondContact O-CB 3.32Å; A76-K80 PolarHBondContact O-N 3.42Å
77C88.6Confident87.8Confident14 Ų1446.1 Ų46.110%0.09525%0.25CS..Hα-helixtrans-66.9-42.5174.6-74.60000111.6I55 F72 S74 E75 K80 A81I55-C77 HydrophobicContact CB-CB 4.15Å; I55-C77 HydrophobicContact CG2-CB 4.46Å; F72-C77 HydrophobicContact CB-CB 4.19Å; F72-C77 HydrophobicContact CD1-CB 4.43Å; S74-C77 PolarHBondContact O-N 3.41Å; S74-C77 PolarHBondContact OG-N 2.89Å; S74-C77 PolarHBondContact OG-SG 2.95Å; E75-C77 VanDerWaalsContact C-N 3.33Å; E75-C77 PolarHBondContact O-N 3.32Å; C77-K80 PolarHBondContact O-N 3.05Å; C77-A81 PolarHBondContact O-N 2.96Å
78W91.2Very high87.6Confident9 Ų947.6 Ų47.63%0.03426%0.258CS..Hα-helixtrans-63.6-47.6178.5176.469.5000112.1Y65 E67 F72 S74 E75 K80 A81 I82 V110Y65-W78 HydrophobicContact CD1-CB 4.48Å; Y65-W78 AromaticContact CD1-CD2 3.82Å; Y65-W78 HydrophobicContact CD1-CD2 3.82Å; Y65-W78 AromaticContact CD1-CE3 3.97Å; Y65-W78 HydrophobicContact CD1-CE3 3.97Å; Y65-W78 HydrophobicContact CD1-CG 4.08Å; Y65-W78 HydrophobicContact CD1-CZ3 4.44Å; Y65-W78 HydrophobicContact CD2-CB 4.42Å; Y65-W78 HydrophobicContact CE1-CD2 4.38Å; Y65-W78 HydrophobicContact CE1-CE3 4.06Å; Y65-W78 HydrophobicContact CE1-CZ3 4.31Å; Y65-W78 HydrophobicContact CG-CB 4.08Å; Y65-W78 HydrophobicContact CG-CD2 4.26Å; Y65-W78 HydrophobicContact CG-CG 4.03Å; E67-W78 PolarHBondContact OE1-NE1 3.06Å; F72-W78 HydrophobicContact CB-CB 3.96Å; F72-W78 HydrophobicContact CD2-CB 4.1Å; F72-W78 AromaticContact CD2-CD1 3.6Å; F72-W78 HydrophobicContact CD2-CG 4.24Å; F72-W78 AromaticContact CE2-CD1 3.79Å; F72-W78 HydrophobicContact CG-CB 3.98Å; S74-W78 PolarHBondContact O-N 3.23Å; S74-W78 VanDerWaalsContact O-N 3.11Å; E75-W78 HydrophobicContact CG-CE3 4.22Å; E75-W78 PolarHBondContact O-N 3Å; E75-W78 VanDerWaalsContact O-N 3.15Å; W78-K80 VanDerWaalsContact C-N 3.32Å; W78-K80 PolarHBondContact O-N 3.22Å; W78-A81 WeakPolarHBondContact O-CB 3.29Å; W78-A81 PolarHBondContact O-N 2.75Å; W78-I82 HydrophobicContact CD2-CD1 3.91Å; W78-I82 HydrophobicContact CE3-CD1 4.3Å; W78-I82 HydrophobicContact CG-CD1 4.45Å; W78-I82 HydrophobicContact CH2-CD1 4.22Å; W78-I82 HydrophobicContact CZ2-CD1 3.83Å; W78-I82 HydrophobicContact CZ3-CD1 4.44Å; W78-I82 WeakPolarHBondContact O-CG1 3.27Å; W78-I82 PolarHBondContact O-N 2.89Å; W78-V110 HydrophobicContact CH2-CB 4.33Å; W78-V110 HydrophobicContact CH2-CG2 3.75Å; W78-V110 HydrophobicContact CZ3-CG2 4.01Å
79L91.2Very high87.6Confident56 Ų5644.8 Ų44.829%0.29325%0.246SC..Hα-helixtrans-61.8-38.3175.2-71.3176.7000112.3E75 A81 I82 T83 V110E75-L79 HydrophobicContact CG-CD1 3.93Å; E75-L79 HydrophobicContact CG-CG 4.13Å; E75-L79 WeakPolarHBondContact O-CB 3.43Å; E75-L79 WeakPolarHBondContact O-CG 3.39Å; E75-L79 PolarHBondContact O-N 2.73Å; L79-A81 VanDerWaalsContact C-N 3.35Å; L79-I82 PolarHBondContact O-N 3.28Å; L79-T83 WeakPolarHBondContact O-CB 3.43Å; L79-T83 PolarHBondContact O-N 2.91Å; L79-T83 PolarHBondContact O-OG1 2.86Å; L79-V110 HydrophobicContact CD2-CG1 3.57Å
80K89.7Confident87.6Confident124 Ų12440.8 Ų40.854%0.53923%0.228SC..Hα-helixtrans-62.8-42.1175.2-172.6172.1-177.6179.90111.5I55 A76 C77 W78 T83 I84I55-K80 HydrophobicContact CG2-CD 4.02Å; A76-K80 VanDerWaalsContact O-CB 3.26Å; A76-K80 WeakPolarHBondContact O-CB 3.32Å; A76-K80 PolarHBondContact O-N 3.42Å; C77-K80 PolarHBondContact O-N 3.05Å; W78-K80 VanDerWaalsContact C-N 3.32Å; W78-K80 PolarHBondContact O-N 3.22Å; K80-T83 PolarHBondContact O-N 2.68Å; K80-I84 HydrophobicContact CG-CD1 4.15Å; K80-I84 VanDerWaalsContact O-CG1 3.29Å; K80-I84 WeakPolarHBondContact O-CG1 3.37Å; K80-I84 PolarHBondContact O-N 3.47Å
81A90.7Very high87.1Confident0 Ų046.2 Ų46.20%026%0.259CS..Hα-helixtrans-61.9-44.8175.400000111.8I55 F72 C77 W78 L79 T83 I84 A85 W97 F102I55-A81 HydrophobicContact CD1-CB 3.82Å; I55-A81 HydrophobicContact CG1-CB 3.97Å; F72-A81 HydrophobicContact CD1-CB 4.32Å; F72-A81 HydrophobicContact CE1-CB 3.48Å; F72-A81 VanDerWaalsContact CE1-CB 3.48Å; F72-A81 HydrophobicContact CZ-CB 3.81Å; C77-A81 PolarHBondContact O-N 2.96Å; W78-A81 WeakPolarHBondContact O-CB 3.29Å; W78-A81 PolarHBondContact O-N 2.75Å; L79-A81 VanDerWaalsContact C-N 3.35Å; A81-T83 VanDerWaalsContact C-N 3.31Å; A81-T83 PolarHBondContact O-N 2.66Å; A81-I84 PolarHBondContact O-N 3.2Å; A81-A85 WeakPolarHBondContact O-CB 3.12Å; A81-A85 PolarHBondContact O-N 3.33Å; A81-W97 HydrophobicContact CB-CD2 4.35Å; A81-W97 HydrophobicContact CB-CG 4.45Å; A81-F102 HydrophobicContact CB-CE1 4.21Å; A81-F102 HydrophobicContact CB-CZ 3.94Å
82I91.4Very high86.4Confident1 Ų149.3 Ų49.31%0.00529%0.292CS..Hα-helixtrans-61-41.8176.1-68.1171.9000111.2W78 L79 A85 L86 F102 V110 I111 L114W78-I82 HydrophobicContact CD2-CD1 3.91Å; W78-I82 HydrophobicContact CE3-CD1 4.3Å; W78-I82 HydrophobicContact CG-CD1 4.45Å; W78-I82 HydrophobicContact CH2-CD1 4.22Å; W78-I82 HydrophobicContact CZ2-CD1 3.83Å; W78-I82 HydrophobicContact CZ3-CD1 4.44Å; W78-I82 WeakPolarHBondContact O-CG1 3.27Å; W78-I82 PolarHBondContact O-N 2.89Å; L79-I82 PolarHBondContact O-N 3.28Å; I82-A85 WeakPolarHBondContact O-CB 3.35Å; I82-A85 PolarHBondContact O-N 2.98Å; I82-L86 HydrophobicContact CG2-CD1 4.34Å; I82-L86 PolarHBondContact O-N 2.96Å; I82-F102 HydrophobicContact CB-CE1 4.42Å; I82-F102 HydrophobicContact CB-CZ 4.45Å; I82-F102 HydrophobicContact CD1-CD1 4.22Å; I82-F102 HydrophobicContact CD1-CE1 4.33Å; I82-F102 HydrophobicContact CG1-CD1 3.58Å; I82-F102 HydrophobicContact CG1-CE1 3.35Å; I82-F102 HydrophobicContact CG1-CE2 4.41Å; I82-F102 HydrophobicContact CG1-CG 4.21Å; I82-F102 HydrophobicContact CG1-CZ 3.82Å; I82-V110 HydrophobicContact CD1-CB 4.36Å; I82-V110 HydrophobicContact CD1-CG1 3.92Å; I82-V110 HydrophobicContact CG2-CG1 4.37Å; I82-I111 HydrophobicContact CG2-CG1 3.61Å; I82-L114 HydrophobicContact CG2-CD1 3.73Å
83T89.6Confident85.2Confident61 Ų6151.5 Ų51.537%0.37431%0.314SS..Hα-helixtrans-64.2-45.1179.7-54.10000111L79 K80 A81 A85 L86 D87L79-T83 WeakPolarHBondContact O-CB 3.43Å; L79-T83 PolarHBondContact O-N 2.91Å; L79-T83 PolarHBondContact O-OG1 2.86Å; K80-T83 PolarHBondContact O-N 2.68Å; A81-T83 VanDerWaalsContact C-N 3.31Å; A81-T83 PolarHBondContact O-N 2.66Å; T83-A85 VanDerWaalsContact C-N 3.31Å; T83-A85 PolarHBondContact O-N 2.83Å; T83-L86 PolarHBondContact O-N 3.01Å; T83-D87 PolarHBondContact O-N 3.01Å
84I87.9Confident84.2Confident50 Ų5057.1 Ų57.126%0.25635%0.347SS..Hα-helixtrans-60-43174.9-67.3164.2000110.8I55 K80 A81 L86 D87 D88I55-I84 HydrophobicContact CD1-CD1 4.46Å; K80-I84 HydrophobicContact CG-CD1 4.15Å; K80-I84 VanDerWaalsContact O-CG1 3.29Å; K80-I84 WeakPolarHBondContact O-CG1 3.37Å; K80-I84 PolarHBondContact O-N 3.47Å; A81-I84 PolarHBondContact O-N 3.2Å; I84-L86 VanDerWaalsContact C-N 3.33Å; I84-L86 PolarHBondContact O-N 2.97Å; I84-D87 PolarHBondContact O-N 3.34Å; I84-D88 WeakPolarHBondContact O-CB 3.26Å; I84-D88 PolarHBondContact O-N 3.38Å
85A88.9Confident83.3Confident2 Ų256.5 Ų56.52%0.01734%0.343CS..Hα-helixtrans-60.2-41.7177.900000112.8A81 I82 T83 F89 W97 L99 F102A81-A85 WeakPolarHBondContact O-CB 3.12Å; A81-A85 PolarHBondContact O-N 3.33Å; I82-A85 WeakPolarHBondContact O-CB 3.35Å; I82-A85 PolarHBondContact O-N 2.98Å; T83-A85 VanDerWaalsContact C-N 3.31Å; T83-A85 PolarHBondContact O-N 2.83Å; A85-F89 VanDerWaalsContact O-CB 3.28Å; A85-F89 WeakPolarHBondContact O-CB 3.39Å; A85-F89 PolarHBondContact O-N 2.96Å; A85-W97 HydrophobicContact CB-CB 3.86Å; A85-W97 WeakPolarHBondContact CB-O 3.25Å; A85-L99 HydrophobicContact CB-CD2 4.23Å; A85-F102 HydrophobicContact CB-CD2 4.4Å; A85-F102 HydrophobicContact CB-CE2 3.56Å; A85-F102 HydrophobicContact CB-CZ 4.3Å
86L87.9Confident82.7Confident15 Ų1556.6 Ų56.68%0.07935%0.351CS..Hα-helixtrans-66.4-44.7175.8-77.2174.2000111.7I82 T83 I84 D88 F89 V90 L99 I111 L114 T115 I127I82-L86 HydrophobicContact CG2-CD1 4.34Å; I82-L86 PolarHBondContact O-N 2.96Å; T83-L86 PolarHBondContact O-N 3.01Å; I84-L86 VanDerWaalsContact C-N 3.33Å; I84-L86 PolarHBondContact O-N 2.97Å; L86-D88 PolarHBondContact O-N 3.15Å; L86-F89 PolarHBondContact O-N 2.97Å; L86-V90 VanDerWaalsContact O-CG2 3.27Å; L86-V90 WeakPolarHBondContact O-CG2 3.39Å; L86-V90 PolarHBondContact O-N 3.32Å; L86-L99 HydrophobicContact CD2-CD2 4.45Å; L86-I111 HydrophobicContact CD2-CG2 4.17Å; L86-L114 HydrophobicContact CD1-CB 3.68Å; L86-L114 HydrophobicContact CD1-CD1 4.15Å; L86-T115 WeakPolarHBondContact CD2-OG1 3.38Å; L86-I127 HydrophobicContact CD2-CD1 3.96Å; L86-I127 HydrophobicContact CD2-CG1 4.38Å
87D84.1Confident82.5Confident87 Ų8755 Ų5547%0.46533%0.33SS..Hα-helixtrans-60-45.5176.6-74.6-15.2000111.4T83 I84 F89 V90 V91T83-D87 PolarHBondContact O-N 3.01Å; I84-D87 PolarHBondContact O-N 3.34Å; D87-F89 VanDerWaalsContact C-N 3.35Å; D87-F89 PolarHBondContact O-N 2.82Å; D87-V90 PolarHBondContact O-N 3.24Å; D87-V91 WeakPolarHBondContact O-CG2 3.41Å; D87-V91 PolarHBondContact O-N 3.27Å
88D83.5Confident82.3Confident44 Ų4457.2 Ų57.224%0.23534%0.343CS..Hα-helixtrans-62.9-41.3177.1-73.5-17.8000111.8I84 L86 V90 V91 G92 G93 S95 T96I84-D88 WeakPolarHBondContact O-CB 3.26Å; I84-D88 PolarHBondContact O-N 3.38Å; L86-D88 PolarHBondContact O-N 3.15Å; D88-V90 VanDerWaalsContact C-N 3.35Å; D88-V91 PolarHBondContact O-N 2.7Å; D88-G92 PolarHBondContact O-N 3.48Å; D88-G93 PolarHBondContact O-N 2.91Å; D88-S95 VanDerWaalsContact CB-CB 3.5Å; D88-S95 WeakPolarHBondContact CB-OG 3.24Å; D88-S95 VanDerWaalsContact OD2-CA 3.23Å; D88-S95 WeakPolarHBondContact OD2-CA 3.46Å; D88-S95 VanDerWaalsContact OD2-CB 3.27Å; D88-S95 WeakPolarHBondContact OD2-CB 3.13Å; D88-S95 PolarHBondContact OD2-OG 2.99Å; D88-T96 PolarHBondContact OD2-N 3.35Å
89F84.1Confident82.1Confident60 Ų6058.1 Ų58.126%0.26335%0.349SS..Hα-helixtrans-63.8-39.5178.4-176.7-95.7000112A85 L86 D87 V91 G92 L99 L123 K126 I127 E130A85-F89 VanDerWaalsContact O-CB 3.28Å; A85-F89 WeakPolarHBondContact O-CB 3.39Å; A85-F89 PolarHBondContact O-N 2.96Å; L86-F89 PolarHBondContact O-N 2.97Å; D87-F89 VanDerWaalsContact C-N 3.35Å; D87-F89 PolarHBondContact O-N 2.82Å; F89-V91 VanDerWaalsContact C-N 3.33Å; F89-G92 PolarHBondContact O-N 3.34Å; F89-L99 HydrophobicContact CB-CD1 4.37Å; F89-L99 HydrophobicContact CD1-CD1 4.37Å; F89-L99 HydrophobicContact CD2-CD1 3.49Å; F89-L99 VanDerWaalsContact CD2-CD1 3.49Å; F89-L99 HydrophobicContact CD2-CG 4.25Å; F89-L99 HydrophobicContact CE2-CD1 3.75Å; F89-L99 HydrophobicContact CG-CD1 3.83Å; F89-L99 HydrophobicContact CZ-CD1 4.29Å; F89-L123 HydrophobicContact CD1-CD1 3.78Å; F89-L123 HydrophobicContact CE1-CD1 4Å; F89-K126 HydrophobicContact CE1-CB 3.95Å; F89-K126 HydrophobicContact CE1-CD 4.34Å; F89-K126 HydrophobicContact CZ-CB 4.2Å; F89-I127 HydrophobicContact CD1-CD1 3.79Å; F89-I127 HydrophobicContact CE1-CD1 3.66Å; F89-I127 HydrophobicContact CE1-CG1 4.23Å; F89-I127 HydrophobicContact CG-CD1 4.41Å; F89-I127 HydrophobicContact CZ-CD1 4.19Å; F89-E130 HydrophobicContact CE2-CG 4.29Å; F89-E130 HydrophobicContact CZ-CG 4.06Å
90V80.3Confident81.8Confident77 Ų7759.2 Ų59.247%0.46736%0.361SS..Hα-helixtrans-62.1-42.1175.41710000111.1L86 D87 D88 G92 L123L86-V90 VanDerWaalsContact O-CG2 3.27Å; L86-V90 WeakPolarHBondContact O-CG2 3.39Å; L86-V90 PolarHBondContact O-N 3.32Å; D87-V90 PolarHBondContact O-N 3.24Å; D88-V90 VanDerWaalsContact C-N 3.35Å; V90-G92 VanDerWaalsContact C-N 3.32Å; V90-L123 HydrophobicContact CG2-CD1 3.56Å; V90-L123 HydrophobicContact CG2-CD2 3.5Å; V90-L123 VanDerWaalsContact CG2-CD2 3.5Å; V90-L123 HydrophobicContact CG2-CG 4.11Å
91V75.5Confident81.7Confident123 Ų12354.2 Ų54.275%0.74534%0.341SS*.Hα-helixtrans-78.3-16.6-177.4-179.60000112.4D87 D88 F89 G93D87-V91 WeakPolarHBondContact O-CG2 3.41Å; D87-V91 PolarHBondContact O-N 3.27Å; D88-V91 PolarHBondContact O-N 2.7Å; F89-V91 VanDerWaalsContact C-N 3.33Å; V91-G93 VanDerWaalsContact C-N 3.32Å
92G70.1Confident81.6Confident69 Ų6954.2 Ų54.271%0.71134%0.341SS*.THydrogen-bonded Turntrans7422.7-178.200000113.6D88 F89 V90D88-G92 PolarHBondContact O-N 3.48Å; F89-G92 PolarHBondContact O-N 3.34Å; V90-G92 VanDerWaalsContact C-N 3.32Å
93G62.8Low81.4Confident46 Ų4657.7 Ų57.747%0.47436%0.362SS..  trans-83.4169.8-179.900000113.6D88 V91 S95D88-G93 PolarHBondContact O-N 2.91Å; V91-G93 VanDerWaalsContact C-N 3.32Å; G93-S95 PolarHBondContact O-N 2.97Å; G93-S95 VanDerWaalsContact O-N 3.13Å
94V65.9Low81.2Confident150 Ų15056.1 Ų56.191%0.90935%0.353SS*.  trans-70.9105.7165.9178.80000107.3
95S70.1Confident81.1Confident24 Ų2457.8 Ų57.817%0.16836%0.36CS..  trans-75.5141.8-179.4-173.30000111.8D88 G93 W97D88-S95 VanDerWaalsContact CB-CB 3.5Å; D88-S95 WeakPolarHBondContact CB-OG 3.24Å; D88-S95 VanDerWaalsContact OD2-CA 3.23Å; D88-S95 WeakPolarHBondContact OD2-CA 3.46Å; D88-S95 VanDerWaalsContact OD2-CB 3.27Å; D88-S95 WeakPolarHBondContact OD2-CB 3.13Å; D88-S95 PolarHBondContact OD2-OG 2.99Å; G93-S95 PolarHBondContact O-N 2.97Å; G93-S95 VanDerWaalsContact O-N 3.13Å; S95-W97 PolarHBondContact O-N 3.34Å; S95-W97 WeakPolarHBondContact OG-CA 3.36Å; S95-W97 PolarHBondContact OG-N 3.42Å; S95-W97 PolarHBondContact OG-O 2.94Å; S95-W97 VanDerWaalsContact OG-O 3.1Å
96T75.8Confident80.9Confident104 Ų10461.4 Ų61.464%0.63839%0.385SS*.SBendtrans-66.8-23.1164.148.70000112.1D88D88-T96 PolarHBondContact OD2-N 3.35Å
97W83.3Confident81.1Confident40 Ų4060.7 Ų60.715%0.15238%0.382CS..SBendtrans-130.174.3-178.9-63.9107.8000109.9A54 I55 A70 F72 A81 A85 S95 L99 T101 F102A54-W97 HydrophobicContact CB-CH2 3.31Å; A54-W97 HydrophobicContact CB-CZ2 3.65Å; A54-W97 HydrophobicContact CB-CZ3 4.44Å; I55-W97 HydrophobicContact CD1-CZ2 4.15Å; A70-W97 HydrophobicContact CB-CH2 4.1Å; A70-W97 HydrophobicContact CB-CZ3 3.72Å; F72-W97 HydrophobicContact CE1-CH2 4.38Å; F72-W97 HydrophobicContact CZ-CH2 4.37Å; F72-W97 HydrophobicContact CZ-CZ3 4.19Å; A81-W97 HydrophobicContact CB-CD2 4.35Å; A81-W97 HydrophobicContact CB-CG 4.45Å; A85-W97 HydrophobicContact CB-CB 3.86Å; A85-W97 WeakPolarHBondContact CB-O 3.25Å; S95-W97 PolarHBondContact O-N 3.34Å; S95-W97 WeakPolarHBondContact OG-CA 3.36Å; S95-W97 PolarHBondContact OG-N 3.42Å; S95-W97 PolarHBondContact OG-O 2.94Å; S95-W97 VanDerWaalsContact OG-O 3.1Å; W97-L99 PolarHBondContact O-N 3.49Å; W97-T101 HydrophobicContact CE3-CG2 3.84Å; W97-T101 HydrophobicContact CZ3-CG2 3.99Å; W97-F102 HydrophobicContact CB-CE2 4.06Å; W97-F102 HydrophobicContact CB-CZ 4.2Å
98P85.1Confident81.4Confident59 Ų5957.3 Ų57.338%0.38336%0.363SS..  trans-51.7144.2174-24.434.1000110.9S100 T101P98-S100 PolarHBondContact O-N 3.08Å; P98-T101 VanDerWaalsContact O-CB 3.24Å; P98-T101 WeakPolarHBondContact O-CB 3.48Å; P98-T101 PolarHBondContact O-N 3.1Å; P98-T101 PolarHBondContact O-OG1 3.3Å
99L86.4Confident81.7Confident28 Ų2856.8 Ų56.815%0.14736%0.363CS..THydrogen-bonded Turntrans-57.5-20.7178.7-68.3177000113.3A85 L86 F89 W97 T101 F102 K108 I111 I127A85-L99 HydrophobicContact CB-CD2 4.23Å; L86-L99 HydrophobicContact CD2-CD2 4.45Å; F89-L99 HydrophobicContact CB-CD1 4.37Å; F89-L99 HydrophobicContact CD1-CD1 4.37Å; F89-L99 HydrophobicContact CD2-CD1 3.49Å; F89-L99 VanDerWaalsContact CD2-CD1 3.49Å; F89-L99 HydrophobicContact CD2-CG 4.25Å; F89-L99 HydrophobicContact CE2-CD1 3.75Å; F89-L99 HydrophobicContact CG-CD1 3.83Å; F89-L99 HydrophobicContact CZ-CD1 4.29Å; W97-L99 PolarHBondContact O-N 3.49Å; L99-T101 PolarHBondContact O-N 3.39Å; L99-F102 PolarHBondContact O-N 3.49Å; L99-K108 PolarHBondContact O-NZ 3.24Å; L99-I111 HydrophobicContact CD2-CD1 4.27Å; L99-I127 HydrophobicContact CD1-CD1 3.48Å; L99-I127 VanDerWaalsContact CD1-CD1 3.48Å
100S85Confident82.1Confident80 Ų8055.4 Ų55.456%0.55936%0.359SS*.THydrogen-bonded Turntrans-69.4-15.8173590000114.5P98 F102P98-S100 PolarHBondContact O-N 3.08Å; S100-F102 VanDerWaalsContact C-N 3.33Å
101T87Confident82.7Confident18 Ų1851.9 Ų51.911%0.1134%0.338CS..THydrogen-bonded Turntrans-66.2-40.5173.7-63.40000110.6E67 K68 A70 W97 P98 L99 V103E67-T101 HydrophobicContact CB-CG2 4.25Å; E67-T101 WeakPolarHBondContact CB-O 3.23Å; K68-T101 WeakPolarHBondContact CB-O 3.36Å; K68-T101 PolarHBondContact N-O 3.32Å; A70-T101 HydrophobicContact CB-CG2 4.39Å; W97-T101 HydrophobicContact CE3-CG2 3.84Å; W97-T101 HydrophobicContact CZ3-CG2 3.99Å; P98-T101 VanDerWaalsContact O-CB 3.24Å; P98-T101 WeakPolarHBondContact O-CB 3.48Å; P98-T101 PolarHBondContact O-N 3.1Å; P98-T101 PolarHBondContact O-OG1 3.3Å; L99-T101 PolarHBondContact O-N 3.39Å; T101-V103 PolarHBondContact O-N 3.07Å
102F89.6Confident83.5Confident0 Ų046.2 Ų46.20%030%0.303CS..  trans-83.294.5-176.9-58.6-73.8000110.2E67 F72 A81 I82 A85 W97 L99 S100 S107 K108 I111E67-F102 HydrophobicContact CG-CD1 3.95Å; E67-F102 WeakPolarHBondContact OE2-CA 3.48Å; F72-F102 HydrophobicContact CZ-CE1 4.46Å; A81-F102 HydrophobicContact CB-CE1 4.21Å; A81-F102 HydrophobicContact CB-CZ 3.94Å; I82-F102 HydrophobicContact CB-CE1 4.42Å; I82-F102 HydrophobicContact CB-CZ 4.45Å; I82-F102 HydrophobicContact CD1-CD1 4.22Å; I82-F102 HydrophobicContact CD1-CE1 4.33Å; I82-F102 HydrophobicContact CG1-CD1 3.58Å; I82-F102 HydrophobicContact CG1-CE1 3.35Å; I82-F102 HydrophobicContact CG1-CE2 4.41Å; I82-F102 HydrophobicContact CG1-CG 4.21Å; I82-F102 HydrophobicContact CG1-CZ 3.82Å; A85-F102 HydrophobicContact CB-CD2 4.4Å; A85-F102 HydrophobicContact CB-CE2 3.56Å; A85-F102 HydrophobicContact CB-CZ 4.3Å; W97-F102 HydrophobicContact CB-CE2 4.06Å; W97-F102 HydrophobicContact CB-CZ 4.2Å; L99-F102 PolarHBondContact O-N 3.49Å; S100-F102 VanDerWaalsContact C-N 3.33Å; F102-S107 WeakPolarHBondContact CB-OG 3.45Å; F102-K108 WeakPolarHBondContact O-CD 3.41Å; F102-K108 WeakPolarHBondContact O-CE 3.32Å; F102-K108 PolarHBondContact O-NZ 3.16Å; F102-I111 HydrophobicContact CB-CD1 3.76Å; F102-I111 HydrophobicContact CD2-CD1 4.25Å; F102-I111 HydrophobicContact CG-CD1 4.13Å
103V86.4Confident84.6Confident75 Ų7547 Ų4746%0.45529%0.291SS..  trans-101-22.3-173.2-660000112.5E67 K68 T101E67-V103 PolarHBondContact OE2-N 3.45Å; K68-V103 HydrophobicContact CB-CG1 3.98Å; K68-V103 HydrophobicContact CB-CG2 4.42Å; T101-V103 PolarHBondContact O-N 3.07Å
104S85.9Confident85.9Confident27 Ų2747.4 Ų47.419%0.18928%0.282CS..SBendtrans-66.3145.5-178.171.10000112.6E67 S106 S107 K108E67-S104 WeakPolarHBondContact OE1-CB 3.48Å; E67-S104 PolarHBondContact OE1-OG 3.37Å; E67-S104 PolarHBondContact OE2-N 3.37Å; E67-S104 VanDerWaalsContact OE2-N 3.1Å; S104-S106 PolarHBondContact O-N 3.42Å; S104-S107 PolarHBondContact N-OG 3.46Å; S104-S107 PolarHBondContact O-N 3.11Å; S104-S107 VanDerWaalsContact O-N 3.11Å; S104-S107 PolarHBondContact O-OG 3.17Å; S104-S107 WeakPolarHBondContact OG-CB 3.35Å; S104-S107 PolarHBondContact OG-N 2.93Å; S104-S107 PolarHBondContact OG-OG 2.8Å; S104-S107 VanDerWaalsContact OG-OG 3.05Å; S104-K108 PolarHBondContact O-N 3.11Å; S104-K108 VanDerWaalsContact O-N 3.1Å
105Q84.6Confident87.2Confident85 Ų8540.2 Ų40.240%0.39724%0.239SC..Hα-helixtrans-58.5-35.9174.3-173.6179.98.400112K108 S109Q105-K108 PolarHBondContact O-N 2.96Å; Q105-S109 PolarHBondContact O-N 3.17Å; Q105-S109 PolarHBondContact O-OG 3.39Å
106S86.6Confident88.2Confident78 Ų7840 Ų4055%0.54524%0.236SC..Hα-helixtrans-59.8-47.7174.5-570000111.3S104 K108 S109 V110S104-S106 PolarHBondContact O-N 3.42Å; S106-K108 PolarHBondContact O-N 3.33Å; S106-S109 PolarHBondContact O-N 2.69Å; S106-V110 WeakPolarHBondContact O-CG2 3.48Å; S106-V110 PolarHBondContact O-N 3.11Å
107S90.5Very high88.8Confident0 Ų038.7 Ų38.70%023%0.231CC..Hα-helixtrans-63.8-41.2178.268.40000112.5E67 F102 S104 S109 V110 I111E67-S107 VanDerWaalsContact OE1-CB 3.28Å; E67-S107 WeakPolarHBondContact OE1-CB 3.35Å; F102-S107 WeakPolarHBondContact CB-OG 3.45Å; S104-S107 PolarHBondContact N-OG 3.46Å; S104-S107 PolarHBondContact O-N 3.11Å; S104-S107 VanDerWaalsContact O-N 3.11Å; S104-S107 PolarHBondContact O-OG 3.17Å; S104-S107 WeakPolarHBondContact OG-CB 3.35Å; S104-S107 PolarHBondContact OG-N 2.93Å; S104-S107 PolarHBondContact OG-OG 2.8Å; S104-S107 VanDerWaalsContact OG-OG 3.05Å; S107-S109 VanDerWaalsContact C-N 3.31Å; S107-S109 PolarHBondContact O-N 3.41Å; S107-V110 PolarHBondContact O-N 2.84Å; S107-I111 WeakPolarHBondContact O-CB 3.4Å; S107-I111 VanDerWaalsContact O-CG1 3.23Å; S107-I111 WeakPolarHBondContact O-CG1 3.39Å; S107-I111 PolarHBondContact O-N 3.39Å
108K91.2Very high88.7Confident16 Ų1639.4 Ų39.47%0.0724%0.24CC..Hα-helixtrans-61-40.9176.4-60.8-43.4-158.1-177.10112.1L99 F102 S104 Q105 S106 L112 L131 L135 I143L99-K108 PolarHBondContact O-NZ 3.24Å; F102-K108 WeakPolarHBondContact O-CD 3.41Å; F102-K108 WeakPolarHBondContact O-CE 3.32Å; F102-K108 PolarHBondContact O-NZ 3.16Å; S104-K108 PolarHBondContact O-N 3.11Å; S104-K108 VanDerWaalsContact O-N 3.1Å; Q105-K108 PolarHBondContact O-N 2.96Å; S106-K108 PolarHBondContact O-N 3.33Å; K108-L112 PolarHBondContact O-N 2.97Å; K108-L131 HydrophobicContact CB-CD2 4.02Å; K108-L131 HydrophobicContact CD-CD2 3.59Å; K108-L131 HydrophobicContact CG-CD2 4.04Å; K108-L135 HydrophobicContact CG-CD2 4.29Å; K108-I143 HydrophobicContact CB-CD1 3.91Å
109S90.2Very high88.5Confident33 Ų3341.9 Ų41.923%0.23126%0.258CS..Hα-helixtrans-65.8-42.6177.1-56.10000111.5Q105 S106 S107 L112 N113Q105-S109 PolarHBondContact O-N 3.17Å; Q105-S109 PolarHBondContact O-OG 3.39Å; S106-S109 PolarHBondContact O-N 2.69Å; S107-S109 VanDerWaalsContact C-N 3.31Å; S107-S109 PolarHBondContact O-N 3.41Å; S109-L112 PolarHBondContact O-N 3.41Å; S109-N113 WeakPolarHBondContact O-CB 3.47Å; S109-N113 VanDerWaalsContact O-CG 3.23Å; S109-N113 PolarHBondContact O-N 2.71Å; S109-N113 PolarHBondContact O-ND2 3.36Å
110V92.1Very high88.3Confident32 Ų3243.7 Ų43.719%0.19427%0.267CS..Hα-helixtrans-65.5-46.3176.41700000111.6W78 L79 I82 S106 S107 L112 N113 L114W78-V110 HydrophobicContact CH2-CB 4.33Å; W78-V110 HydrophobicContact CH2-CG2 3.75Å; W78-V110 HydrophobicContact CZ3-CG2 4.01Å; L79-V110 HydrophobicContact CD2-CG1 3.57Å; I82-V110 HydrophobicContact CD1-CB 4.36Å; I82-V110 HydrophobicContact CD1-CG1 3.92Å; I82-V110 HydrophobicContact CG2-CG1 4.37Å; S106-V110 WeakPolarHBondContact O-CG2 3.48Å; S106-V110 PolarHBondContact O-N 3.11Å; S107-V110 PolarHBondContact O-N 2.84Å; V110-L112 VanDerWaalsContact C-N 3.28Å; V110-L112 PolarHBondContact O-N 3.32Å; V110-N113 PolarHBondContact O-N 3.21Å; V110-L114 HydrophobicContact CG1-CD1 3.78Å; V110-L114 HydrophobicContact CG1-CG 4.2Å; V110-L114 WeakPolarHBondContact O-CB 3.22Å; V110-L114 WeakPolarHBondContact O-CG 3.22Å; V110-L114 PolarHBondContact O-N 3.31Å
111I93.3Very high88.4Confident3 Ų340.9 Ų40.92%0.01525%0.251CS..Hα-helixtrans-53.3-48174.9-76.4164.7000110.2I82 L86 L99 F102 S107 T115 I127I82-I111 HydrophobicContact CG2-CG1 3.61Å; L86-I111 HydrophobicContact CD2-CG2 4.17Å; L99-I111 HydrophobicContact CD2-CD1 4.27Å; F102-I111 HydrophobicContact CB-CD1 3.76Å; F102-I111 HydrophobicContact CD2-CD1 4.25Å; F102-I111 HydrophobicContact CG-CD1 4.13Å; S107-I111 WeakPolarHBondContact O-CB 3.4Å; S107-I111 VanDerWaalsContact O-CG1 3.23Å; S107-I111 WeakPolarHBondContact O-CG1 3.39Å; S107-I111 PolarHBondContact O-N 3.39Å; I111-T115 VanDerWaalsContact O-CB 3.3Å; I111-T115 WeakPolarHBondContact O-CB 3.43Å; I111-T115 PolarHBondContact O-N 2.79Å; I111-T115 PolarHBondContact O-OG1 2.96Å; I111-I127 HydrophobicContact CG2-CG2 3.83Å
112L92.9Very high88.4Confident3 Ų345.8 Ų45.82%0.01628%0.277CS..Hα-helixtrans-64.9-45.7-180-169.566.1000111.7K108 S109 V110 T115 T116 I127 V128 L131 I143 N147 A150K108-L112 PolarHBondContact O-N 2.97Å; S109-L112 PolarHBondContact O-N 3.41Å; V110-L112 VanDerWaalsContact C-N 3.28Å; V110-L112 PolarHBondContact O-N 3.32Å; L112-T115 PolarHBondContact O-N 2.65Å; L112-T116 WeakPolarHBondContact O-CG2 3.47Å; L112-T116 PolarHBondContact O-N 3.26Å; L112-T116 PolarHBondContact O-OG1 3.44Å; L112-I127 HydrophobicContact CD1-CG2 4.3Å; L112-V128 HydrophobicContact CD1-CG2 3.74Å; L112-L131 HydrophobicContact CB-CD1 4.27Å; L112-L131 HydrophobicContact CD1-CD1 4.12Å; L112-I143 HydrophobicContact CD2-CG2 3.57Å; L112-N147 HydrophobicContact CD2-CB 3.82Å; L112-N147 HydrophobicContact CG-CB 4.47Å; L112-A150 HydrophobicContact CD1-CB 3.71Å; L112-A150 HydrophobicContact CD2-CB 3.83Å; L112-A150 HydrophobicContact CG-CB 3.94Å
113N91.8Very high88.3Confident85 Ų8546.3 Ų46.346%0.45528%0.279SS..Hα-helixtrans-62.6-46.7179.8-72.4-16.1000112.1S109 V110 T115 T116 S117 N147S109-N113 WeakPolarHBondContact O-CB 3.47Å; S109-N113 VanDerWaalsContact O-CG 3.23Å; S109-N113 PolarHBondContact O-N 2.71Å; S109-N113 PolarHBondContact O-ND2 3.36Å; V110-N113 PolarHBondContact O-N 3.21Å; N113-T115 VanDerWaalsContact C-N 3.32Å; N113-T115 PolarHBondContact O-N 2.52Å; N113-T116 WeakPolarHBondContact CA-OG1 3.4Å; N113-T116 PolarHBondContact O-N 3.37Å; N113-T116 PolarHBondContact O-OG1 2.87Å; N113-S117 PolarHBondContact O-N 3.22Å; N113-N147 PolarHBondContact OD1-ND2 3.44Å
114L90.9Very high88.7Confident55 Ų5542.7 Ų42.729%0.28826%0.258SS..Hα-helixtrans-59.7-45.1174.6-71.8175000110.9I82 L86 V110 T116 S117 T118I82-L114 HydrophobicContact CG2-CD1 3.73Å; L86-L114 HydrophobicContact CD1-CB 3.68Å; L86-L114 HydrophobicContact CD1-CD1 4.15Å; V110-L114 HydrophobicContact CG1-CD1 3.78Å; V110-L114 HydrophobicContact CG1-CG 4.2Å; V110-L114 WeakPolarHBondContact O-CB 3.22Å; V110-L114 WeakPolarHBondContact O-CG 3.22Å; V110-L114 PolarHBondContact O-N 3.31Å; L114-T116 PolarHBondContact O-N 3.29Å; L114-S117 WeakPolarHBondContact O-CB 3.23Å; L114-S117 PolarHBondContact O-N 3.42Å; L114-S117 VanDerWaalsContact O-N 3.13Å; L114-S117 PolarHBondContact O-OG 2.94Å; L114-T118 PolarHBondContact O-N 3.17Å
115T91.8Very high89Confident0 Ų042.6 Ų42.60%026%0.256CS..Hα-helixtrans-59.9-45.5177.1-57.60000111.5L86 I111 L112 N113 S117 T118 L123 I124 I127L86-T115 WeakPolarHBondContact CD2-OG1 3.38Å; I111-T115 VanDerWaalsContact O-CB 3.3Å; I111-T115 WeakPolarHBondContact O-CB 3.43Å; I111-T115 PolarHBondContact O-N 2.79Å; I111-T115 PolarHBondContact O-OG1 2.96Å; L112-T115 PolarHBondContact O-N 2.65Å; N113-T115 VanDerWaalsContact C-N 3.32Å; N113-T115 PolarHBondContact O-N 2.52Å; T115-S117 PolarHBondContact O-N 2.9Å; T115-T118 WeakPolarHBondContact O-CB 3.42Å; T115-T118 PolarHBondContact O-N 3.03Å; T115-T118 PolarHBondContact O-OG1 3.25Å; T115-L123 HydrophobicContact CG2-CB 4.45Å; T115-L123 HydrophobicContact CG2-CD2 4.03Å; T115-L123 HydrophobicContact CG2-CG 3.75Å; T115-I124 HydrophobicContact CG2-CB 4.35Å; T115-I124 HydrophobicContact CG2-CG1 3.85Å; T115-I127 HydrophobicContact CG2-CB 4.14Å; T115-I127 HydrophobicContact CG2-CG1 3.89Å
116T91.2Very high89.3Confident20 Ų2044.4 Ų44.412%0.12326%0.262CS..Hα-helixtrans-64.2-28.417851.50000113.3L112 N113 L114 T118 C119 I124 N147 V149 A150L112-T116 WeakPolarHBondContact O-CG2 3.47Å; L112-T116 PolarHBondContact O-N 3.26Å; L112-T116 PolarHBondContact O-OG1 3.44Å; N113-T116 WeakPolarHBondContact CA-OG1 3.4Å; N113-T116 PolarHBondContact O-N 3.37Å; N113-T116 PolarHBondContact O-OG1 2.87Å; L114-T116 PolarHBondContact O-N 3.29Å; T116-T118 PolarHBondContact O-N 3.12Å; T116-C119 PolarHBondContact O-N 2.77Å; T116-I124 HydrophobicContact CG2-CD1 4.41Å; T116-I124 HydrophobicContact CG2-CG1 4.33Å; T116-I124 HydrophobicContact CG2-CG2 4.35Å; T116-N147 PolarHBondContact OG1-ND2 3.19Å; T116-V149 HydrophobicContact CG2-CB 4.11Å; T116-V149 HydrophobicContact CG2-CG1 4.02Å; T116-A150 HydrophobicContact CG2-CB 4Å
117S88.5Confident89.6Confident76 Ų7640.8 Ų40.853%0.53124%0.237SC..Hα-helixtrans-69.1-18.4174.880.40000113.7N113 L114 T115 C119N113-S117 PolarHBondContact O-N 3.22Å; L114-S117 WeakPolarHBondContact O-CB 3.23Å; L114-S117 PolarHBondContact O-N 3.42Å; L114-S117 VanDerWaalsContact O-N 3.13Å; L114-S117 PolarHBondContact O-OG 2.94Å; T115-S117 PolarHBondContact O-N 2.9Å; S117-C119 VanDerWaalsContact C-N 3.26Å; S117-C119 PolarHBondContact O-N 3.11Å
118T82.7Confident89.8Confident55 Ų5540.8 Ų40.834%0.33724%0.237SC..THydrogen-bonded Turntrans-72.6-19.4176.9700000113.1L114 T115 T116 D120 L123L114-T118 PolarHBondContact O-N 3.17Å; T115-T118 WeakPolarHBondContact O-CB 3.42Å; T115-T118 PolarHBondContact O-N 3.03Å; T115-T118 PolarHBondContact O-OG1 3.25Å; T116-T118 PolarHBondContact O-N 3.12Å; T118-D120 PolarHBondContact O-N 3.47Å; T118-D120 VanDerWaalsContact O-N 3.1Å; T118-D120 PolarHBondContact OG1-N 3.23Å; T118-L123 HydrophobicContact CG2-CD2 4.2Å
119C80.4Confident89.8Confident111 Ų11141.6 Ų41.675%0.7524%0.242SC*.THydrogen-bonded Turntrans56.514.7-171.5-570000114.5T116 S117 G121T116-C119 PolarHBondContact O-N 2.77Å; S117-C119 VanDerWaalsContact C-N 3.26Å; S117-C119 PolarHBondContact O-N 3.11Å; C119-G121 PolarHBondContact O-N 3.26Å
120D82.7Confident89.7Confident65 Ų6544.5 Ų44.535%0.34825%0.252SS..  trans-86.3100.7173.8-179.6-16.1000109.8T118 N122 L123 I124T118-D120 PolarHBondContact O-N 3.47Å; T118-D120 VanDerWaalsContact O-N 3.1Å; T118-D120 PolarHBondContact OG1-N 3.23Å; D120-N122 PolarHBondContact O-N 3.43Å; D120-N122 WeakPolarHBondContact OD1-CA 3.49Å; D120-N122 WeakPolarHBondContact OD1-CB 2.86Å; D120-N122 PolarHBondContact OD1-N 3.31Å; D120-L123 HydrophobicContact CB-CB 3.83Å; D120-L123 PolarHBondContact O-N 3.22Å; D120-L123 PolarHBondContact OD1-N 3.41Å; D120-I124 VanDerWaalsContact O-CG1 3.23Å; D120-I124 WeakPolarHBondContact O-CG1 3.05Å; D120-I124 PolarHBondContact O-N 3.08Å
121G86.4Confident89.7Confident21 Ų2143.3 Ų43.322%0.21624%0.244CC..Hα-helixtrans-60.6-28.4-179.100000114.6C119 T125 H153C119-G121 PolarHBondContact O-N 3.26Å; G121-T125 WeakPolarHBondContact O-CB 3.3Å; G121-T125 PolarHBondContact O-N 2.86Å; G121-T125 VanDerWaalsContact O-N 3.12Å; G121-T125 PolarHBondContact O-OG1 3.36Å; G121-H153 WeakPolarHBondContact CA-CE1 3.5Å
122N86.3Confident89.6Confident122 Ų12246.3 Ų46.365%0.65226%0.256SS*.Hα-helixtrans-73.8-44.7176.6-71.4-35.3000110.5D120 T125 K126D120-N122 PolarHBondContact O-N 3.43Å; D120-N122 WeakPolarHBondContact OD1-CA 3.49Å; D120-N122 WeakPolarHBondContact OD1-CB 2.86Å; D120-N122 PolarHBondContact OD1-N 3.31Å; N122-T125 PolarHBondContact O-N 3.3Å; N122-K126 WeakPolarHBondContact O-CG 3.47Å; N122-K126 PolarHBondContact O-N 3.37Å
123L89.3Confident89.5Confident10 Ų1052.2 Ų52.25%0.05229%0.287CS..Hα-helixtrans-62.8-46.2176-177.661.9000111.5F89 V90 T115 T118 D120 T125 K126 I127F89-L123 HydrophobicContact CD1-CD1 3.78Å; F89-L123 HydrophobicContact CE1-CD1 4Å; V90-L123 HydrophobicContact CG2-CD1 3.56Å; V90-L123 HydrophobicContact CG2-CD2 3.5Å; V90-L123 VanDerWaalsContact CG2-CD2 3.5Å; V90-L123 HydrophobicContact CG2-CG 4.11Å; T115-L123 HydrophobicContact CG2-CB 4.45Å; T115-L123 HydrophobicContact CG2-CD2 4.03Å; T115-L123 HydrophobicContact CG2-CG 3.75Å; T118-L123 HydrophobicContact CG2-CD2 4.2Å; D120-L123 HydrophobicContact CB-CB 3.83Å; D120-L123 PolarHBondContact O-N 3.22Å; D120-L123 PolarHBondContact OD1-N 3.41Å; L123-T125 VanDerWaalsContact C-N 3.29Å; L123-T125 PolarHBondContact O-N 2.97Å; L123-K126 PolarHBondContact O-N 3.03Å; L123-K126 VanDerWaalsContact O-N 3.17Å; L123-I127 HydrophobicContact CD1-CG1 4.18Å; L123-I127 HydrophobicContact CG-CG1 4.45Å; L123-I127 WeakPolarHBondContact O-CG1 3.46Å; L123-I127 PolarHBondContact O-N 3.05Å
124I92.9Very high89.2Confident0 Ų051.5 Ų51.50%029%0.289CS..Hα-helixtrans-54.4-49175.6-65.7162.9000109.9T115 T116 D120 K126 I127 V128 V149 A150 H153T115-I124 HydrophobicContact CG2-CB 4.35Å; T115-I124 HydrophobicContact CG2-CG1 3.85Å; T116-I124 HydrophobicContact CG2-CD1 4.41Å; T116-I124 HydrophobicContact CG2-CG1 4.33Å; T116-I124 HydrophobicContact CG2-CG2 4.35Å; D120-I124 VanDerWaalsContact O-CG1 3.23Å; D120-I124 WeakPolarHBondContact O-CG1 3.05Å; D120-I124 PolarHBondContact O-N 3.08Å; I124-K126 PolarHBondContact O-N 2.88Å; I124-I127 PolarHBondContact O-N 2.87Å; I124-V128 HydrophobicContact CG2-CG2 4.27Å; I124-V128 WeakPolarHBondContact O-CB 3.1Å; I124-V128 VanDerWaalsContact O-CG2 3.23Å; I124-V128 WeakPolarHBondContact O-CG2 2.99Å; I124-V128 PolarHBondContact O-N 3.35Å; I124-V149 HydrophobicContact CD1-CG1 4.39Å; I124-A150 HydrophobicContact CG2-CB 4.45Å; I124-H153 HydrophobicContact CB-CB 4.44Å; I124-H153 HydrophobicContact CG2-CB 3.66Å
125T92.3Very high89.1Confident25 Ų2550.8 Ų50.815%0.15329%0.285CS..Hα-helixtrans-62-41.4179.8-57.50000112.4G121 N122 L123 N129 F157G121-T125 WeakPolarHBondContact O-CB 3.3Å; G121-T125 PolarHBondContact O-N 2.86Å; G121-T125 VanDerWaalsContact O-N 3.12Å; G121-T125 PolarHBondContact O-OG1 3.36Å; N122-T125 PolarHBondContact O-N 3.3Å; L123-T125 VanDerWaalsContact C-N 3.29Å; L123-T125 PolarHBondContact O-N 2.97Å; T125-N129 WeakPolarHBondContact O-CB 3.49Å; T125-N129 PolarHBondContact O-N 2.81Å; T125-N129 PolarHBondContact O-ND2 2.88Å; T125-F157 HydrophobicContact CG2-CB 3.7Å; T125-F157 HydrophobicContact CG2-CD2 3.47Å; T125-F157 VanDerWaalsContact CG2-CD2 3.47Å; T125-F157 HydrophobicContact CG2-CE2 4.22Å; T125-F157 HydrophobicContact CG2-CG 3.64Å
126K91.5Very high89Confident122 Ų12253.6 Ų53.653%0.5331%0.305SS..Hα-helixtrans-62.2-51176.5-74.3175.7-178.9178.20111.5F89 N122 L123 I124 V128 N129 E130F89-K126 HydrophobicContact CE1-CB 3.95Å; F89-K126 HydrophobicContact CE1-CD 4.34Å; F89-K126 HydrophobicContact CZ-CB 4.2Å; N122-K126 WeakPolarHBondContact O-CG 3.47Å; N122-K126 PolarHBondContact O-N 3.37Å; L123-K126 PolarHBondContact O-N 3.03Å; L123-K126 VanDerWaalsContact O-N 3.17Å; I124-K126 PolarHBondContact O-N 2.88Å; K126-V128 PolarHBondContact O-N 3.27Å; K126-N129 PolarHBondContact O-N 3.21Å; K126-E130 WeakPolarHBondContact O-CG 3.44Å; K126-E130 PolarHBondContact O-N 3.1Å
127I93Very high88.9Confident2 Ų257.4 Ų57.41%0.0132%0.321CS..Hα-helixtrans-62.6-42.9-179.6-67.8-64.1000111.2L86 F89 L99 I111 L112 T115 L123 I124 N129 E130 L131L86-I127 HydrophobicContact CD2-CD1 3.96Å; L86-I127 HydrophobicContact CD2-CG1 4.38Å; F89-I127 HydrophobicContact CD1-CD1 3.79Å; F89-I127 HydrophobicContact CE1-CD1 3.66Å; F89-I127 HydrophobicContact CE1-CG1 4.23Å; F89-I127 HydrophobicContact CG-CD1 4.41Å; F89-I127 HydrophobicContact CZ-CD1 4.19Å; L99-I127 HydrophobicContact CD1-CD1 3.48Å; L99-I127 VanDerWaalsContact CD1-CD1 3.48Å; I111-I127 HydrophobicContact CG2-CG2 3.83Å; L112-I127 HydrophobicContact CD1-CG2 4.3Å; T115-I127 HydrophobicContact CG2-CB 4.14Å; T115-I127 HydrophobicContact CG2-CG1 3.89Å; L123-I127 HydrophobicContact CD1-CG1 4.18Å; L123-I127 HydrophobicContact CG-CG1 4.45Å; L123-I127 WeakPolarHBondContact O-CG1 3.46Å; L123-I127 PolarHBondContact O-N 3.05Å; I124-I127 PolarHBondContact O-N 2.87Å; I127-N129 VanDerWaalsContact C-N 3.3Å; I127-N129 PolarHBondContact O-N 3.27Å; I127-E130 PolarHBondContact O-N 2.72Å; I127-L131 HydrophobicContact CG2-CD1 4.25Å; I127-L131 HydrophobicContact CG2-CG 4.39Å; I127-L131 WeakPolarHBondContact O-CG 2.97Å; I127-L131 PolarHBondContact O-N 3.37Å
128V93.8Very high88.9Confident1 Ų157 Ų571%0.00632%0.319CS..Hα-helixtrans-60.1-42.1176.4172.60000111.3L112 I124 K126 L131 R132 F140 L144 A150 F154L112-V128 HydrophobicContact CD1-CG2 3.74Å; I124-V128 HydrophobicContact CG2-CG2 4.27Å; I124-V128 WeakPolarHBondContact O-CB 3.1Å; I124-V128 VanDerWaalsContact O-CG2 3.23Å; I124-V128 WeakPolarHBondContact O-CG2 2.99Å; I124-V128 PolarHBondContact O-N 3.35Å; K126-V128 PolarHBondContact O-N 3.27Å; V128-L131 PolarHBondContact O-N 3.32Å; V128-R132 WeakPolarHBondContact O-CB 3.39Å; V128-R132 PolarHBondContact O-N 3.32Å; V128-F140 HydrophobicContact CG1-CE2 3.84Å; V128-F140 HydrophobicContact CG1-CZ 3.74Å; V128-F140 WeakPolarHBondContact O-CE2 3.5Å; V128-L144 HydrophobicContact CG1-CD1 4.34Å; V128-A150 HydrophobicContact CG2-CB 3.93Å; V128-F154 HydrophobicContact CG1-CB 3.91Å; V128-F154 HydrophobicContact CG1-CD2 3.49Å; V128-F154 VanDerWaalsContact CG1-CD2 3.49Å; V128-F154 HydrophobicContact CG1-CE2 4.21Å; V128-F154 HydrophobicContact CG1-CG 3.79Å
129N91.2Very high89.2Confident32 Ų3256.2 Ų56.217%0.17131%0.314CS..Hα-helixtrans-66.5-38.8175.9-79.2-33.2000112.7T125 K126 I127 R132 N133 F157T125-N129 WeakPolarHBondContact O-CB 3.49Å; T125-N129 PolarHBondContact O-N 2.81Å; T125-N129 PolarHBondContact O-ND2 2.88Å; K126-N129 PolarHBondContact O-N 3.21Å; I127-N129 VanDerWaalsContact C-N 3.3Å; I127-N129 PolarHBondContact O-N 3.27Å; N129-R132 WeakPolarHBondContact O-CB 3.48Å; N129-R132 PolarHBondContact O-N 3.42Å; N129-N133 VanDerWaalsContact O-CG 3.22Å; N129-N133 PolarHBondContact O-N 2.92Å; N129-N133 PolarHBondContact O-ND2 3.09Å; N129-F157 WeakPolarHBondContact ND2-CE1 3.38Å; N129-F157 VanDerWaalsContact ND2-CZ 3.28Å; N129-F157 WeakPolarHBondContact ND2-CZ 3.48Å; N129-F157 WeakPolarHBondContact OD1-CE1 3.36Å
130E90Very high89.8Confident94 Ų9451.1 Ų51.144%0.43928%0.279SS..Hα-helixtrans-61.8-42.2173.4-73.4-59.6137.400112.1F89 K126 I127 N133 S134F89-E130 HydrophobicContact CE2-CG 4.29Å; F89-E130 HydrophobicContact CZ-CG 4.06Å; K126-E130 WeakPolarHBondContact O-CG 3.44Å; K126-E130 PolarHBondContact O-N 3.1Å; I127-E130 PolarHBondContact O-N 2.72Å; E130-N133 PolarHBondContact O-N 2.68Å; E130-S134 WeakPolarHBondContact O-CB 3.41Å; E130-S134 PolarHBondContact O-N 3.47Å; E130-S134 VanDerWaalsContact O-N 3.1Å; E130-S134 PolarHBondContact O-OG 3.47Å
131L91.9Very high90.2Very high7 Ų749.5 Ų49.54%0.03727%0.269CS..Hα-helixtrans-65.1-42.3174.6-67-179.5000111.6K108 L112 I127 V128 N133 S134 L135 F140K108-L131 HydrophobicContact CB-CD2 4.02Å; K108-L131 HydrophobicContact CD-CD2 3.59Å; K108-L131 HydrophobicContact CG-CD2 4.04Å; L112-L131 HydrophobicContact CB-CD1 4.27Å; L112-L131 HydrophobicContact CD1-CD1 4.12Å; I127-L131 HydrophobicContact CG2-CD1 4.25Å; I127-L131 HydrophobicContact CG2-CG 4.39Å; I127-L131 WeakPolarHBondContact O-CG 2.97Å; I127-L131 PolarHBondContact O-N 3.37Å; V128-L131 PolarHBondContact O-N 3.32Å; L131-N133 VanDerWaalsContact C-N 3.26Å; L131-N133 PolarHBondContact O-N 3.22Å; L131-S134 PolarHBondContact O-N 2.94Å; L131-S134 PolarHBondContact O-OG 2.89Å; L131-L135 HydrophobicContact CB-CD1 4.12Å; L131-L135 HydrophobicContact CD2-CD1 4.29Å; L131-L135 VanDerWaalsContact O-CB 3.28Å; L131-L135 WeakPolarHBondContact O-CB 3.45Å; L131-L135 VanDerWaalsContact O-CG 3.26Å; L131-L135 WeakPolarHBondContact O-CG 3.32Å; L131-L135 PolarHBondContact O-N 3.4Å; L131-F140 HydrophobicContact CB-CD2 4.21Å; L131-F140 HydrophobicContact CB-CE2 4.35Å
132R91.4Very high90.3Very high67 Ų6752.5 Ų52.525%0.25328%0.28SS..Hα-helixtrans-57.4-40.4176-174.7-173.4179-168.80.5111.9V128 N129 F140 D166V128-R132 WeakPolarHBondContact O-CB 3.39Å; V128-R132 PolarHBondContact O-N 3.32Å; N129-R132 WeakPolarHBondContact O-CB 3.48Å; N129-R132 PolarHBondContact O-N 3.42Å; R132-F140 HydrophobicContact CB-CD1 4.48Å; R132-F140 HydrophobicContact CB-CD2 4.03Å; R132-F140 HydrophobicContact CB-CE1 4.21Å; R132-F140 HydrophobicContact CB-CE2 3.73Å; R132-F140 HydrophobicContact CB-CG 4.4Å; R132-F140 HydrophobicContact CB-CZ 3.82Å; R132-F140 HydrophobicContact CG-CD1 4.31Å; R132-F140 HydrophobicContact CG-CE1 4.1Å; R132-F140 HydrophobicContact CG-CE2 4.49Å; R132-F140 HydrophobicContact CG-CZ 4.2Å; R132-D166 IonicContact CZ-OD2 3.39Å; R132-D166 IonicContact NH1-OD2 2.72Å; R132-D166 IonicContact NH2-OD2 2.78Å; R132-D166 PolarHBondContact NH2-OD2 2.88Å
133N89.2Confident90.4Very high126 Ų12647 Ų4767%0.67425%0.251SS*.Hα-helixtrans-78.5-24.6-177.4-67.9-23.1000113.5N129 E130 L131N129-N133 VanDerWaalsContact O-CG 3.22Å; N129-N133 PolarHBondContact O-N 2.92Å; N129-N133 PolarHBondContact O-ND2 3.09Å; E130-N133 PolarHBondContact O-N 2.68Å; L131-N133 VanDerWaalsContact C-N 3.26Å; L131-N133 PolarHBondContact O-N 3.22Å
134S86.4Confident90.5Very high71 Ų7146.7 Ų46.750%0.49725%0.249SC..Hα-helixtrans-100.2-15.2-174.755.90000114.5E130 L131E130-S134 WeakPolarHBondContact O-CB 3.41Å; E130-S134 PolarHBondContact O-N 3.47Å; E130-S134 VanDerWaalsContact O-N 3.1Å; E130-S134 PolarHBondContact O-OG 3.47Å; L131-S134 PolarHBondContact O-N 2.94Å; L131-S134 PolarHBondContact O-OG 2.89Å
135L88.1Confident90.2Very high39 Ų3950.5 Ų50.520%0.20427%0.269CS..SBendtrans-110.6157-175.3-60.9176.5000112K108 L131 T139 F140 I143K108-L135 HydrophobicContact CG-CD2 4.29Å; L131-L135 HydrophobicContact CB-CD1 4.12Å; L131-L135 HydrophobicContact CD2-CD1 4.29Å; L131-L135 VanDerWaalsContact O-CB 3.28Å; L131-L135 WeakPolarHBondContact O-CB 3.45Å; L131-L135 VanDerWaalsContact O-CG 3.26Å; L131-L135 WeakPolarHBondContact O-CG 3.32Å; L131-L135 PolarHBondContact O-N 3.4Å; L135-T139 HydrophobicContact CD1-CG2 4.26Å; L135-T139 HydrophobicContact CD2-CG2 4.28Å; L135-F140 HydrophobicContact CB-CB 4.31Å; L135-I143 HydrophobicContact CD1-CD1 3.62Å
136S89.3Confident90Very high60 Ų6057.1 Ų57.142%0.4230%0.296SS..  trans-63.5152.116570.20000110.1S138 T139 F140S136-S138 VanDerWaalsContact C-N 3.3Å; S136-S138 PolarHBondContact O-N 2.83Å; S136-S138 PolarHBondContact OG-OG 2.84Å; S136-T139 PolarHBondContact O-N 3.4Å; S136-T139 VanDerWaalsContact O-N 3.09Å; S136-T139 WeakPolarHBondContact OG-CB 3.36Å; S136-T139 PolarHBondContact OG-N 3.07Å; S136-T139 PolarHBondContact OG-OG1 2.73Å; S136-F140 PolarHBondContact O-N 3.46Å
137E89.9Confident89.8Confident99 Ų9951.9 Ų51.946%0.46327%0.273SS..Hα-helixtrans-58-42.8-175.6-170.7167.9-127.200112.4T139 F140 E141 R169E137-T139 PolarHBondContact O-N 3.35Å; E137-F140 PolarHBondContact O-N 2.85Å; E137-E141 WeakPolarHBondContact O-CB 3.29Å; E137-E141 VanDerWaalsContact O-CG 3.23Å; E137-E141 WeakPolarHBondContact O-CG 3.48Å; E137-E141 PolarHBondContact O-N 3.12Å; E137-R169 IonicContact OE1-CZ 2.68Å; E137-R169 IonicContact OE1-NH1 3.75Å; E137-R169 PolarHBondContact OE1-NH1 2.97Å; E137-R169 IonicContact OE1-NH2 3.48Å; E137-R169 PolarHBondContact OE1-NH2 3.02Å; E137-R169 VanDerWaalsContact OE1-NH2 3.16Å; E137-R169 IonicContact OE2-CZ 3.04Å; E137-R169 IonicContact OE2-NH1 3.97Å; E137-R169 PolarHBondContact OE2-NH1 3.3Å; E137-R169 VanDerWaalsContact OE2-NH1 3.15Å; E137-R169 IonicContact OE2-NH2 3.57Å; E137-R169 PolarHBondContact OE2-NH2 3.4Å
138S89.5Confident89.6Confident69 Ų6955.4 Ų55.448%0.48330%0.298SS..Hα-helixtrans-62.8-39.9176.355.10000112.8S136 N142S136-S138 VanDerWaalsContact C-N 3.3Å; S136-S138 PolarHBondContact O-N 2.83Å; S136-S138 PolarHBondContact OG-OG 2.84Å; S138-N142 WeakPolarHBondContact O-CB 3.32Å; S138-N142 VanDerWaalsContact O-CG 3.29Å; S138-N142 PolarHBondContact O-N 3.03Å; S138-N142 PolarHBondContact O-ND2 3.13Å
139T88.2Confident89.3Confident37 Ų3758.4 Ų58.423%0.22732%0.316CS..Hα-helixtrans-68.5-43.8178.6-54.70000110.9L135 S136 E137 N142 I143L135-T139 HydrophobicContact CD1-CG2 4.26Å; L135-T139 HydrophobicContact CD2-CG2 4.28Å; S136-T139 PolarHBondContact O-N 3.4Å; S136-T139 VanDerWaalsContact O-N 3.09Å; S136-T139 WeakPolarHBondContact OG-CB 3.36Å; S136-T139 PolarHBondContact OG-N 3.07Å; S136-T139 PolarHBondContact OG-OG1 2.73Å; E137-T139 PolarHBondContact O-N 3.35Å; T139-N142 PolarHBondContact O-N 3Å; T139-I143 HydrophobicContact CG2-CD1 4.13Å; T139-I143 WeakPolarHBondContact O-CG1 3.23Å; T139-I143 PolarHBondContact O-N 3.1Å
140F92.4Very high89.3Confident4 Ų456.9 Ų56.92%0.01831%0.308CS..Hα-helixtrans-60.7-47.1175.6175.9-106.8000111.6V128 L131 R132 L135 S136 E137 N142 I143 L144 F154 Y170V128-F140 HydrophobicContact CG1-CE2 3.84Å; V128-F140 HydrophobicContact CG1-CZ 3.74Å; V128-F140 WeakPolarHBondContact O-CE2 3.5Å; L131-F140 HydrophobicContact CB-CD2 4.21Å; L131-F140 HydrophobicContact CB-CE2 4.35Å; R132-F140 HydrophobicContact CB-CD1 4.48Å; R132-F140 HydrophobicContact CB-CD2 4.03Å; R132-F140 HydrophobicContact CB-CE1 4.21Å; R132-F140 HydrophobicContact CB-CE2 3.73Å; R132-F140 HydrophobicContact CB-CG 4.4Å; R132-F140 HydrophobicContact CB-CZ 3.82Å; R132-F140 HydrophobicContact CG-CD1 4.31Å; R132-F140 HydrophobicContact CG-CE1 4.1Å; R132-F140 HydrophobicContact CG-CE2 4.49Å; R132-F140 HydrophobicContact CG-CZ 4.2Å; L135-F140 HydrophobicContact CB-CB 4.31Å; S136-F140 PolarHBondContact O-N 3.46Å; E137-F140 PolarHBondContact O-N 2.85Å; F140-N142 PolarHBondContact O-N 3.12Å; F140-I143 PolarHBondContact O-N 2.88Å; F140-L144 HydrophobicContact CE1-CD2 4.2Å; F140-L144 HydrophobicContact CZ-CD1 4.45Å; F140-L144 HydrophobicContact CZ-CD2 4.29Å; F140-L144 WeakPolarHBondContact O-CB 3.26Å; F140-L144 PolarHBondContact O-N 3.37Å; F140-F154 HydrophobicContact CE1-CD1 4.48Å; F140-F154 AromaticContact CE1-CE1 3.87Å; F140-F154 HydrophobicContact CE1-CE1 3.87Å; F140-F154 AromaticContact CE1-CZ 3.99Å; F140-F154 HydrophobicContact CE1-CZ 3.99Å; F140-F154 HydrophobicContact CZ-CD1 4.35Å; F140-F154 HydrophobicContact CZ-CE1 4.05Å; F140-F154 HydrophobicContact CZ-CE2 4.26Å; F140-F154 HydrophobicContact CZ-CZ 4.02Å; F140-Y170 HydrophobicContact CD1-CE1 4.1Å; F140-Y170 WeakPolarHBondContact CD1-OH 3.44Å; F140-Y170 AromaticContact CE1-CE1 3.81Å; F140-Y170 HydrophobicContact CE1-CE1 3.81Å; F140-Y170 AromaticContact CE1-CZ 3.79Å; F140-Y170 WeakPolarHBondContact CE1-OH 3.18Å
141E90.7Very high89.3Confident31 Ų3152.5 Ų52.515%0.14529%0.289CS..Hα-helixtrans-57.2-46.2176.4-77-177.9172.700112E137 I143 L144 L145 R169 Y170 L173E137-E141 WeakPolarHBondContact O-CB 3.29Å; E137-E141 VanDerWaalsContact O-CG 3.23Å; E137-E141 WeakPolarHBondContact O-CG 3.48Å; E137-E141 PolarHBondContact O-N 3.12Å; E141-I143 PolarHBondContact O-N 3.39Å; E141-L144 PolarHBondContact O-N 3.4Å; E141-L145 WeakPolarHBondContact O-CB 3.39Å; E141-L145 WeakPolarHBondContact O-CG 3.15Å; E141-L145 PolarHBondContact O-N 2.74Å; E141-R169 IonicContact OE1-CZ 2.66Å; E141-R169 VanDerWaalsContact OE1-CZ 3.32Å; E141-R169 IonicContact OE1-NE 3.79Å; E141-R169 PolarHBondContact OE1-NE 3.19Å; E141-R169 IonicContact OE1-NH2 2.69Å; E141-R169 PolarHBondContact OE1-NH2 2.82Å; E141-Y170 HydrophobicContact CG-CE1 3.87Å; E141-L173 HydrophobicContact CB-CD2 3.75Å; E141-L173 HydrophobicContact CG-CD2 3.47Å; E141-L173 VanDerWaalsContact CG-CD2 3.47Å
142N89Confident89.1Confident85 Ų8557.5 Ų57.546%0.45531%0.31SS..Hα-helixtrans-63.6-38.6178-78.1-31000113.4S138 T139 F140 K146S138-N142 WeakPolarHBondContact O-CB 3.32Å; S138-N142 VanDerWaalsContact O-CG 3.29Å; S138-N142 PolarHBondContact O-N 3.03Å; S138-N142 PolarHBondContact O-ND2 3.13Å; T139-N142 PolarHBondContact O-N 3Å; F140-N142 PolarHBondContact O-N 3.12Å; N142-K146 WeakPolarHBondContact O-CG 3.45Å
143I89.2Confident89Confident7 Ų757 Ų574%0.03631%0.31CS..Hα-helixtrans-68.7-43176.1-71.3171.5000110.2K108 L112 L135 T139 F140 E141 K146K108-I143 HydrophobicContact CB-CD1 3.91Å; L112-I143 HydrophobicContact CD2-CG2 3.57Å; L135-I143 HydrophobicContact CD1-CD1 3.62Å; T139-I143 HydrophobicContact CG2-CD1 4.13Å; T139-I143 WeakPolarHBondContact O-CG1 3.23Å; T139-I143 PolarHBondContact O-N 3.1Å; F140-I143 PolarHBondContact O-N 2.88Å; E141-I143 PolarHBondContact O-N 3.39Å; I143-K146 PolarHBondContact O-N 3.14Å
144L90.6Very high89.1Confident3 Ų351 Ų512%0.01628%0.278CS..Hα-helixtrans-65.6-40.7-178.9-162.869.6000112V128 F140 E141 K146 N147 A150 A151 F154 Y170V128-L144 HydrophobicContact CG1-CD1 4.34Å; F140-L144 HydrophobicContact CE1-CD2 4.2Å; F140-L144 HydrophobicContact CZ-CD1 4.45Å; F140-L144 HydrophobicContact CZ-CD2 4.29Å; F140-L144 WeakPolarHBondContact O-CB 3.26Å; F140-L144 PolarHBondContact O-N 3.37Å; E141-L144 PolarHBondContact O-N 3.4Å; L144-K146 PolarHBondContact O-N 2.89Å; L144-N147 CarbonylContact O-C 3.44Å; L144-N147 PolarHBondContact O-N 3.07Å; L144-N147 VanDerWaalsContact O-N 3.09Å; L144-N147 VanDerWaalsContact O-O 3.09Å; L144-A150 HydrophobicContact CD1-CB 4.24Å; L144-A151 HydrophobicContact CD1-CB 4.13Å; L144-A151 HydrophobicContact CD2-CB 4.45Å; L144-A151 HydrophobicContact CG-CB 3.86Å; L144-F154 HydrophobicContact CD1-CB 4.41Å; L144-F154 HydrophobicContact CD2-CD1 3.7Å; L144-F154 HydrophobicContact CD2-CE1 4.27Å; L144-F154 HydrophobicContact CD2-CG 4.46Å; L144-Y170 HydrophobicContact CD2-CD1 3.92Å; L144-Y170 HydrophobicContact CD2-CE1 4.17Å
145L86.9Confident89.3Confident80 Ų8048.3 Ų48.342%0.41926%0.259SS..Hα-helixtrans-60.2-29.5176.7-80.7164.6000113.1E141 L173 L174E141-L145 WeakPolarHBondContact O-CB 3.39Å; E141-L145 WeakPolarHBondContact O-CG 3.15Å; E141-L145 PolarHBondContact O-N 2.74Å; L145-L173 HydrophobicContact CD1-CD1 4.26Å; L145-L173 HydrophobicContact CD1-CD2 4.48Å; L145-L173 HydrophobicContact CD1-CG 4.28Å; L145-L173 HydrophobicContact CD2-CG 4.37Å; L145-L173 HydrophobicContact CG-CG 4.45Å; L145-L174 HydrophobicContact CD2-CD2 3.87Å; L145-L174 HydrophobicContact CG-CD2 4.42Å
146K87.8Confident89.2Confident163 Ų16349.2 Ų49.271%0.70926%0.264SS*.THydrogen-bonded Turntrans-82.5-11.4178.7-68.8177.1-178.2-176.90113.5N142 I143 L144N142-K146 WeakPolarHBondContact O-CG 3.45Å; I143-K146 PolarHBondContact O-N 3.14Å; L144-K146 PolarHBondContact O-N 2.89Å
147N88.2Confident89.2Confident12 Ų1248.8 Ų48.86%0.06425%0.254CS..  trans-132.293.7-178.8-170-46.3000110.8L112 N113 T116 L144 V149 A150 A151L112-N147 HydrophobicContact CD2-CB 3.82Å; L112-N147 HydrophobicContact CG-CB 4.47Å; N113-N147 PolarHBondContact OD1-ND2 3.44Å; T116-N147 PolarHBondContact OG1-ND2 3.19Å; L144-N147 CarbonylContact O-C 3.44Å; L144-N147 PolarHBondContact O-N 3.07Å; L144-N147 VanDerWaalsContact O-N 3.09Å; L144-N147 VanDerWaalsContact O-O 3.09Å; N147-V149 VanDerWaalsContact C-N 3.32Å; N147-V149 PolarHBondContact O-N 2.95Å; N147-V149 PolarHBondContact OD1-N 3.02Å; N147-A150 HydrophobicContact CB-CB 4.16Å; N147-A150 PolarHBondContact O-N 3.29Å; N147-A150 WeakPolarHBondContact OD1-CB 3.34Å; N147-A150 PolarHBondContact OD1-N 3.43Å; N147-A151 PolarHBondContact O-N 3.45Å
148S87.1Confident89.1Confident76 Ų7644.1 Ų44.153%0.53123%0.232SC..Hα-helixtrans-60.5-38.3-177.257.40000113A151 F152S148-A151 WeakPolarHBondContact O-CB 3.25Å; S148-A151 PolarHBondContact O-N 3.27Å; S148-F152 WeakPolarHBondContact O-CD2 3.33Å; S148-F152 PolarHBondContact O-N 2.97Å
149V87.6Confident88.9Confident64 Ų6448 Ų4839%0.38824%0.236SC..Hα-helixtrans-61.2-51.3179.5178.30000110.4T116 I124 N147 A151 F152 H153T116-V149 HydrophobicContact CG2-CB 4.11Å; T116-V149 HydrophobicContact CG2-CG1 4.02Å; I124-V149 HydrophobicContact CD1-CG1 4.39Å; N147-V149 VanDerWaalsContact C-N 3.32Å; N147-V149 PolarHBondContact O-N 2.95Å; N147-V149 PolarHBondContact OD1-N 3.02Å; V149-A151 VanDerWaalsContact C-N 3.29Å; V149-A151 PolarHBondContact O-N 3.39Å; V149-F152 PolarHBondContact O-N 2.98Å; V149-H153 PolarHBondContact O-CD2 3.43Å; V149-H153 VanDerWaalsContact O-CD2 3.28Å; V149-H153 PolarHBondContact O-N 3.15Å; V149-H153 VanDerWaalsContact O-N 3.1Å
150A92Very high88.6Confident0 Ų051.8 Ų51.80%026%0.255CS..Hα-helixtrans-59.3-41.5175.700000112L112 T116 I124 V128 L144 N147 F152 H153 F154L112-A150 HydrophobicContact CD1-CB 3.71Å; L112-A150 HydrophobicContact CD2-CB 3.83Å; L112-A150 HydrophobicContact CG-CB 3.94Å; T116-A150 HydrophobicContact CG2-CB 4Å; I124-A150 HydrophobicContact CG2-CB 4.45Å; V128-A150 HydrophobicContact CG2-CB 3.93Å; L144-A150 HydrophobicContact CD1-CB 4.24Å; N147-A150 HydrophobicContact CB-CB 4.16Å; N147-A150 PolarHBondContact O-N 3.29Å; N147-A150 WeakPolarHBondContact OD1-CB 3.34Å; N147-A150 PolarHBondContact OD1-N 3.43Å; A150-F152 PolarHBondContact O-N 3.46Å; A150-H153 PolarHBondContact O-N 2.78Å; A150-F154 WeakPolarHBondContact O-CB 3.21Å; A150-F154 PolarHBondContact O-N 3.4Å
151A90.7Very high88.3Confident3 Ų355 Ų553%0.02528%0.276CS..Hα-helixtrans-58.2-45.9176.300000112.1L144 N147 S148 V149 F154 L155 L174L144-A151 HydrophobicContact CD1-CB 4.13Å; L144-A151 HydrophobicContact CD2-CB 4.45Å; L144-A151 HydrophobicContact CG-CB 3.86Å; N147-A151 PolarHBondContact O-N 3.45Å; S148-A151 WeakPolarHBondContact O-CB 3.25Å; S148-A151 PolarHBondContact O-N 3.27Å; V149-A151 VanDerWaalsContact C-N 3.29Å; V149-A151 PolarHBondContact O-N 3.39Å; A151-F154 WeakPolarHBondContact O-CB 3.35Å; A151-F154 PolarHBondContact O-N 2.96Å; A151-L155 WeakPolarHBondContact O-CG 3.4Å; A151-L155 PolarHBondContact O-N 3.39Å; A151-L174 HydrophobicContact CB-CD1 3.79Å; A151-L174 HydrophobicContact CB-CD2 3.77Å; A151-L174 HydrophobicContact CB-CG 4.46Å
152F87.7Confident87.9Confident112 Ų11255.9 Ų55.949%0.49129%0.292SS..Hα-helixtrans-64.4-43.4177.6-75.3-63.5000113.1S148 V149 A150 F154 L155 N156 F176S148-F152 WeakPolarHBondContact O-CD2 3.33Å; S148-F152 PolarHBondContact O-N 2.97Å; V149-F152 PolarHBondContact O-N 2.98Å; A150-F152 PolarHBondContact O-N 3.46Å; F152-F154 VanDerWaalsContact C-N 3.28Å; F152-F154 PolarHBondContact O-N 3.41Å; F152-L155 PolarHBondContact O-N 3.19Å; F152-N156 WeakPolarHBondContact O-CB 3.15Å; F152-N156 PolarHBondContact O-N 3.07Å; F152-F176 HydrophobicContact CD1-CZ 4.11Å; F152-F176 AromaticContact CE1-CE1 3.7Å; F152-F176 HydrophobicContact CE1-CE1 3.7Å; F152-F176 HydrophobicContact CE1-CE2 4.38Å; F152-F176 AromaticContact CE1-CZ 3.28Å; F152-F176 HydrophobicContact CE1-CZ 3.28Å; F152-F176 HydrophobicContact CZ-CE1 4.08Å; F152-F176 AromaticContact CZ-CZ 3.68Å; F152-F176 HydrophobicContact CZ-CZ 3.68Å
153H89.2Confident87.7Confident55 Ų5554.7 Ų54.726%0.25528%0.284SS..Hα-helixtrans-60.5-40.9174.7-82.4-77.7000111.6G121 I124 V149 A150 N156 F157G121-H153 WeakPolarHBondContact CA-CE1 3.5Å; I124-H153 HydrophobicContact CB-CB 4.44Å; I124-H153 HydrophobicContact CG2-CB 3.66Å; V149-H153 PolarHBondContact O-CD2 3.43Å; V149-H153 VanDerWaalsContact O-CD2 3.28Å; V149-H153 PolarHBondContact O-N 3.15Å; V149-H153 VanDerWaalsContact O-N 3.1Å; A150-H153 PolarHBondContact O-N 2.78Å; H153-N156 PolarHBondContact O-N 2.81Å; H153-F157 WeakPolarHBondContact O-CB 3.25Å; H153-F157 PolarHBondContact O-N 3.39Å
154F91.7Very high87.3Confident1 Ų159.4 Ų59.40%0.00431%0.309CS..Hα-helixtrans-64-48176.8-171.9-123.4000112.7V128 F140 L144 A150 A151 F152 N156 F157 L158 Y170V128-F154 HydrophobicContact CG1-CB 3.91Å; V128-F154 HydrophobicContact CG1-CD2 3.49Å; V128-F154 VanDerWaalsContact CG1-CD2 3.49Å; V128-F154 HydrophobicContact CG1-CE2 4.21Å; V128-F154 HydrophobicContact CG1-CG 3.79Å; F140-F154 HydrophobicContact CE1-CD1 4.48Å; F140-F154 AromaticContact CE1-CE1 3.87Å; F140-F154 HydrophobicContact CE1-CE1 3.87Å; F140-F154 AromaticContact CE1-CZ 3.99Å; F140-F154 HydrophobicContact CE1-CZ 3.99Å; F140-F154 HydrophobicContact CZ-CD1 4.35Å; F140-F154 HydrophobicContact CZ-CE1 4.05Å; F140-F154 HydrophobicContact CZ-CE2 4.26Å; F140-F154 HydrophobicContact CZ-CZ 4.02Å; L144-F154 HydrophobicContact CD1-CB 4.41Å; L144-F154 HydrophobicContact CD2-CD1 3.7Å; L144-F154 HydrophobicContact CD2-CE1 4.27Å; L144-F154 HydrophobicContact CD2-CG 4.46Å; A150-F154 WeakPolarHBondContact O-CB 3.21Å; A150-F154 PolarHBondContact O-N 3.4Å; A151-F154 WeakPolarHBondContact O-CB 3.35Å; A151-F154 PolarHBondContact O-N 2.96Å; F152-F154 VanDerWaalsContact C-N 3.28Å; F152-F154 PolarHBondContact O-N 3.41Å; F154-N156 VanDerWaalsContact C-N 3.26Å; F154-N156 PolarHBondContact O-N 3.29Å; F154-F157 HydrophobicContact CD2-CD1 4.4Å; F154-F157 HydrophobicContact CE2-CD1 4.43Å; F154-F157 WeakPolarHBondContact O-CB 3.32Å; F154-F157 PolarHBondContact O-N 3.36Å; F154-F157 VanDerWaalsContact O-N 3.16Å; F154-L158 HydrophobicContact CD1-CD1 4.01Å; F154-L158 HydrophobicContact CE1-CD1 3.64Å; F154-L158 HydrophobicContact CE1-CG 4.3Å; F154-L158 HydrophobicContact CE2-CD1 4.49Å; F154-L158 HydrophobicContact CE2-CD2 4.21Å; F154-L158 HydrophobicContact CE2-CG 4.28Å; F154-L158 HydrophobicContact CZ-CD1 3.9Å; F154-L158 HydrophobicContact CZ-CD2 4.06Å; F154-L158 HydrophobicContact CZ-CG 4.14Å; F154-L158 WeakPolarHBondContact O-CG 3.27Å; F154-L158 PolarHBondContact O-N 2.98Å; F154-Y170 HydrophobicContact CD1-CD1 4.49Å; F154-Y170 HydrophobicContact CD1-CD2 4.48Å; F154-Y170 HydrophobicContact CD1-CG 4.34Å; F154-Y170 HydrophobicContact CE1-CD1 4.05Å; F154-Y170 AromaticContact CE1-CD2 3.59Å; F154-Y170 HydrophobicContact CE1-CD2 3.59Å; F154-Y170 HydrophobicContact CE1-CE1 4.06Å; F154-Y170 AromaticContact CE1-CE2 3.61Å; F154-Y170 HydrophobicContact CE1-CE2 3.61Å; F154-Y170 AromaticContact CE1-CG 3.83Å; F154-Y170 HydrophobicContact CE1-CG 3.83Å; F154-Y170 AromaticContact CE1-CZ 3.86Å; F154-Y170 HydrophobicContact CZ-CD2 4.38Å; F154-Y170 HydrophobicContact CZ-CE2 4.09Å
155L89.1Confident86.9Confident15 Ų1565 Ų658%0.07934%0.343CS..Hα-helixtrans-58.4-41.4175.2-68.1-178.9000111.3A151 F152 L158 R159 L167 M171 L174 F176A151-L155 WeakPolarHBondContact O-CG 3.4Å; A151-L155 PolarHBondContact O-N 3.39Å; F152-L155 PolarHBondContact O-N 3.19Å; L155-L158 PolarHBondContact O-N 3.46Å; L155-R159 WeakPolarHBondContact O-CB 3.4Å; L155-R159 PolarHBondContact O-N 3.44Å; L155-L167 HydrophobicContact CB-CD1 4.16Å; L155-L167 HydrophobicContact CD2-CD1 3.94Å; L155-L167 WeakPolarHBondContact O-CD1 3.41Å; L155-M171 HydrophobicContact CD1-CG 4.17Å; L155-M171 HydrophobicContact CD2-CG 3.83Å; L155-L174 HydrophobicContact CD1-CD1 3.75Å; L155-L174 HydrophobicContact CD2-CD1 4.09Å; L155-L174 HydrophobicContact CG-CD1 3.97Å; L155-F176 HydrophobicContact CD1-CD2 3.95Å; L155-F176 HydrophobicContact CD1-CE2 3.48Å; L155-F176 VanDerWaalsContact CD1-CE2 3.48Å; L155-F176 HydrophobicContact CD1-CZ 4.2Å
156N85.9Confident86.9Confident58 Ų5863.1 Ų63.131%0.3133%0.333SS..Hα-helixtrans-64-42.1176.7-165.443.5000112.2F152 H153 F154 R159 N160F152-N156 WeakPolarHBondContact O-CB 3.15Å; F152-N156 PolarHBondContact O-N 3.07Å; H153-N156 PolarHBondContact O-N 2.81Å; F154-N156 VanDerWaalsContact C-N 3.26Å; F154-N156 PolarHBondContact O-N 3.29Å; N156-R159 PolarHBondContact O-N 2.81Å; N156-R159 PolarHBondContact OD1-NE 3.35Å; N156-R159 PolarHBondContact OD1-NH2 2.88Å; N156-N160 WeakPolarHBondContact O-CB 3.17Å; N156-N160 PolarHBondContact O-N 3.47Å; N156-N160 PolarHBondContact O-ND2 3.37Å
157F89.2Confident86.6Confident51 Ų5156.4 Ų56.422%0.22431%0.305CS..Hα-helixtrans-59.7-46.6173.9168.5-101.6000112T125 N129 H153 F154 R159 N160 T161T125-F157 HydrophobicContact CG2-CB 3.7Å; T125-F157 HydrophobicContact CG2-CD2 3.47Å; T125-F157 VanDerWaalsContact CG2-CD2 3.47Å; T125-F157 HydrophobicContact CG2-CE2 4.22Å; T125-F157 HydrophobicContact CG2-CG 3.64Å; N129-F157 WeakPolarHBondContact ND2-CE1 3.38Å; N129-F157 VanDerWaalsContact ND2-CZ 3.28Å; N129-F157 WeakPolarHBondContact ND2-CZ 3.48Å; N129-F157 WeakPolarHBondContact OD1-CE1 3.36Å; H153-F157 WeakPolarHBondContact O-CB 3.25Å; H153-F157 PolarHBondContact O-N 3.39Å; F154-F157 HydrophobicContact CD2-CD1 4.4Å; F154-F157 HydrophobicContact CE2-CD1 4.43Å; F154-F157 WeakPolarHBondContact O-CB 3.32Å; F154-F157 PolarHBondContact O-N 3.36Å; F154-F157 VanDerWaalsContact O-N 3.16Å; F157-R159 VanDerWaalsContact C-N 3.32Å; F157-R159 PolarHBondContact O-N 2.93Å; F157-N160 PolarHBondContact O-N 2.94Å; F157-T161 HydrophobicContact CD2-CG2 3.9Å; F157-T161 HydrophobicContact CE2-CG2 3.54Å; F157-T161 HydrophobicContact CZ-CG2 3.89Å; F157-T161 WeakPolarHBondContact O-CB 3.23Å; F157-T161 WeakPolarHBondContact O-CG2 3.36Å; F157-T161 PolarHBondContact O-N 3.22Å; F157-T161 PolarHBondContact O-OG1 3.45Å
158L88.4Confident86.1Confident0 Ų063.1 Ų63.10%033%0.334CS..Hα-helixtrans-61.7-41.1177.3-66176.1000111.7F154 L155 T161 G162 Q163 D166 L167 Y170F154-L158 HydrophobicContact CD1-CD1 4.01Å; F154-L158 HydrophobicContact CE1-CD1 3.64Å; F154-L158 HydrophobicContact CE1-CG 4.3Å; F154-L158 HydrophobicContact CE2-CD1 4.49Å; F154-L158 HydrophobicContact CE2-CD2 4.21Å; F154-L158 HydrophobicContact CE2-CG 4.28Å; F154-L158 HydrophobicContact CZ-CD1 3.9Å; F154-L158 HydrophobicContact CZ-CD2 4.06Å; F154-L158 HydrophobicContact CZ-CG 4.14Å; F154-L158 WeakPolarHBondContact O-CG 3.27Å; F154-L158 PolarHBondContact O-N 2.98Å; L155-L158 PolarHBondContact O-N 3.46Å; L158-T161 PolarHBondContact O-OG1 3.33Å; L158-G162 PolarHBondContact O-N 3.49Å; L158-G162 VanDerWaalsContact O-N 3.12Å; L158-Q163 HydrophobicContact CB-CB 4.33Å; L158-Q163 HydrophobicContact CD2-CB 3.74Å; L158-Q163 HydrophobicContact CD2-CG 4.36Å; L158-Q163 PolarHBondContact O-N 3.46Å; L158-D166 HydrophobicContact CD1-CB 4.02Å; L158-D166 HydrophobicContact CD2-CB 4.03Å; L158-L167 HydrophobicContact CB-CB 4.05Å; L158-L167 HydrophobicContact CB-CD1 4.16Å; L158-Y170 HydrophobicContact CD1-CD2 3.98Å
159R85.2Confident86Confident150 Ų15064.1 Ų64.157%0.56633%0.326SS*.Hα-helixtrans-62.2-49.6175.1175.3171.452.7-170.4-7.3111.9L155 N156 F157 T161 G162 L167L155-R159 WeakPolarHBondContact O-CB 3.4Å; L155-R159 PolarHBondContact O-N 3.44Å; N156-R159 PolarHBondContact O-N 2.81Å; N156-R159 PolarHBondContact OD1-NE 3.35Å; N156-R159 PolarHBondContact OD1-NH2 2.88Å; F157-R159 VanDerWaalsContact C-N 3.32Å; F157-R159 PolarHBondContact O-N 2.93Å; R159-T161 VanDerWaalsContact C-N 3.31Å; R159-T161 PolarHBondContact O-N 2.93Å; R159-G162 PolarHBondContact O-N 3.31Å; R159-L167 HydrophobicContact CB-CD1 4.49Å; R159-L167 HydrophobicContact CB-CD2 4.02Å
160N82.3Confident85.9Confident118 Ų11861.2 Ų61.263%0.63131%0.308SS*.Hα-helixtrans-69.9-27.2-177.4-67.8-11.5000113N156 F157N156-N160 WeakPolarHBondContact O-CB 3.17Å; N156-N160 PolarHBondContact O-N 3.47Å; N156-N160 PolarHBondContact O-ND2 3.37Å; F157-N160 PolarHBondContact O-N 2.94Å
161T86.9Confident85.3Confident72 Ų7262.8 Ų62.844%0.44232%0.316SS..THydrogen-bonded Turntrans-91.2-1.7176.256.50000113.7F157 L158 R159 Q163F157-T161 HydrophobicContact CD2-CG2 3.9Å; F157-T161 HydrophobicContact CE2-CG2 3.54Å; F157-T161 HydrophobicContact CZ-CG2 3.89Å; F157-T161 WeakPolarHBondContact O-CB 3.23Å; F157-T161 WeakPolarHBondContact O-CG2 3.36Å; F157-T161 PolarHBondContact O-N 3.22Å; F157-T161 PolarHBondContact O-OG1 3.45Å; L158-T161 PolarHBondContact O-OG1 3.33Å; R159-T161 VanDerWaalsContact C-N 3.31Å; R159-T161 PolarHBondContact O-N 2.93Å; T161-Q163 VanDerWaalsContact C-N 3.31Å; T161-Q163 PolarHBondContact O-N 3.27Å; T161-Q163 PolarHBondContact OG1-NE2 3.14Å
162G80.4Confident84.7Confident48 Ų4870 Ų7050%0.49535%0.346SS..THydrogen-bonded Turntrans7218.5179.400000114.8L158 R159 L164L158-G162 PolarHBondContact O-N 3.49Å; L158-G162 VanDerWaalsContact O-N 3.12Å; R159-G162 PolarHBondContact O-N 3.31Å; G162-L164 PolarHBondContact O-N 3.3Å
163Q86.9Confident84.5Confident61 Ų6167.4 Ų67.429%0.28534%0.337SS..  trans-77.463176.6-71.1177.271.900111.1L158 T161 V165 D166 L167L158-Q163 HydrophobicContact CB-CB 4.33Å; L158-Q163 HydrophobicContact CD2-CB 3.74Å; L158-Q163 HydrophobicContact CD2-CG 4.36Å; L158-Q163 PolarHBondContact O-N 3.46Å; T161-Q163 VanDerWaalsContact C-N 3.31Å; T161-Q163 PolarHBondContact O-N 3.27Å; T161-Q163 PolarHBondContact OG1-NE2 3.14Å; Q163-V165 VanDerWaalsContact C-N 3.31Å; Q163-V165 PolarHBondContact O-N 3.13Å; Q163-D166 PolarHBondContact O-N 3.43Å; Q163-L167 WeakPolarHBondContact O-CB 3.46Å; Q163-L167 PolarHBondContact O-N 2.95Å
164L78.9Confident83.9Confident105 Ų10566.5 Ų66.555%0.5533%0.334SS..Hα-helixtrans-65.7-27.7-168.4-60.1-178.1000114.6G162 L167 K168G162-L164 PolarHBondContact O-N 3.3Å; L164-L167 HydrophobicContact CD2-CD2 4.31Å; L164-K168 VanDerWaalsContact O-CG 3.3Å; L164-K168 WeakPolarHBondContact O-CG 3.24Å; L164-K168 PolarHBondContact O-N 2.9Å
165V83.8Confident82.9Confident122 Ų12268.5 Ų68.574%0.73936%0.355SS*.Hα-helixtrans-68.9-50.9178.4177.60000110.1Q163 K168 R169Q163-V165 VanDerWaalsContact C-N 3.31Å; Q163-V165 PolarHBondContact O-N 3.13Å; V165-K168 PolarHBondContact O-N 3.5Å; V165-R169 PolarHBondContact O-N 2.95Å
166D86.1Confident81.8Confident39 Ų3971 Ų7121%0.20937%0.365CS..Hα-helixtrans-64.7-42.8177.3-68.7-19.1000110.8R132 L158 Q163 K168 R169 Y170R132-D166 IonicContact CZ-OD2 3.39Å; R132-D166 IonicContact NH1-OD2 2.72Å; R132-D166 IonicContact NH2-OD2 2.78Å; R132-D166 PolarHBondContact NH2-OD2 2.88Å; L158-D166 HydrophobicContact CD1-CB 4.02Å; L158-D166 HydrophobicContact CD2-CB 4.03Å; Q163-D166 PolarHBondContact O-N 3.43Å; D166-K168 VanDerWaalsContact C-N 3.31Å; D166-K168 PolarHBondContact O-N 3.39Å; D166-R169 WeakPolarHBondContact O-CB 3.19Å; D166-R169 PolarHBondContact O-N 3.24Å; D166-R169 VanDerWaalsContact O-N 3.07Å; D166-Y170 HydrophobicContact CB-CD2 4.33Å; D166-Y170 HydrophobicContact CB-CE2 4.43Å; D166-Y170 VanDerWaalsContact O-CD2 3.26Å; D166-Y170 WeakPolarHBondContact O-CD2 3.35Å; D166-Y170 PolarHBondContact O-N 3.34Å
167L82.7Confident80.4Confident22 Ų2273.2 Ų73.212%0.11538%0.376CS..Hα-helixtrans-52.8-51177.417963.5000111L155 L158 R159 Q163 L164 R169 Y170 M171L155-L167 HydrophobicContact CB-CD1 4.16Å; L155-L167 HydrophobicContact CD2-CD1 3.94Å; L155-L167 WeakPolarHBondContact O-CD1 3.41Å; L158-L167 HydrophobicContact CB-CB 4.05Å; L158-L167 HydrophobicContact CB-CD1 4.16Å; R159-L167 HydrophobicContact CB-CD1 4.49Å; R159-L167 HydrophobicContact CB-CD2 4.02Å; Q163-L167 WeakPolarHBondContact O-CB 3.46Å; Q163-L167 PolarHBondContact O-N 2.95Å; L164-L167 HydrophobicContact CD2-CD2 4.31Å; L167-R169 VanDerWaalsContact C-N 3.33Å; L167-R169 PolarHBondContact O-N 3.42Å; L167-Y170 PolarHBondContact O-N 3.13Å; L167-M171 HydrophobicContact CD1-CG 4.1Å; L167-M171 HydrophobicContact CD1-SD 3.83Å; L167-M171 HydrophobicContact CD2-SD 4.44Å; L167-M171 HydrophobicContact CG-CG 4.41Å; L167-M171 HydrophobicContact CG-SD 3.76Å; L167-M171 WeakPolarHBondContact O-CB 3.29Å; L167-M171 WeakPolarHBondContact O-CG 3.32Å; L167-M171 PolarHBondContact O-N 3.13Å
168K76.8Confident78.7Confident154 Ų15475.3 Ų75.367%0.6739%0.385SS*.Hα-helixtrans-60.6-41178.4-74.6176-178.5-177.10112.5L164 V165 D166 K172L164-K168 VanDerWaalsContact O-CG 3.3Å; L164-K168 WeakPolarHBondContact O-CG 3.24Å; L164-K168 PolarHBondContact O-N 2.9Å; V165-K168 PolarHBondContact O-N 3.5Å; D166-K168 VanDerWaalsContact C-N 3.31Å; D166-K168 PolarHBondContact O-N 3.39Å; K168-K172 WeakPolarHBondContact O-CB 3.49Å; K168-K172 PolarHBondContact O-N 2.77Å; K168-K172 VanDerWaalsContact O-N 3.13Å
169R85.2Confident76.9Confident97 Ų9778.4 Ų78.437%0.36640%0.4SS..Hα-helixtrans-61.9-53.8177.8177-171.3172.7153.63.5111.1E137 E141 V165 D166 L167 M171 K172 L173E137-R169 IonicContact OE1-CZ 2.68Å; E137-R169 IonicContact OE1-NH1 3.75Å; E137-R169 PolarHBondContact OE1-NH1 2.97Å; E137-R169 IonicContact OE1-NH2 3.48Å; E137-R169 PolarHBondContact OE1-NH2 3.02Å; E137-R169 VanDerWaalsContact OE1-NH2 3.16Å; E137-R169 IonicContact OE2-CZ 3.04Å; E137-R169 IonicContact OE2-NH1 3.97Å; E137-R169 PolarHBondContact OE2-NH1 3.3Å; E137-R169 VanDerWaalsContact OE2-NH1 3.15Å; E137-R169 IonicContact OE2-NH2 3.57Å; E137-R169 PolarHBondContact OE2-NH2 3.4Å; E141-R169 IonicContact OE1-CZ 2.66Å; E141-R169 VanDerWaalsContact OE1-CZ 3.32Å; E141-R169 IonicContact OE1-NE 3.79Å; E141-R169 PolarHBondContact OE1-NE 3.19Å; E141-R169 IonicContact OE1-NH2 2.69Å; E141-R169 PolarHBondContact OE1-NH2 2.82Å; V165-R169 PolarHBondContact O-N 2.95Å; D166-R169 WeakPolarHBondContact O-CB 3.19Å; D166-R169 PolarHBondContact O-N 3.24Å; D166-R169 VanDerWaalsContact O-N 3.07Å; L167-R169 VanDerWaalsContact C-N 3.33Å; L167-R169 PolarHBondContact O-N 3.42Å; R169-M171 PolarHBondContact O-N 3.03Å; R169-K172 WeakPolarHBondContact O-CB 3.34Å; R169-K172 PolarHBondContact O-N 2.7Å; R169-L173 PolarHBondContact O-N 3.38Å
170Y85.7Confident75.1Confident3 Ų376.2 Ų76.21%0.01241%0.407CS..Hα-helixtrans-69.4-34-176.7-76.7-77.6000112.4F140 E141 L144 F154 L158 D166 L167 K172 L173 L174F140-Y170 HydrophobicContact CD1-CE1 4.1Å; F140-Y170 WeakPolarHBondContact CD1-OH 3.44Å; F140-Y170 AromaticContact CE1-CE1 3.81Å; F140-Y170 HydrophobicContact CE1-CE1 3.81Å; F140-Y170 AromaticContact CE1-CZ 3.79Å; F140-Y170 WeakPolarHBondContact CE1-OH 3.18Å; E141-Y170 HydrophobicContact CG-CE1 3.87Å; L144-Y170 HydrophobicContact CD2-CD1 3.92Å; L144-Y170 HydrophobicContact CD2-CE1 4.17Å; F154-Y170 HydrophobicContact CD1-CD1 4.49Å; F154-Y170 HydrophobicContact CD1-CD2 4.48Å; F154-Y170 HydrophobicContact CD1-CG 4.34Å; F154-Y170 HydrophobicContact CE1-CD1 4.05Å; F154-Y170 AromaticContact CE1-CD2 3.59Å; F154-Y170 HydrophobicContact CE1-CD2 3.59Å; F154-Y170 HydrophobicContact CE1-CE1 4.06Å; F154-Y170 AromaticContact CE1-CE2 3.61Å; F154-Y170 HydrophobicContact CE1-CE2 3.61Å; F154-Y170 AromaticContact CE1-CG 3.83Å; F154-Y170 HydrophobicContact CE1-CG 3.83Å; F154-Y170 AromaticContact CE1-CZ 3.86Å; F154-Y170 HydrophobicContact CZ-CD2 4.38Å; F154-Y170 HydrophobicContact CZ-CE2 4.09Å; L158-Y170 HydrophobicContact CD1-CD2 3.98Å; D166-Y170 HydrophobicContact CB-CD2 4.33Å; D166-Y170 HydrophobicContact CB-CE2 4.43Å; D166-Y170 VanDerWaalsContact O-CD2 3.26Å; D166-Y170 WeakPolarHBondContact O-CD2 3.35Å; D166-Y170 PolarHBondContact O-N 3.34Å; L167-Y170 PolarHBondContact O-N 3.13Å; Y170-K172 VanDerWaalsContact C-N 3.31Å; Y170-K172 PolarHBondContact O-N 3.2Å; Y170-L173 HydrophobicContact CD1-CD2 3.97Å; Y170-L173 HydrophobicContact CE1-CD2 4.25Å; Y170-L173 PolarHBondContact O-N 3.45Å; Y170-L174 WeakPolarHBondContact O-CB 3.38Å; Y170-L174 WeakPolarHBondContact O-CD1 3.44Å; Y170-L174 VanDerWaalsContact O-CG 3.23Å; Y170-L174 WeakPolarHBondContact O-CG 3.28Å; Y170-L174 PolarHBondContact O-N 2.79Å
171M78.9Confident73.9Confident33 Ų3376.2 Ų76.216%0.16340%0.404CS..Hα-helixtrans-59.4-44171.1-73.117779.400111.5L155 L167 R169 G175 F176 E179L155-M171 HydrophobicContact CD1-CG 4.17Å; L155-M171 HydrophobicContact CD2-CG 3.83Å; L167-M171 HydrophobicContact CD1-CG 4.1Å; L167-M171 HydrophobicContact CD1-SD 3.83Å; L167-M171 HydrophobicContact CD2-SD 4.44Å; L167-M171 HydrophobicContact CG-CG 4.41Å; L167-M171 HydrophobicContact CG-SD 3.76Å; L167-M171 WeakPolarHBondContact O-CB 3.29Å; L167-M171 WeakPolarHBondContact O-CG 3.32Å; L167-M171 PolarHBondContact O-N 3.13Å; R169-M171 PolarHBondContact O-N 3.03Å; M171-G175 PolarHBondContact O-N 2.67Å; M171-F176 HydrophobicContact CB-CB 4.21Å; M171-F176 HydrophobicContact CB-CD2 4.45Å; M171-F176 HydrophobicContact CE-CB 4.5Å; M171-F176 WeakPolarHBondContact O-CB 3.48Å; M171-F176 PolarHBondContact O-N 3.07Å; M171-E179 HydrophobicContact CE-CG 4.21Å; M171-E179 VanDerWaalsContact CE-OE1 3.29Å; M171-E179 WeakPolarHBondContact CE-OE1 3.2Å; M171-E179 VanDerWaalsContact CE-OE2 3.25Å; M171-E179 WeakPolarHBondContact CE-OE2 3.42Å
172K78.5Confident72.8Confident153 Ų15375 Ų7567%0.66539%0.394SS*.Hα-helixtrans-63.4-44.2175.7-174.2-176.5177.1-171.60111.8K168 R169 Y170 G175K168-K172 WeakPolarHBondContact O-CB 3.49Å; K168-K172 PolarHBondContact O-N 2.77Å; K168-K172 VanDerWaalsContact O-N 3.13Å; R169-K172 WeakPolarHBondContact O-CB 3.34Å; R169-K172 PolarHBondContact O-N 2.7Å; Y170-K172 VanDerWaalsContact C-N 3.31Å; Y170-K172 PolarHBondContact O-N 3.2Å; K172-G175 PolarHBondContact O-N 3.11Å
173L82.2Confident72.3Confident58 Ų5876.5 Ų76.530%0.30440%0.397SS..Hα-helixtrans-60.5-45.4179.1179.972.2000112.1E141 L145 R169 Y170 G175E141-L173 HydrophobicContact CB-CD2 3.75Å; E141-L173 HydrophobicContact CG-CD2 3.47Å; E141-L173 VanDerWaalsContact CG-CD2 3.47Å; L145-L173 HydrophobicContact CD1-CD1 4.26Å; L145-L173 HydrophobicContact CD1-CD2 4.48Å; L145-L173 HydrophobicContact CD1-CG 4.28Å; L145-L173 HydrophobicContact CD2-CG 4.37Å; L145-L173 HydrophobicContact CG-CG 4.45Å; R169-L173 PolarHBondContact O-N 3.38Å; Y170-L173 HydrophobicContact CD1-CD2 3.97Å; Y170-L173 HydrophobicContact CE1-CD2 4.25Å; Y170-L173 PolarHBondContact O-N 3.45Å; L173-G175 PolarHBondContact O-N 2.97Å; L173-G175 VanDerWaalsContact O-N 3.14Å
174L78.4Confident71.6Confident37 Ų3774 Ų7419%0.19439%0.386CS..THydrogen-bonded Turntrans-76.16-179.1-65.6164000113L145 A151 L155 Y170 F176L145-L174 HydrophobicContact CD2-CD2 3.87Å; L145-L174 HydrophobicContact CG-CD2 4.42Å; A151-L174 HydrophobicContact CB-CD1 3.79Å; A151-L174 HydrophobicContact CB-CD2 3.77Å; A151-L174 HydrophobicContact CB-CG 4.46Å; L155-L174 HydrophobicContact CD1-CD1 3.75Å; L155-L174 HydrophobicContact CD2-CD1 4.09Å; L155-L174 HydrophobicContact CG-CD1 3.97Å; Y170-L174 WeakPolarHBondContact O-CB 3.38Å; Y170-L174 WeakPolarHBondContact O-CD1 3.44Å; Y170-L174 VanDerWaalsContact O-CG 3.23Å; Y170-L174 WeakPolarHBondContact O-CG 3.28Å; Y170-L174 PolarHBondContact O-N 2.79Å; L174-F176 VanDerWaalsContact C-N 3.34Å; L174-F176 HydrophobicContact CB-CD2 3.59Å; L174-F176 HydrophobicContact CB-CE2 3.46Å; L174-F176 VanDerWaalsContact CB-CE2 3.46Å; L174-F176 HydrophobicContact CD1-CD2 4.45Å; L174-F176 HydrophobicContact CD1-CE2 3.91Å; L174-F176 HydrophobicContact CG-CE2 4.32Å; L174-F176 PolarHBondContact O-N 3.35Å
175G69.7Low71.2Confident43 Ų4371.6 Ų71.644%0.44337%0.37SS..THydrogen-bonded Turntrans75.817.5176.400000114.4M171 K172 L173 I177M171-G175 PolarHBondContact O-N 2.67Å; K172-G175 PolarHBondContact O-N 3.11Å; L173-G175 PolarHBondContact O-N 2.97Å; L173-G175 VanDerWaalsContact O-N 3.14Å; G175-I177 PolarHBondContact O-N 3.08Å
176F65.5Low70.6Confident67 Ų6768.4 Ų68.429%0.29435%0.353SS..  trans-73.241.5169.9-62.3-76.6000111.8F152 L155 M171 L174 K178F152-F176 HydrophobicContact CD1-CZ 4.11Å; F152-F176 AromaticContact CE1-CE1 3.7Å; F152-F176 HydrophobicContact CE1-CE1 3.7Å; F152-F176 HydrophobicContact CE1-CE2 4.38Å; F152-F176 AromaticContact CE1-CZ 3.28Å; F152-F176 HydrophobicContact CE1-CZ 3.28Å; F152-F176 HydrophobicContact CZ-CE1 4.08Å; F152-F176 AromaticContact CZ-CZ 3.68Å; F152-F176 HydrophobicContact CZ-CZ 3.68Å; L155-F176 HydrophobicContact CD1-CD2 3.95Å; L155-F176 HydrophobicContact CD1-CE2 3.48Å; L155-F176 VanDerWaalsContact CD1-CE2 3.48Å; L155-F176 HydrophobicContact CD1-CZ 4.2Å; M171-F176 HydrophobicContact CB-CB 4.21Å; M171-F176 HydrophobicContact CB-CD2 4.45Å; M171-F176 HydrophobicContact CE-CB 4.5Å; M171-F176 WeakPolarHBondContact O-CB 3.48Å; M171-F176 PolarHBondContact O-N 3.07Å; L174-F176 VanDerWaalsContact C-N 3.34Å; L174-F176 HydrophobicContact CB-CD2 3.59Å; L174-F176 HydrophobicContact CB-CE2 3.46Å; L174-F176 VanDerWaalsContact CB-CE2 3.46Å; L174-F176 HydrophobicContact CD1-CD2 4.45Å; L174-F176 HydrophobicContact CD1-CE2 3.91Å; L174-F176 HydrophobicContact CG-CE2 4.32Å; L174-F176 PolarHBondContact O-N 3.35Å; F176-K178 PolarHBondContact O-N 3.22Å
177I56.5Low70.3Confident105 Ų10571 Ų7154%0.53836%0.364SS..THydrogen-bonded Turntrans-25.3106.6-172.1-66.8170.6000111.6G175 E179G175-I177 PolarHBondContact O-N 3.08Å; I177-E179 PolarHBondContact O-N 2.9Å
178K54.8Low70.2Confident94 Ų9470.3 Ų70.341%0.40936%0.36SS..THydrogen-bonded Turntrans34.864.5163.2-67.4143.8153.5-137.20114.2F176 S180 E181 I182F176-K178 PolarHBondContact O-N 3.22Å; K178-S180 PolarHBondContact O-N 3.17Å; K178-E181 HydrophobicContact CB-CB 3.71Å; K178-E181 HydrophobicContact CB-CG 3.76Å; K178-E181 HydrophobicContact CD-CG 4.25Å; K178-E181 VanDerWaalsContact CD-OE1 3.27Å; K178-E181 WeakPolarHBondContact CD-OE1 3.42Å; K178-E181 WeakPolarHBondContact CD-OE2 3.45Å; K178-E181 VanDerWaalsContact CE-CD 3.4Å; K178-E181 WeakPolarHBondContact CE-OE1 3.4Å; K178-E181 WeakPolarHBondContact CE-OE2 3.4Å; K178-E181 HydrophobicContact CG-CG 4.1Å; K178-E181 WeakPolarHBondContact CG-OE2 3.41Å; K178-E181 IonicContact NZ-OE1 2.64Å; K178-E181 PolarHBondContact NZ-OE1 3.17Å; K178-E181 IonicContact NZ-OE2 3.15Å; K178-E181 PolarHBondContact NZ-OE2 3.29Å; K178-E181 PolarHBondContact O-N 2.87Å; K178-I182 PolarHBondContact O-N 3.2Å
179E49.3Very low70.2Confident66 Ų6666.5 Ų66.531%0.30835%0.346SS..THydrogen-bonded Turntrans-46.7-29.1161.7-72.6-178.3-174.600112.1M171 I177 Y185M171-E179 HydrophobicContact CE-CG 4.21Å; M171-E179 VanDerWaalsContact CE-OE1 3.29Å; M171-E179 WeakPolarHBondContact CE-OE1 3.2Å; M171-E179 VanDerWaalsContact CE-OE2 3.25Å; M171-E179 WeakPolarHBondContact CE-OE2 3.42Å; I177-E179 PolarHBondContact O-N 2.9Å; E179-Y185 HydrophobicContact CB-CD1 3.72Å; E179-Y185 HydrophobicContact CB-CE1 3.63Å; E179-Y185 VanDerWaalsContact CD-CE1 3.42Å; E179-Y185 HydrophobicContact CG-CD1 4Å; E179-Y185 HydrophobicContact CG-CE1 3.57Å; E179-Y185 PolarHBondContact OE1-OH 3.32Å; E179-Y185 VanDerWaalsContact OE2-CE1 3.27Å; E179-Y185 WeakPolarHBondContact OE2-CE1 3.23Å; E179-Y185 PolarHBondContact OE2-OH 3.27Å
180S47.7Very low69.9Low103 Ų10367 Ų6772%0.7235%0.352SS*.THydrogen-bonded Turntrans-72.1-17.8174.660.90000115.9K178K178-S180 PolarHBondContact O-N 3.17Å
181E57.2Low69.9Low119 Ų11969.9 Ų69.956%0.55637%0.365SS*.THydrogen-bonded Turntrans-97.8-15.3177.8-71176.535.800112.5K178 S183K178-E181 HydrophobicContact CB-CB 3.71Å; K178-E181 HydrophobicContact CB-CG 3.76Å; K178-E181 HydrophobicContact CD-CG 4.25Å; K178-E181 VanDerWaalsContact CD-OE1 3.27Å; K178-E181 WeakPolarHBondContact CD-OE1 3.42Å; K178-E181 WeakPolarHBondContact CD-OE2 3.45Å; K178-E181 VanDerWaalsContact CE-CD 3.4Å; K178-E181 WeakPolarHBondContact CE-OE1 3.4Å; K178-E181 WeakPolarHBondContact CE-OE2 3.4Å; K178-E181 HydrophobicContact CG-CG 4.1Å; K178-E181 WeakPolarHBondContact CG-OE2 3.41Å; K178-E181 IonicContact NZ-OE1 2.64Å; K178-E181 PolarHBondContact NZ-OE1 3.17Å; K178-E181 IonicContact NZ-OE2 3.15Å; K178-E181 PolarHBondContact NZ-OE2 3.29Å; K178-E181 PolarHBondContact O-N 2.87Å; E181-S183 PolarHBondContact O-N 3.25Å; E181-S183 VanDerWaalsContact O-N 3.14Å
182I63.2Low70.1Confident46 Ų4668.9 Ų68.924%0.23636%0.36CS..  trans-8491.6174-55178.2000107.6K178 S184 Y185 S186 E214K178-I182 PolarHBondContact O-N 3.2Å; I182-S184 WeakPolarHBondContact CG2-OG 3.44Å; I182-S184 PolarHBondContact O-N 3.41Å; I182-S184 VanDerWaalsContact O-N 3.16Å; I182-Y185 WeakPolarHBondContact O-CB 3.27Å; I182-Y185 PolarHBondContact O-N 2.97Å; I182-S186 PolarHBondContact O-N 2.73Å; I182-S186 VanDerWaalsContact O-N 3.12Å; I182-E214 WeakPolarHBondContact CG2-OE2 3.16Å
183S69.8Low70Confident79 Ų7968.1 Ų68.155%0.55236%0.36SS*.Hα-helixtrans-56.4-32.7-177.169.50000112.9E181 Q187E181-S183 PolarHBondContact O-N 3.25Å; E181-S183 VanDerWaalsContact O-N 3.14Å; S183-Q187 WeakPolarHBondContact O-CG 3.25Å; S183-Q187 PolarHBondContact O-N 3.07Å; S183-Q187 VanDerWaalsContact O-N 3.17Å
184S72.5Confident70Confident9 Ų971.3 Ų71.36%0.06338%0.378CS..Hα-helixtrans-68.3-39.1177.580.50000111.8I182 Q187 L188 Y206 I210 E214I182-S184 WeakPolarHBondContact CG2-OG 3.44Å; I182-S184 PolarHBondContact O-N 3.41Å; I182-S184 VanDerWaalsContact O-N 3.16Å; S184-Q187 CarbonylContact O-C 3.57Å; S184-Q187 WeakPolarHBondContact O-CB 3.43Å; S184-Q187 PolarHBondContact O-N 2.86Å; S184-L188 PolarHBondContact O-N 3.33Å; S184-Y206 WeakPolarHBondContact CA-OH 3.28Å; S184-Y206 WeakPolarHBondContact O-CE1 3.46Å; S184-Y206 PolarHBondContact O-OH 2.87Å; S184-I210 WeakPolarHBondContact O-CD1 3.47Å; S184-E214 WeakPolarHBondContact CB-OE1 3.47Å; S184-E214 PolarHBondContact OG-OE1 3.01Å; S184-E214 PolarHBondContact OG-OE2 3.35Å
185Y70.2Confident70.4Confident55 Ų5570.9 Ų70.922%0.21638%0.376CS..Hα-helixtrans-69.1-41.5-179.9-176.3-96.6000110.6E179 I182 Q187 L188 M189E179-Y185 HydrophobicContact CB-CD1 3.72Å; E179-Y185 HydrophobicContact CB-CE1 3.63Å; E179-Y185 VanDerWaalsContact CD-CE1 3.42Å; E179-Y185 HydrophobicContact CG-CD1 4Å; E179-Y185 HydrophobicContact CG-CE1 3.57Å; E179-Y185 PolarHBondContact OE1-OH 3.32Å; E179-Y185 VanDerWaalsContact OE2-CE1 3.27Å; E179-Y185 WeakPolarHBondContact OE2-CE1 3.23Å; E179-Y185 PolarHBondContact OE2-OH 3.27Å; I182-Y185 WeakPolarHBondContact O-CB 3.27Å; I182-Y185 PolarHBondContact O-N 2.97Å; Y185-Q187 VanDerWaalsContact C-N 3.3Å; Y185-Q187 PolarHBondContact O-N 2.86Å; Y185-L188 HydrophobicContact CD2-CD2 4.41Å; Y185-L188 WeakPolarHBondContact O-CB 3.29Å; Y185-L188 PolarHBondContact O-N 2.85Å; Y185-L188 VanDerWaalsContact O-N 3.11Å; Y185-M189 HydrophobicContact CD1-CG 4.08Å; Y185-M189 HydrophobicContact CE1-CG 3.73Å; Y185-M189 HydrophobicContact CE1-SD 4.25Å; Y185-M189 WeakPolarHBondContact O-CG 3.45Å; Y185-M189 PolarHBondContact O-N 3.45Å
186S70.8Confident71.2Confident55 Ų5571.3 Ų71.339%0.38537%0.372SS..Hα-helixtrans-57.3-43.6170.9-178.20000111.9I182 M189 Q190I182-S186 PolarHBondContact O-N 2.73Å; I182-S186 VanDerWaalsContact O-N 3.12Å; S186-M189 PolarHBondContact O-N 3.22Å; S186-Q190 WeakPolarHBondContact O-CG 3.28Å; S186-Q190 PolarHBondContact O-N 3.11Å; S186-Q190 VanDerWaalsContact O-N 3.1Å
187Q80.1Confident72Confident94 Ų9471.4 Ų71.444%0.43938%0.381SS..Hα-helixtrans-66.3-37.4174.4-711744600112.5S183 S184 Y185 Q190 K191 Y206S183-Q187 WeakPolarHBondContact O-CG 3.25Å; S183-Q187 PolarHBondContact O-N 3.07Å; S183-Q187 VanDerWaalsContact O-N 3.17Å; S184-Q187 CarbonylContact O-C 3.57Å; S184-Q187 WeakPolarHBondContact O-CB 3.43Å; S184-Q187 PolarHBondContact O-N 2.86Å; Y185-Q187 VanDerWaalsContact C-N 3.3Å; Y185-Q187 PolarHBondContact O-N 2.86Å; Q187-Q190 PolarHBondContact O-N 3.18Å; Q187-K191 WeakPolarHBondContact O-CG 2.96Å; Q187-K191 PolarHBondContact O-N 3.28Å; Q187-Y206 HydrophobicContact CB-CE1 4.16Å; Q187-Y206 WeakPolarHBondContact CB-OH 3.37Å; Q187-Y206 PolarHBondContact OE1-OH 2.87Å
188L80.5Confident73.3Confident7 Ų769.7 Ų69.74%0.03739%0.389CS..Hα-helixtrans-62.1-47.9175.8173.561.4000110.4S184 Y185 Q190 K191 L192 V203 Y206 I207 I210S184-L188 PolarHBondContact O-N 3.33Å; Y185-L188 HydrophobicContact CD2-CD2 4.41Å; Y185-L188 WeakPolarHBondContact O-CB 3.29Å; Y185-L188 PolarHBondContact O-N 2.85Å; Y185-L188 VanDerWaalsContact O-N 3.11Å; L188-Q190 VanDerWaalsContact C-N 3.28Å; L188-Q190 PolarHBondContact O-N 3.34Å; L188-K191 WeakPolarHBondContact O-CB 3.21Å; L188-K191 PolarHBondContact O-N 3.05Å; L188-L192 HydrophobicContact CD1-CD1 3.95Å; L188-L192 HydrophobicContact CD1-CG 3.99Å; L188-L192 HydrophobicContact CD2-CD1 4.41Å; L188-L192 HydrophobicContact CG-CD1 3.79Å; L188-L192 HydrophobicContact CG-CG 4.28Å; L188-L192 WeakPolarHBondContact O-CG 3.27Å; L188-L192 PolarHBondContact O-N 2.92Å; L188-V203 HydrophobicContact CD1-CG1 4.23Å; L188-Y206 HydrophobicContact CB-CD1 4.08Å; L188-Y206 HydrophobicContact CB-CE1 3.84Å; L188-Y206 HydrophobicContact CD1-CD1 3.98Å; L188-I207 HydrophobicContact CD1-CD1 4.24Å; L188-I207 HydrophobicContact CD1-CG1 3.39Å; L188-I207 HydrophobicContact CD2-CG1 4.18Å; L188-I207 HydrophobicContact CG-CG1 4.42Å; L188-I210 HydrophobicContact CB-CD1 3.67Å; L188-I210 HydrophobicContact CD2-CD1 3.98Å; L188-I210 HydrophobicContact CG-CD1 4.31Å
189M77.7Confident74.9Confident73 Ų7369.8 Ų69.836%0.3639%0.391SS..Hα-helixtrans-59.7-39.6177.1-69.6-54.7-61.600111.7Y185 S186 L192 M193Y185-M189 HydrophobicContact CD1-CG 4.08Å; Y185-M189 HydrophobicContact CE1-CG 3.73Å; Y185-M189 HydrophobicContact CE1-SD 4.25Å; Y185-M189 WeakPolarHBondContact O-CG 3.45Å; Y185-M189 PolarHBondContact O-N 3.45Å; S186-M189 PolarHBondContact O-N 3.22Å; M189-L192 PolarHBondContact O-N 3.38Å; M189-L192 HydrophobicContact SD-CD1 4.16Å; M189-M193 WeakPolarHBondContact O-CB 3.16Å; M189-M193 VanDerWaalsContact O-CG 3.27Å; M189-M193 WeakPolarHBondContact O-CG 2.93Å; M189-M193 PolarHBondContact O-N 3.36Å
190Q78.8Confident76.8Confident108 Ų10866.7 Ų66.751%0.50538%0.376SS..Hα-helixtrans-63.7-40.1173.4-71.3177.42200113S186 Q187 L188 M193 N194S186-Q190 WeakPolarHBondContact O-CG 3.28Å; S186-Q190 PolarHBondContact O-N 3.11Å; S186-Q190 VanDerWaalsContact O-N 3.1Å; Q187-Q190 PolarHBondContact O-N 3.18Å; L188-Q190 VanDerWaalsContact C-N 3.28Å; L188-Q190 PolarHBondContact O-N 3.34Å; Q190-M193 HydrophobicContact CG-CE 4.23Å; Q190-N194 PolarHBondContact O-N 3.25Å; Q190-N194 PolarHBondContact O-ND2 3.36Å
191K85.2Confident78.8Confident64 Ų6467.4 Ų67.428%0.27837%0.372SS..Hα-helixtrans-65.4-43174.9-76180177.1-700111.8Q187 L188 N194 L195 E202 V203 Y206Q187-K191 WeakPolarHBondContact O-CG 2.96Å; Q187-K191 PolarHBondContact O-N 3.28Å; L188-K191 WeakPolarHBondContact O-CB 3.21Å; L188-K191 PolarHBondContact O-N 3.05Å; K191-N194 CarbonylContact O-C 3.56Å; K191-N194 PolarHBondContact O-N 3.39Å; K191-L195 PolarHBondContact O-N 3.09Å; K191-E202 IonicContact NZ-OE1 3.67Å; K191-E202 PolarHBondContact NZ-OE1 3.46Å; K191-V203 HydrophobicContact CB-CG2 3.94Å; K191-Y206 HydrophobicContact CD-CD1 3.78Å; K191-Y206 HydrophobicContact CD-CE1 4.24Å; K191-Y206 HydrophobicContact CD-CG 4.03Å
192L83.4Confident80.3Confident11 Ų1166.4 Ų66.46%0.05837%0.368CS..Hα-helixtrans-66.2-40.1178.3-69.5169.5000112.5L188 M189 N194 L195 V203 I207 L231 L235 M271L188-L192 HydrophobicContact CD1-CD1 3.95Å; L188-L192 HydrophobicContact CD1-CG 3.99Å; L188-L192 HydrophobicContact CD2-CD1 4.41Å; L188-L192 HydrophobicContact CG-CD1 3.79Å; L188-L192 HydrophobicContact CG-CG 4.28Å; L188-L192 WeakPolarHBondContact O-CG 3.27Å; L188-L192 PolarHBondContact O-N 2.92Å; M189-L192 PolarHBondContact O-N 3.38Å; M189-L192 HydrophobicContact SD-CD1 4.16Å; L192-N194 PolarHBondContact O-N 3.13Å; L192-L195 VanDerWaalsContact O-CB 3.26Å; L192-L195 WeakPolarHBondContact O-CB 2.73Å; L192-L195 PolarHBondContact O-N 2.96Å; L192-V203 HydrophobicContact CD2-CG1 3.65Å; L192-V203 HydrophobicContact CG-CG1 4.28Å; L192-I207 HydrophobicContact CD2-CD1 4.42Å; L192-L231 HydrophobicContact CD1-CD2 4.17Å; L192-L231 HydrophobicContact CD2-CD2 4.39Å; L192-L235 HydrophobicContact CD2-CD1 3.99Å; L192-M271 HydrophobicContact CB-CE 4Å; L192-M271 HydrophobicContact CB-SD 4.18Å; L192-M271 HydrophobicContact CD1-CE 4.48Å; L192-M271 HydrophobicContact CD2-CE 4.15Å; L192-M271 HydrophobicContact CD2-SD 3.56Å; L192-M271 VanDerWaalsContact CD2-SD 3.56Å; L192-M271 HydrophobicContact CG-CE 4.44Å; L192-M271 HydrophobicContact CG-SD 4.39Å
193M76.9Confident81.5Confident137 Ų13764.4 Ų64.468%0.67536%0.358SS*.Hα-helixtrans-63.8-25.7177-76.2-171.4-60.300113.4M189 Q190M189-M193 WeakPolarHBondContact O-CB 3.16Å; M189-M193 VanDerWaalsContact O-CG 3.27Å; M189-M193 WeakPolarHBondContact O-CG 2.93Å; M189-M193 PolarHBondContact O-N 3.36Å; Q190-M193 HydrophobicContact CG-CE 4.23Å
194N81.1Confident82.4Confident126 Ų12661.2 Ų61.267%0.67433%0.334SS*.THydrogen-bonded Turntrans-108.620.3179.2-61.5-64000112.1Q190 K191 L192 S196Q190-N194 PolarHBondContact O-N 3.25Å; Q190-N194 PolarHBondContact O-ND2 3.36Å; K191-N194 CarbonylContact O-C 3.56Å; K191-N194 PolarHBondContact O-N 3.39Å; L192-N194 PolarHBondContact O-N 3.13Å; N194-S196 PolarHBondContact O-N 2.78Å
195L86.4Confident83.2Confident28 Ų2867.5 Ų67.515%0.14736%0.36CS..  trans-63.7136.3-175-169.969.9000110.9K191 L192 V200 V203 L235 L270 M271K191-L195 PolarHBondContact O-N 3.09Å; L192-L195 VanDerWaalsContact O-CB 3.26Å; L192-L195 WeakPolarHBondContact O-CB 2.73Å; L192-L195 PolarHBondContact O-N 2.96Å; L195-V200 HydrophobicContact CD1-CG2 4.12Å; L195-V200 HydrophobicContact CD2-CG2 4.37Å; L195-V200 HydrophobicContact CG-CG2 4.33Å; L195-V203 HydrophobicContact CD1-CB 3.93Å; L195-V203 HydrophobicContact CD1-CG1 4.29Å; L195-V203 HydrophobicContact CD1-CG2 3.6Å; L195-L235 HydrophobicContact CD2-CD1 4.39Å; L195-L235 HydrophobicContact CD2-CD2 3.62Å; L195-L270 HydrophobicContact CD2-CB 4.29Å; L195-L270 HydrophobicContact CG-CD1 4.48Å; L195-M271 HydrophobicContact CB-CG 4.39Å; L195-M271 HydrophobicContact CD2-CG 3.78Å; L195-M271 HydrophobicContact CD2-SD 4.01Å
196S87.3Confident83.9Confident52 Ų5266.5 Ų66.536%0.36436%0.357SS..  trans-139.5160.3170.250.80000109N194 G198 H199N194-S196 PolarHBondContact O-N 2.78Å; S196-G198 PolarHBondContact O-N 3.39Å; S196-H199 PolarHBondContact O-N 2.86Å; S196-H199 PolarHBondContact OG-ND1 3.09Å
197S82.6Confident84.6Confident68 Ų6863.9 Ų63.948%0.47634%0.338SS..G310 helixtrans-54-31.4-173.853.10000114.3H199 N239S197-H199 VanDerWaalsContact C-N 3.3Å; S197-H199 PolarHBondContact O-N 3.31Å; S197-N239 VanDerWaalsContact CA-OD1 3.24Å; S197-N239 WeakPolarHBondContact CA-OD1 3.42Å; S197-N239 VanDerWaalsContact CB-OD1 3.26Å; S197-N239 WeakPolarHBondContact CB-OD1 3.46Å; S197-N239 PolarHBondContact O-ND2 3.36Å; S197-N239 PolarHBondContact O-OD1 3.37Å; S197-N239 VanDerWaalsContact O-OD1 3.12Å
198G83.9Confident84.7Confident70 Ų7063 Ų6372%0.72234%0.335SS*.G310 helixtrans-74.6-10.5177.200000115.9S196S196-G198 PolarHBondContact O-N 3.39Å
199H88.4Confident84.8Confident96 Ų9666.9 Ų66.944%0.44435%0.353SS..G310 helixtrans-116.61.5-174.7-61.293.7000113.4S196 S197 D201 E202 V203S196-H199 PolarHBondContact O-N 2.86Å; S196-H199 PolarHBondContact OG-ND1 3.09Å; S197-H199 VanDerWaalsContact C-N 3.3Å; S197-H199 PolarHBondContact O-N 3.31Å; H199-D201 PolarHBondContact O-N 2.92Å; H199-E202 IonicContact CD2-OE2 3.77Å; H199-E202 WeakPolarHBondContact O-CB 3.32Å; H199-E202 PolarHBondContact O-N 2.94Å; H199-V203 WeakPolarHBondContact O-CG2 3.43Å; H199-V203 PolarHBondContact O-N 3.07Å
200V89.1Confident84.8Confident0 Ų063.8 Ų63.80%034%0.338CS..Hα-helixtrans-59.1-45.8-176.5176.80000111.9L195 E202 V203 N204 L235 N239 L270L195-V200 HydrophobicContact CD1-CG2 4.12Å; L195-V200 HydrophobicContact CD2-CG2 4.37Å; L195-V200 HydrophobicContact CG-CG2 4.33Å; V200-E202 VanDerWaalsContact C-N 3.29Å; V200-E202 PolarHBondContact O-N 3.21Å; V200-V203 PolarHBondContact O-N 3.27Å; V200-N204 WeakPolarHBondContact O-CB 3.4Å; V200-N204 PolarHBondContact O-N 3.44Å; V200-L235 HydrophobicContact CG1-CB 4.06Å; V200-N239 HydrophobicContact CB-CB 4.13Å; V200-N239 HydrophobicContact CG1-CB 3.99Å; V200-N239 HydrophobicContact CG2-CB 3.91Å; V200-L270 HydrophobicContact CG2-CD1 4.46Å; V200-L270 HydrophobicContact CG2-CD2 3.9Å
201D89.3Confident84.5Confident118 Ų11858.9 Ų58.963%0.63132%0.316SS*.Hα-helixtrans-60.5-38.7178.4-63.3-12.6000112.3H199 K205H199-D201 PolarHBondContact O-N 2.92Å; D201-K205 WeakPolarHBondContact O-CB 3.36Å; D201-K205 PolarHBondContact O-N 3.02Å
202E89.3Confident84.1Confident99 Ų9962.5 Ų62.546%0.46333%0.334SS..Hα-helixtrans-66.1-45177.4-170.1-162.3142.200110.8K191 H199 V200 K205 Y206K191-E202 IonicContact NZ-OE1 3.67Å; K191-E202 PolarHBondContact NZ-OE1 3.46Å; H199-E202 IonicContact CD2-OE2 3.77Å; H199-E202 WeakPolarHBondContact O-CB 3.32Å; H199-E202 PolarHBondContact O-N 2.94Å; V200-E202 VanDerWaalsContact C-N 3.29Å; V200-E202 PolarHBondContact O-N 3.21Å; E202-K205 PolarHBondContact O-N 3.44Å; E202-Y206 WeakPolarHBondContact O-CB 3.26Å; E202-Y206 PolarHBondContact O-N 2.94Å
203V88.6Confident83.6Confident4 Ų465.8 Ų65.82%0.02436%0.358CS..Hα-helixtrans-67.6-42.6178.9176.20000111L188 K191 L192 L195 H199 V200 K205 Y206 I207L188-V203 HydrophobicContact CD1-CG1 4.23Å; K191-V203 HydrophobicContact CB-CG2 3.94Å; L192-V203 HydrophobicContact CD2-CG1 3.65Å; L192-V203 HydrophobicContact CG-CG1 4.28Å; L195-V203 HydrophobicContact CD1-CB 3.93Å; L195-V203 HydrophobicContact CD1-CG1 4.29Å; L195-V203 HydrophobicContact CD1-CG2 3.6Å; H199-V203 WeakPolarHBondContact O-CG2 3.43Å; H199-V203 PolarHBondContact O-N 3.07Å; V200-V203 PolarHBondContact O-N 3.27Å; V203-K205 VanDerWaalsContact C-N 3.34Å; V203-K205 PolarHBondContact O-N 3.43Å; V203-Y206 CarbonylContact O-C 3.49Å; V203-Y206 WeakPolarHBondContact O-CA 3.39Å; V203-Y206 WeakPolarHBondContact O-CB 3.23Å; V203-Y206 PolarHBondContact O-N 3.37Å; V203-I207 HydrophobicContact CG1-CD1 3.94Å; V203-I207 HydrophobicContact CG1-CG1 4.29Å; V203-I207 VanDerWaalsContact O-CG1 3.3Å; V203-I207 WeakPolarHBondContact O-CG1 3.45Å; V203-I207 PolarHBondContact O-N 2.63Å
204N89.1Confident83Confident11 Ų1162.6 Ų62.66%0.05934%0.341CS..Hα-helixtrans-62.7-41176.4-78.6-8.2000112V200 Y206 I207 M208 A232 L235 D236V200-N204 WeakPolarHBondContact O-CB 3.4Å; V200-N204 PolarHBondContact O-N 3.44Å; N204-Y206 VanDerWaalsContact C-N 3.28Å; N204-Y206 PolarHBondContact O-N 3.19Å; N204-I207 PolarHBondContact O-N 3.42Å; N204-M208 WeakPolarHBondContact O-CG 3.48Å; N204-M208 PolarHBondContact O-N 3.23Å; N204-A232 HydrophobicContact CB-CB 4.3Å; N204-A232 PolarHBondContact ND2-O 3.14Å; N204-A232 VanDerWaalsContact ND2-O 3.12Å; N204-A232 WeakPolarHBondContact OD1-CA 3.45Å; N204-L235 WeakPolarHBondContact OD1-CD1 3.41Å; N204-D236 PolarHBondContact ND2-OD1 3.04Å
205K87.8Confident82Confident141 Ų14157 Ų5761%0.61331%0.311SS*.Hα-helixtrans-59.6-41.6171.4-175.8176.9-179.9-179.70111.6D201 E202 V203 M208 Q209D201-K205 WeakPolarHBondContact O-CB 3.36Å; D201-K205 PolarHBondContact O-N 3.02Å; E202-K205 PolarHBondContact O-N 3.44Å; V203-K205 VanDerWaalsContact C-N 3.34Å; V203-K205 PolarHBondContact O-N 3.43Å; K205-M208 PolarHBondContact O-N 3.34Å; K205-Q209 VanDerWaalsContact O-CG 3.25Å; K205-Q209 WeakPolarHBondContact O-CG 3.46Å; K205-Q209 PolarHBondContact O-N 2.94Å
206Y86.7Confident80.8Confident35 Ų3559.6 Ų59.614%0.13734%0.337CS..Hα-helixtrans-68.7-39.9178.9-167.6-107.3000112.6S184 Q187 L188 K191 E202 V203 N204 M208 Q209 I210S184-Y206 WeakPolarHBondContact CA-OH 3.28Å; S184-Y206 WeakPolarHBondContact O-CE1 3.46Å; S184-Y206 PolarHBondContact O-OH 2.87Å; Q187-Y206 HydrophobicContact CB-CE1 4.16Å; Q187-Y206 WeakPolarHBondContact CB-OH 3.37Å; Q187-Y206 PolarHBondContact OE1-OH 2.87Å; L188-Y206 HydrophobicContact CB-CD1 4.08Å; L188-Y206 HydrophobicContact CB-CE1 3.84Å; L188-Y206 HydrophobicContact CD1-CD1 3.98Å; K191-Y206 HydrophobicContact CD-CD1 3.78Å; K191-Y206 HydrophobicContact CD-CE1 4.24Å; K191-Y206 HydrophobicContact CD-CG 4.03Å; E202-Y206 WeakPolarHBondContact O-CB 3.26Å; E202-Y206 PolarHBondContact O-N 2.94Å; V203-Y206 CarbonylContact O-C 3.49Å; V203-Y206 WeakPolarHBondContact O-CA 3.39Å; V203-Y206 WeakPolarHBondContact O-CB 3.23Å; V203-Y206 PolarHBondContact O-N 3.37Å; N204-Y206 VanDerWaalsContact C-N 3.28Å; N204-Y206 PolarHBondContact O-N 3.19Å; Y206-M208 PolarHBondContact O-N 2.88Å; Y206-Q209 WeakPolarHBondContact O-CB 3.29Å; Y206-Q209 PolarHBondContact O-N 3.22Å; Y206-I210 HydrophobicContact CD1-CD1 3.81Å; Y206-I210 HydrophobicContact CE1-CD1 3.42Å; Y206-I210 VanDerWaalsContact CE1-CD1 3.42Å; Y206-I210 HydrophobicContact CE1-CG1 4.25Å; Y206-I210 WeakPolarHBondContact O-CG1 3.22Å; Y206-I210 PolarHBondContact O-N 2.77Å
207I84.5Confident79.4Confident0 Ų062.5 Ų62.50%036%0.357CS..Hα-helixtrans-56.4-50172.2-70.9168000110.3L188 L192 V203 N204 Q209 I210 A211 S228 L231 A232 L235L188-I207 HydrophobicContact CD1-CD1 4.24Å; L188-I207 HydrophobicContact CD1-CG1 3.39Å; L188-I207 HydrophobicContact CD2-CG1 4.18Å; L188-I207 HydrophobicContact CG-CG1 4.42Å; L192-I207 HydrophobicContact CD2-CD1 4.42Å; V203-I207 HydrophobicContact CG1-CD1 3.94Å; V203-I207 HydrophobicContact CG1-CG1 4.29Å; V203-I207 VanDerWaalsContact O-CG1 3.3Å; V203-I207 WeakPolarHBondContact O-CG1 3.45Å; V203-I207 PolarHBondContact O-N 2.63Å; N204-I207 PolarHBondContact O-N 3.42Å; I207-Q209 VanDerWaalsContact C-N 3.33Å; I207-Q209 PolarHBondContact O-N 3.41Å; I207-I210 PolarHBondContact O-N 3.46Å; I207-A211 WeakPolarHBondContact O-CB 3.25Å; I207-A211 PolarHBondContact O-N 3.43Å; I207-S228 VanDerWaalsContact CG2-O 3.22Å; I207-S228 WeakPolarHBondContact CG2-O 3.31Å; I207-L231 HydrophobicContact CD1-CD2 3.97Å; I207-L231 HydrophobicContact CD1-CG 4.13Å; I207-A232 HydrophobicContact CG2-CB 4.36Å; I207-L235 HydrophobicContact CD1-CD1 3.9Å
208M82.4Confident78.2Confident74 Ų7462.7 Ų62.737%0.36535%0.353SS..Hα-helixtrans-65.7-36.5179.6-66.2-58.5-69.100112.1N204 K205 Y206 A211 E212N204-M208 WeakPolarHBondContact O-CG 3.48Å; N204-M208 PolarHBondContact O-N 3.23Å; K205-M208 PolarHBondContact O-N 3.34Å; Y206-M208 PolarHBondContact O-N 2.88Å; M208-A211 PolarHBondContact O-N 3.37Å; M208-E212 WeakPolarHBondContact O-CB 3.15Å; M208-E212 VanDerWaalsContact O-CG 3.32Å; M208-E212 WeakPolarHBondContact O-CG 3.34Å; M208-E212 PolarHBondContact O-N 3.23Å
209Q83.2Confident76.9Confident90 Ų9067.2 Ų67.242%0.42136%0.36SS..Hα-helixtrans-60.5-46.1173.6-77.4173.7-16.600112.1K205 Y206 I207 E212 S213K205-Q209 VanDerWaalsContact O-CG 3.25Å; K205-Q209 WeakPolarHBondContact O-CG 3.46Å; K205-Q209 PolarHBondContact O-N 2.94Å; Y206-Q209 WeakPolarHBondContact O-CB 3.29Å; Y206-Q209 PolarHBondContact O-N 3.22Å; I207-Q209 VanDerWaalsContact C-N 3.33Å; I207-Q209 PolarHBondContact O-N 3.41Å; Q209-E212 PolarHBondContact O-N 3.49Å; Q209-S213 WeakPolarHBondContact O-CB 2.99Å; Q209-S213 PolarHBondContact O-N 2.9Å; Q209-S213 PolarHBondContact O-OG 2.92Å
210I76Confident75.3Confident7 Ų765.8 Ų65.84%0.03637%0.365CS..Hα-helixtrans-62-46.3177.3-68.5172.4000110.5S184 L188 Y206 I207 E212 S213 E214S184-I210 WeakPolarHBondContact O-CD1 3.47Å; L188-I210 HydrophobicContact CB-CD1 3.67Å; L188-I210 HydrophobicContact CD2-CD1 3.98Å; L188-I210 HydrophobicContact CG-CD1 4.31Å; Y206-I210 HydrophobicContact CD1-CD1 3.81Å; Y206-I210 HydrophobicContact CE1-CD1 3.42Å; Y206-I210 VanDerWaalsContact CE1-CD1 3.42Å; Y206-I210 HydrophobicContact CE1-CG1 4.25Å; Y206-I210 WeakPolarHBondContact O-CG1 3.22Å; Y206-I210 PolarHBondContact O-N 2.77Å; I207-I210 PolarHBondContact O-N 3.46Å; I210-E212 VanDerWaalsContact C-N 3.31Å; I210-E212 PolarHBondContact O-N 3.16Å; I210-S213 PolarHBondContact O-N 3.33Å; I210-E214 PolarHBondContact O-N 2.95Å
211A74.5Confident74Confident6 Ų666.9 Ų66.95%0.0537%0.371CS..Hα-helixtrans-58.1-42.1177.400000111.8I207 M208 V215 V225I207-A211 WeakPolarHBondContact O-CB 3.25Å; I207-A211 PolarHBondContact O-N 3.43Å; M208-A211 PolarHBondContact O-N 3.37Å; A211-V215 WeakPolarHBondContact O-CB 3.37Å; A211-V225 HydrophobicContact CB-CB 4.42Å; A211-V225 HydrophobicContact CB-CG2 3.76Å; A211-V225 WeakPolarHBondContact O-CG2 3.43Å
212E74.9Confident72.8Confident139 Ų13966.9 Ų66.965%0.6537%0.366SS*.Hα-helixtrans-78.9-32.5-179.5-71.7175.2-179.300113.7M208 Q209 I210 A216M208-E212 WeakPolarHBondContact O-CB 3.15Å; M208-E212 VanDerWaalsContact O-CG 3.32Å; M208-E212 WeakPolarHBondContact O-CG 3.34Å; M208-E212 PolarHBondContact O-N 3.23Å; Q209-E212 PolarHBondContact O-N 3.49Å; I210-E212 VanDerWaalsContact C-N 3.31Å; I210-E212 PolarHBondContact O-N 3.16Å; E212-A216 VanDerWaalsContact O-CB 3.27Å; E212-A216 WeakPolarHBondContact O-CB 3.34Å
213S74.3Confident71.7Confident81 Ų8167.1 Ų67.157%0.56637%0.37SS*.Hα-helixtrans-94.3-45.8-172.9690000114.6Q209 I210Q209-S213 WeakPolarHBondContact O-CB 2.99Å; Q209-S213 PolarHBondContact O-N 2.9Å; Q209-S213 PolarHBondContact O-OG 2.92Å; I210-S213 PolarHBondContact O-N 3.33Å
214E63.2Low70.6Confident70 Ų7069.7 Ų69.733%0.32738%0.383SS..THydrogen-bonded Turntrans-96.4-22.2-170-68.2-173.6168.600113I182 S184 I210I182-E214 WeakPolarHBondContact CG2-OE2 3.16Å; S184-E214 WeakPolarHBondContact CB-OE1 3.47Å; S184-E214 PolarHBondContact OG-OE1 3.01Å; S184-E214 PolarHBondContact OG-OE2 3.35Å; I210-E214 PolarHBondContact O-N 2.95Å
215V61.5Low69.7Low7 Ų771.5 Ų71.54%0.04239%0.394CS..SBendtrans-96.2-25.9-176.3-175.90000112.6A211 S217 N218 V221 I224 V225A211-V215 WeakPolarHBondContact O-CB 3.37Å; V215-S217 PolarHBondContact O-N 3.27Å; V215-N218 PolarHBondContact O-N 3.19Å; V215-N218 VanDerWaalsContact O-N 3.11Å; V215-V221 HydrophobicContact CB-CB 4.34Å; V215-V221 HydrophobicContact CB-CG1 3.74Å; V215-V221 HydrophobicContact CG1-CB 3.72Å; V215-V221 HydrophobicContact CG1-CG1 3.5Å; V215-V221 VanDerWaalsContact CG1-CG1 3.5Å; V215-V221 WeakPolarHBondContact CG1-O 3.34Å; V215-V221 HydrophobicContact CG2-CB 4.48Å; V215-V221 HydrophobicContact CG2-CG1 3.4Å; V215-V221 VanDerWaalsContact CG2-CG1 3.4Å; V215-I224 HydrophobicContact CG2-CB 4.46Å; V215-I224 HydrophobicContact CG2-CG2 4.33Å; V215-V225 HydrophobicContact CB-CG2 3.33Å; V215-V225 HydrophobicContact CG1-CB 3.96Å; V215-V225 HydrophobicContact CG1-CG2 3.15Å; V215-V225 HydrophobicContact CG2-CG2 3.85Å
216A60.2Low69.1Low84 Ų8469 Ų6969%0.69439%0.385SS*.THydrogen-bonded Turntrans-58.7-19.4-173.800000114.6E212E212-A216 VanDerWaalsContact O-CB 3.27Å; E212-A216 WeakPolarHBondContact O-CB 3.34Å
217S57.1Low68.6Low112 Ų11272.4 Ų72.478%0.78340%0.404SS*.THydrogen-bonded Turntrans-107.7-2.2-179.355.50000115.5V215V215-S217 PolarHBondContact O-N 3.27Å
218N58.4Low68.3Low72 Ų7272.8 Ų72.839%0.38541%0.407SS..  trans-127.2111-174.4-167.9-17.3000112.3V215 A220 V221 K222V215-N218 PolarHBondContact O-N 3.19Å; V215-N218 VanDerWaalsContact O-N 3.11Å; N218-A220 PolarHBondContact O-N 3.01Å; N218-A220 VanDerWaalsContact OD1-CB 3.24Å; N218-A220 WeakPolarHBondContact OD1-CB 3.26Å; N218-A220 PolarHBondContact OD1-N 3.38Å; N218-V221 HydrophobicContact CB-CB 4.09Å; N218-V221 HydrophobicContact CB-CG2 3.65Å; N218-V221 WeakPolarHBondContact O-CA 3.45Å; N218-V221 WeakPolarHBondContact O-CB 3.37Å; N218-V221 PolarHBondContact O-N 3.37Å; N218-K222 PolarHBondContact O-N 3.44Å
219L57.3Low68.3Low165 Ų16571.5 Ų71.586%0.86441%0.406SS*.G310 helixtrans-56.1-32.1175.9-94.6138.5000113.1V221 K222L219-V221 PolarHBondContact O-N 3.28Å; L219-K222 PolarHBondContact O-N 2.94Å
220A54.4Low68.4Low67 Ų6772.1 Ų72.155%0.55441%0.409SS*.G310 helixtrans-66-17.117600000112.8N218N218-A220 PolarHBondContact O-N 3.01Å; N218-A220 VanDerWaalsContact OD1-CB 3.24Å; N218-A220 WeakPolarHBondContact OD1-CB 3.26Å; N218-A220 PolarHBondContact OD1-N 3.38Å
221V60.8Low69Low22 Ų2274 Ų7413%0.13342%0.419CS..G310 helixtrans-108.4-6.6-171-167.90000110.8V215 N218 L219 N223 I224 V225V215-V221 HydrophobicContact CB-CB 4.34Å; V215-V221 HydrophobicContact CB-CG1 3.74Å; V215-V221 HydrophobicContact CG1-CB 3.72Å; V215-V221 HydrophobicContact CG1-CG1 3.5Å; V215-V221 VanDerWaalsContact CG1-CG1 3.5Å; V215-V221 WeakPolarHBondContact CG1-O 3.34Å; V215-V221 HydrophobicContact CG2-CB 4.48Å; V215-V221 HydrophobicContact CG2-CG1 3.4Å; V215-V221 VanDerWaalsContact CG2-CG1 3.4Å; N218-V221 HydrophobicContact CB-CB 4.09Å; N218-V221 HydrophobicContact CB-CG2 3.65Å; N218-V221 WeakPolarHBondContact O-CA 3.45Å; N218-V221 WeakPolarHBondContact O-CB 3.37Å; N218-V221 PolarHBondContact O-N 3.37Å; L219-V221 PolarHBondContact O-N 3.28Å; V221-N223 PolarHBondContact O-N 3.34Å; V221-N223 VanDerWaalsContact O-N 3.07Å; V221-I224 HydrophobicContact CB-CD1 4.48Å; V221-I224 HydrophobicContact CG1-CB 3.8Å; V221-I224 HydrophobicContact CG1-CD1 3.58Å; V221-I224 HydrophobicContact CG1-CG1 3.98Å; V221-I224 HydrophobicContact CG1-CG2 4.44Å; V221-I224 WeakPolarHBondContact O-CA 3.36Å; V221-I224 VanDerWaalsContact O-CB 3.23Å; V221-I224 WeakPolarHBondContact O-CB 2.97Å; V221-I224 PolarHBondContact O-N 3.27Å; V221-V225 PolarHBondContact O-N 2.94Å
222K65.3Low69.6Low119 Ų11974.1 Ų74.152%0.51742%0.419SS..Hα-helixtrans-48.5-41.7178.9-176.7-175.4172-167.70112.9N218 L219 I224 V225 E226N218-K222 PolarHBondContact O-N 3.44Å; L219-K222 PolarHBondContact O-N 2.94Å; K222-I224 PolarHBondContact O-N 3.35Å; K222-V225 PolarHBondContact O-N 3.42Å; K222-V225 VanDerWaalsContact O-N 3.12Å; K222-E226 VanDerWaalsContact CE-OE1 3.3Å; K222-E226 WeakPolarHBondContact CE-OE1 3.35Å; K222-E226 IonicContact NZ-OE1 2.73Å; K222-E226 PolarHBondContact O-N 3.36Å
223N65.5Low70.3Confident104 Ų10469.5 Ų69.556%0.55640%0.401SS*.Hα-helixtrans-61.4-31.4176.7-65.1-9000112.4V221 E226 I227V221-N223 PolarHBondContact O-N 3.34Å; V221-N223 VanDerWaalsContact O-N 3.07Å; N223-E226 PolarHBondContact O-N 3.1Å; N223-I227 WeakPolarHBondContact O-CB 3.35Å; N223-I227 WeakPolarHBondContact O-CD1 3.32Å; N223-I227 WeakPolarHBondContact O-CG1 3.42Å; N223-I227 PolarHBondContact O-N 3.39Å
224I66.6Low71.2Confident57 Ų5766.3 Ų66.329%0.29238%0.377SS..Hα-helixtrans-68-37.2176.3-59.1-180000110.8V215 V221 K222 S228V215-I224 HydrophobicContact CG2-CB 4.46Å; V215-I224 HydrophobicContact CG2-CG2 4.33Å; V221-I224 HydrophobicContact CB-CD1 4.48Å; V221-I224 HydrophobicContact CG1-CB 3.8Å; V221-I224 HydrophobicContact CG1-CD1 3.58Å; V221-I224 HydrophobicContact CG1-CG1 3.98Å; V221-I224 HydrophobicContact CG1-CG2 4.44Å; V221-I224 WeakPolarHBondContact O-CA 3.36Å; V221-I224 VanDerWaalsContact O-CB 3.23Å; V221-I224 WeakPolarHBondContact O-CB 2.97Å; V221-I224 PolarHBondContact O-N 3.27Å; K222-I224 PolarHBondContact O-N 3.35Å; I224-S228 WeakPolarHBondContact O-CA 3.39Å; I224-S228 WeakPolarHBondContact O-CB 3.08Å; I224-S228 PolarHBondContact O-N 2.92Å; I224-S228 PolarHBondContact O-OG 2.9Å
225V68.5Low72.6Confident49 Ų4963 Ų6330%0.29736%0.361SS..Hα-helixtrans-61.7-47.1172.5158.80000110.8A211 V215 V221 K222 S228 S229A211-V225 HydrophobicContact CB-CB 4.42Å; A211-V225 HydrophobicContact CB-CG2 3.76Å; A211-V225 WeakPolarHBondContact O-CG2 3.43Å; V215-V225 HydrophobicContact CB-CG2 3.33Å; V215-V225 HydrophobicContact CG1-CB 3.96Å; V215-V225 HydrophobicContact CG1-CG2 3.15Å; V215-V225 HydrophobicContact CG2-CG2 3.85Å; V221-V225 PolarHBondContact O-N 2.94Å; K222-V225 PolarHBondContact O-N 3.42Å; K222-V225 VanDerWaalsContact O-N 3.12Å; V225-S228 PolarHBondContact O-N 3.32Å; V225-S229 WeakPolarHBondContact O-CB 3.39Å; V225-S229 PolarHBondContact O-N 3.4Å; V225-S229 PolarHBondContact O-OG 2.89Å
226E75.3Confident74Confident90 Ų9066 Ų6642%0.42138%0.377SS..Hα-helixtrans-61.3-51.3-179.6-68.1176.9-175.600110.2K222 N223 S228 S229 E230K222-E226 VanDerWaalsContact CE-OE1 3.3Å; K222-E226 WeakPolarHBondContact CE-OE1 3.35Å; K222-E226 IonicContact NZ-OE1 2.73Å; K222-E226 PolarHBondContact O-N 3.36Å; N223-E226 PolarHBondContact O-N 3.1Å; E226-S228 VanDerWaalsContact C-N 3.33Å; E226-S228 PolarHBondContact O-N 3.41Å; E226-S229 PolarHBondContact O-N 3.39Å; E226-S229 PolarHBondContact O-OG 3.07Å; E226-E230 PolarHBondContact O-N 3.17Å
227I77.6Confident75.6Confident105 Ų10563.5 Ų63.554%0.53835%0.35SS..Hα-helixtrans-59.8-40.7176.3-67.4164.7000111.8N223 E230 L231N223-I227 WeakPolarHBondContact O-CB 3.35Å; N223-I227 WeakPolarHBondContact O-CD1 3.32Å; N223-I227 WeakPolarHBondContact O-CG1 3.42Å; N223-I227 PolarHBondContact O-N 3.39Å; I227-E230 PolarHBondContact O-N 3.13Å; I227-L231 WeakPolarHBondContact O-CB 3.5Å; I227-L231 PolarHBondContact O-N 2.99Å
228S78.3Confident77.4Confident9 Ų958.2 Ų58.26%0.06331%0.313CS..Hα-helixtrans-64.2-43.6178.1-68.30000111.3I207 I224 V225 E226 E230 L231 A232I207-S228 VanDerWaalsContact CG2-O 3.22Å; I207-S228 WeakPolarHBondContact CG2-O 3.31Å; I224-S228 WeakPolarHBondContact O-CA 3.39Å; I224-S228 WeakPolarHBondContact O-CB 3.08Å; I224-S228 PolarHBondContact O-N 2.92Å; I224-S228 PolarHBondContact O-OG 2.9Å; V225-S228 PolarHBondContact O-N 3.32Å; E226-S228 VanDerWaalsContact C-N 3.33Å; E226-S228 PolarHBondContact O-N 3.41Å; S228-E230 VanDerWaalsContact C-N 3.35Å; S228-L231 PolarHBondContact O-N 3.43Å; S228-A232 PolarHBondContact O-N 3.32Å
229S81.4Confident79.1Confident47 Ų4756.8 Ų56.833%0.32931%0.305SS..Hα-helixtrans-64.9-40177.473.70000111.9V225 E226 A232 V233V225-S229 WeakPolarHBondContact O-CB 3.39Å; V225-S229 PolarHBondContact O-N 3.4Å; V225-S229 PolarHBondContact O-OG 2.89Å; E226-S229 PolarHBondContact O-N 3.39Å; E226-S229 PolarHBondContact O-OG 3.07Å; S229-A232 PolarHBondContact O-N 3.33Å; S229-V233 VanDerWaalsContact O-CG2 3.29Å; S229-V233 WeakPolarHBondContact O-CG2 3.41Å; S229-V233 PolarHBondContact O-N 2.97Å; S229-V233 VanDerWaalsContact O-N 3.11Å
230E86.1Confident80.9Confident103 Ų10353.2 Ų53.248%0.48129%0.294SS..Hα-helixtrans-65.2-41.7174.4-78.3-174.9-176.300112E226 I227 S228 V233 I234 F301E226-E230 PolarHBondContact O-N 3.17Å; I227-E230 PolarHBondContact O-N 3.13Å; S228-E230 VanDerWaalsContact C-N 3.35Å; E230-V233 PolarHBondContact O-N 3.36Å; E230-I234 PolarHBondContact O-N 3.39Å; E230-F301 HydrophobicContact CB-CE1 3.91Å; E230-F301 HydrophobicContact CG-CD1 4.46Å; E230-F301 HydrophobicContact CG-CE1 4.08Å
231L87.7Confident82.8Confident47 Ų4752.7 Ų52.725%0.24628%0.278CS..Hα-helixtrans-62.4-44.8175.8-178.661.3000111.6L192 I207 I227 S228 V233 I234 L235L192-L231 HydrophobicContact CD1-CD2 4.17Å; L192-L231 HydrophobicContact CD2-CD2 4.39Å; I207-L231 HydrophobicContact CD1-CD2 3.97Å; I207-L231 HydrophobicContact CD1-CG 4.13Å; I227-L231 WeakPolarHBondContact O-CB 3.5Å; I227-L231 PolarHBondContact O-N 2.99Å; S228-L231 PolarHBondContact O-N 3.43Å; L231-V233 VanDerWaalsContact C-N 3.3Å; L231-V233 PolarHBondContact O-N 3.24Å; L231-I234 HydrophobicContact CD1-CG2 4.11Å; L231-I234 WeakPolarHBondContact O-CG2 3.46Å; L231-I234 PolarHBondContact O-N 3.34Å; L231-L235 HydrophobicContact CD1-CD1 4.14Å; L231-L235 HydrophobicContact CD1-CG 4.08Å; L231-L235 HydrophobicContact CG-CD1 3.99Å; L231-L235 HydrophobicContact CG-CG 4.35Å; L231-L235 WeakPolarHBondContact O-CB 3.4Å; L231-L235 VanDerWaalsContact O-CG 3.23Å; L231-L235 WeakPolarHBondContact O-CG 3.41Å; L231-L235 PolarHBondContact O-N 3.47Å
232A88.2Confident84.4Confident8 Ų852.6 Ų52.67%0.06628%0.276CS..Hα-helixtrans-60.7-44177.300000111.4N204 I207 S228 S229 I234 L235 D236N204-A232 HydrophobicContact CB-CB 4.3Å; N204-A232 PolarHBondContact ND2-O 3.14Å; N204-A232 VanDerWaalsContact ND2-O 3.12Å; N204-A232 WeakPolarHBondContact OD1-CA 3.45Å; I207-A232 HydrophobicContact CG2-CB 4.36Å; S228-A232 PolarHBondContact O-N 3.32Å; S229-A232 PolarHBondContact O-N 3.33Å; A232-I234 PolarHBondContact O-N 3.35Å; A232-L235 PolarHBondContact O-N 2.92Å; A232-D236 PolarHBondContact O-N 3.24Å
233V89.7Confident85.8Confident42 Ų4257.6 Ų57.626%0.25529%0.292SS..Hα-helixtrans-61.6-44.6178.3164.90000112.6S229 E230 L231 Y237 K300 F301S229-V233 VanDerWaalsContact O-CG2 3.29Å; S229-V233 WeakPolarHBondContact O-CG2 3.41Å; S229-V233 PolarHBondContact O-N 2.97Å; S229-V233 VanDerWaalsContact O-N 3.11Å; E230-V233 PolarHBondContact O-N 3.36Å; L231-V233 VanDerWaalsContact C-N 3.3Å; L231-V233 PolarHBondContact O-N 3.24Å; V233-Y237 PolarHBondContact O-N 3.27Å; V233-K300 HydrophobicContact CG1-CD 3.8Å; V233-F301 HydrophobicContact CB-CZ 4.2Å; V233-F301 HydrophobicContact CG1-CE2 3.75Å; V233-F301 HydrophobicContact CG1-CZ 3.67Å
234I92.3Very high87.2Confident14 Ų1456.6 Ų56.67%0.07228%0.284CS..Hα-helixtrans-70-38.9179-165.8174.3000110.8E230 L231 A232 Y237 Q238 L274 F301E230-I234 PolarHBondContact O-N 3.39Å; L231-I234 HydrophobicContact CD1-CG2 4.11Å; L231-I234 WeakPolarHBondContact O-CG2 3.46Å; L231-I234 PolarHBondContact O-N 3.34Å; A232-I234 PolarHBondContact O-N 3.35Å; I234-Y237 WeakPolarHBondContact O-CB 3.3Å; I234-Y237 PolarHBondContact O-N 2.94Å; I234-Y237 VanDerWaalsContact O-N 3.15Å; I234-Q238 HydrophobicContact CG1-CG 4.23Å; I234-Q238 VanDerWaalsContact O-CG 3.25Å; I234-Q238 WeakPolarHBondContact O-CG 3.42Å; I234-Q238 PolarHBondContact O-N 2.91Å; I234-L274 HydrophobicContact CD1-CB 3.96Å; I234-L274 HydrophobicContact CD1-CD1 4.04Å; I234-F301 HydrophobicContact CB-CE2 4.43Å; I234-F301 HydrophobicContact CB-CZ 3.82Å
235L92.9Very high88.6Confident0 Ų054 Ų540%027%0.27CS..Hα-helixtrans-62.6-44178-74.9178.2000112.3L192 L195 V200 N204 I207 L231 A232 Y237 Q238 N239 M271L192-L235 HydrophobicContact CD2-CD1 3.99Å; L195-L235 HydrophobicContact CD2-CD1 4.39Å; L195-L235 HydrophobicContact CD2-CD2 3.62Å; V200-L235 HydrophobicContact CG1-CB 4.06Å; N204-L235 WeakPolarHBondContact OD1-CD1 3.41Å; I207-L235 HydrophobicContact CD1-CD1 3.9Å; L231-L235 HydrophobicContact CD1-CD1 4.14Å; L231-L235 HydrophobicContact CD1-CG 4.08Å; L231-L235 HydrophobicContact CG-CD1 3.99Å; L231-L235 HydrophobicContact CG-CG 4.35Å; L231-L235 WeakPolarHBondContact O-CB 3.4Å; L231-L235 VanDerWaalsContact O-CG 3.23Å; L231-L235 WeakPolarHBondContact O-CG 3.41Å; L231-L235 PolarHBondContact O-N 3.47Å; A232-L235 PolarHBondContact O-N 2.92Å; L235-Y237 VanDerWaalsContact C-N 3.26Å; L235-Y237 PolarHBondContact O-N 3.5Å; L235-Q238 PolarHBondContact O-N 3.09Å; L235-N239 VanDerWaalsContact O-CB 3.31Å; L235-N239 WeakPolarHBondContact O-CB 3.46Å; L235-N239 PolarHBondContact O-N 2.93Å; L235-M271 HydrophobicContact CD2-CG 4.43Å; L235-M271 HydrophobicContact CD2-SD 3.85Å
236D91.4Very high89.8Confident71 Ų7153.9 Ų53.938%0.3827%0.272SS..Hα-helixtrans-58.9-41.2173.9-78.9-24.9000111.4N204 A232 S240N204-D236 PolarHBondContact ND2-OD1 3.04Å; A232-D236 PolarHBondContact O-N 3.24Å; D236-S240 PolarHBondContact O-N 2.89Å; D236-S240 VanDerWaalsContact O-N 3.12Å; D236-S240 PolarHBondContact O-OG 3.18Å
237Y92Very high90.6Very high31 Ų3152.7 Ų52.712%0.12227%0.273CS..Hα-helixtrans-66.7-46.6179.2-154.9-89.2000111.4V233 I234 L235 S240 Y241 L281 R293 L297V233-Y237 PolarHBondContact O-N 3.27Å; I234-Y237 WeakPolarHBondContact O-CB 3.3Å; I234-Y237 PolarHBondContact O-N 2.94Å; I234-Y237 VanDerWaalsContact O-N 3.15Å; L235-Y237 VanDerWaalsContact C-N 3.26Å; L235-Y237 PolarHBondContact O-N 3.5Å; Y237-S240 WeakPolarHBondContact O-CB 3.46Å; Y237-S240 PolarHBondContact O-N 3.2Å; Y237-Y241 AromaticContact CD1-CD2 3.87Å; Y237-Y241 HydrophobicContact CD1-CD2 3.87Å; Y237-Y241 AromaticContact CD1-CE2 3.7Å; Y237-Y241 HydrophobicContact CD1-CE2 3.7Å; Y237-Y241 HydrophobicContact CD2-CE2 4.49Å; Y237-Y241 AromaticContact CE1-CD2 3.82Å; Y237-Y241 HydrophobicContact CE1-CD2 3.82Å; Y237-Y241 AromaticContact CE1-CE2 3.34Å; Y237-Y241 HydrophobicContact CE1-CE2 3.34Å; Y237-Y241 HydrophobicContact CE2-CE2 4.2Å; Y237-Y241 HydrophobicContact CG-CE2 4.28Å; Y237-Y241 AromaticContact CZ-CE2 3.64Å; Y237-Y241 WeakPolarHBondContact O-CD2 3.44Å; Y237-L281 HydrophobicContact CD1-CD1 4.2Å; Y237-L281 HydrophobicContact CE1-CD1 3.51Å; Y237-L281 HydrophobicContact CE1-CD2 4.02Å; Y237-L281 HydrophobicContact CE1-CG 4.4Å; Y237-R293 PolarHBondContact OH-O 2.78Å; Y237-L297 HydrophobicContact CD1-CD1 3.94Å; Y237-L297 HydrophobicContact CD1-CD2 4.01Å; Y237-L297 HydrophobicContact CD1-CG 4.44Å; Y237-L297 HydrophobicContact CD2-CD1 4.07Å; Y237-L297 HydrophobicContact CE1-CB 4.11Å; Y237-L297 HydrophobicContact CE1-CD1 4.19Å; Y237-L297 HydrophobicContact CE1-CD2 4.07Å; Y237-L297 HydrophobicContact CE1-CG 4.36Å; Y237-L297 HydrophobicContact CE2-CD1 4.31Å; Y237-L297 HydrophobicContact CG-CD1 3.86Å
238Q95.3Very high91.4Very high0 Ų049.6 Ų49.60%026%0.255CS..Hα-helixtrans-60.4-45.9176.1-69.2171.6-13.500111I234 L235 S240 Y241 E242 L269 L270 Q272 T277I234-Q238 HydrophobicContact CG1-CG 4.23Å; I234-Q238 VanDerWaalsContact O-CG 3.25Å; I234-Q238 WeakPolarHBondContact O-CG 3.42Å; I234-Q238 PolarHBondContact O-N 2.91Å; L235-Q238 PolarHBondContact O-N 3.09Å; Q238-S240 PolarHBondContact O-N 3.18Å; Q238-Y241 CarbonylContact O-C 3.51Å; Q238-Y241 PolarHBondContact O-N 3.42Å; Q238-E242 PolarHBondContact O-N 3.13Å; Q238-L269 HydrophobicContact CB-CD2 4.37Å; Q238-L269 HydrophobicContact CB-CG 4.05Å; Q238-L269 HydrophobicContact CG-CG 3.99Å; Q238-L269 WeakPolarHBondContact CG-O 3.18Å; Q238-L269 PolarHBondContact NE2-O 3.42Å; Q238-L269 PolarHBondContact OE1-O 2.92Å; Q238-L270 HydrophobicContact CB-CD2 4.09Å; Q238-Q272 PolarHBondContact NE2-O 3.25Å; Q238-T277 HydrophobicContact CG-CG2 3.88Å; Q238-T277 PolarHBondContact NE2-OG1 3.27Å
239N94.8Very high92Very high43 Ų4350.6 Ų50.623%0.2326%0.258CS..Hα-helixtrans-59.3-37179.2-166.138.3000112.6S197 V200 L235 Y241 L270S197-N239 VanDerWaalsContact CA-OD1 3.24Å; S197-N239 WeakPolarHBondContact CA-OD1 3.42Å; S197-N239 VanDerWaalsContact CB-OD1 3.26Å; S197-N239 WeakPolarHBondContact CB-OD1 3.46Å; S197-N239 PolarHBondContact O-ND2 3.36Å; S197-N239 PolarHBondContact O-OD1 3.37Å; S197-N239 VanDerWaalsContact O-OD1 3.12Å; V200-N239 HydrophobicContact CB-CB 4.13Å; V200-N239 HydrophobicContact CG1-CB 3.99Å; V200-N239 HydrophobicContact CG2-CB 3.91Å; L235-N239 VanDerWaalsContact O-CB 3.31Å; L235-N239 WeakPolarHBondContact O-CB 3.46Å; L235-N239 PolarHBondContact O-N 2.93Å; N239-Y241 PolarHBondContact O-N 3.12Å; N239-L270 HydrophobicContact CB-CD2 4.17Å
240S94Very high92.5Very high89 Ų8951.5 Ų51.562%0.62226%0.264SS*.Hα-helixtrans-62.4-25.3177.4-600000113.1D236 Y237 Q238D236-S240 PolarHBondContact O-N 2.89Å; D236-S240 VanDerWaalsContact O-N 3.12Å; D236-S240 PolarHBondContact O-OG 3.18Å; Y237-S240 WeakPolarHBondContact O-CB 3.46Å; Y237-S240 PolarHBondContact O-N 3.2Å; Q238-S240 PolarHBondContact O-N 3.18Å
241Y95Very high92.6Very high56 Ų5651.5 Ų51.522%0.2226%0.264CS..Hα-helixtrans-118.2-1.5-176.9-57.5-64.9000114.4Y237 Q238 N239 R243 E244 W245 L281 R293Y237-Y241 AromaticContact CD1-CD2 3.87Å; Y237-Y241 HydrophobicContact CD1-CD2 3.87Å; Y237-Y241 AromaticContact CD1-CE2 3.7Å; Y237-Y241 HydrophobicContact CD1-CE2 3.7Å; Y237-Y241 HydrophobicContact CD2-CE2 4.49Å; Y237-Y241 AromaticContact CE1-CD2 3.82Å; Y237-Y241 HydrophobicContact CE1-CD2 3.82Å; Y237-Y241 AromaticContact CE1-CE2 3.34Å; Y237-Y241 HydrophobicContact CE1-CE2 3.34Å; Y237-Y241 HydrophobicContact CE2-CE2 4.2Å; Y237-Y241 HydrophobicContact CG-CE2 4.28Å; Y237-Y241 AromaticContact CZ-CE2 3.64Å; Y237-Y241 WeakPolarHBondContact O-CD2 3.44Å; Q238-Y241 CarbonylContact O-C 3.51Å; Q238-Y241 PolarHBondContact O-N 3.42Å; N239-Y241 PolarHBondContact O-N 3.12Å; Y241-R243 VanDerWaalsContact C-N 3.29Å; Y241-R243 PolarHBondContact O-N 3.22Å; Y241-E244 PolarHBondContact O-N 3.38Å; Y241-W245 PolarHBondContact O-N 3.23Å; Y241-L281 HydrophobicContact CD2-CD2 3.82Å; Y241-L281 HydrophobicContact CE2-CD2 4.24Å; Y241-L281 HydrophobicContact CG-CD2 4.17Å; Y241-R293 VanDerWaalsContact CE1-NH1 3.28Å; Y241-R293 WeakPolarHBondContact OH-CD 3.45Å
242E95Very high92.6Very high21 Ų2150.3 Ų50.310%0.09826%0.258CS..Hα-helixtrans-52-46.4-177.317858.6-151.900111.9Q238 E244 W245 S246 S268 L269 L270Q238-E242 PolarHBondContact O-N 3.13Å; E242-E244 PolarHBondContact O-N 3.34Å; E242-W245 PolarHBondContact O-N 3.44Å; E242-S246 PolarHBondContact O-N 2.81Å; E242-S246 PolarHBondContact O-OG 3.05Å; E242-S268 PolarHBondContact OE1-OG 3.36Å; E242-L269 VanDerWaalsContact OE2-CA 3.32Å; E242-L269 WeakPolarHBondContact OE2-CA 3.25Å; E242-L269 WeakPolarHBondContact OE2-CB 3.23Å; E242-L269 PolarHBondContact OE2-N 3.38Å; E242-L270 HydrophobicContact CG-CD1 4.43Å; E242-L270 HydrophobicContact CG-CG 4.26Å; E242-L270 PolarHBondContact OE2-N 3.16Å
243R94.5Very high92.4Very high223 Ų22353.1 Ų53.184%0.84227%0.271SS*.Hα-helixtrans-63.9-40.1-180-173-175.5-62.6160.73.2112.9Y241 S247Y241-R243 VanDerWaalsContact C-N 3.29Å; Y241-R243 PolarHBondContact O-N 3.22Å; R243-S247 PolarHBondContact O-N 3.03Å
244E95.2Very high92.2Very high84 Ų8456.3 Ų56.339%0.39329%0.291SS..Hα-helixtrans-67.8-42.3178-170.3-175.8151.100110.2Y241 E242 S247 Y248 M284 R293Y241-E244 PolarHBondContact O-N 3.38Å; E242-E244 PolarHBondContact O-N 3.34Å; E244-S247 WeakPolarHBondContact O-CB 3.29Å; E244-S247 PolarHBondContact O-N 3.27Å; E244-Y248 PolarHBondContact O-N 3.43Å; E244-M284 HydrophobicContact CB-SD 4.1Å; E244-M284 HydrophobicContact CG-SD 3.89Å; E244-R293 IonicContact OE1-CZ 2.71Å; E244-R293 IonicContact OE1-NH1 3.37Å; E244-R293 PolarHBondContact OE1-NH1 3.44Å; E244-R293 IonicContact OE1-NH2 3.8Å; E244-R293 PolarHBondContact OE1-NH2 3.14Å; E244-R293 IonicContact OE2-CZ 3.32Å; E244-R293 IonicContact OE2-NH1 3.06Å; E244-R293 PolarHBondContact OE2-NH1 3.11Å; E244-R293 IonicContact OE2-NH2 2.78Å
245W95.2Very high91.5Very high2 Ų263 Ų631%0.00832%0.317CS..Hα-helixtrans-59.6-48.5174.9176.5-109000112.1Y241 E242 S247 Y248 Y249 L265 P266 E267 L269 A280 M284Y241-W245 PolarHBondContact O-N 3.23Å; E242-W245 PolarHBondContact O-N 3.44Å; W245-S247 PolarHBondContact O-N 3.03Å; W245-Y248 HydrophobicContact CE3-CD1 4.07Å; W245-Y248 AromaticContact CZ3-CD1 3.76Å; W245-Y248 HydrophobicContact CZ3-CD1 3.76Å; W245-Y248 HydrophobicContact CZ3-CE1 4.16Å; W245-Y248 PolarHBondContact O-N 3.3Å; W245-Y248 VanDerWaalsContact O-N 3.17Å; W245-Y249 HydrophobicContact CZ2-CD2 4.19Å; W245-Y249 VanDerWaalsContact O-CB 3.29Å; W245-Y249 WeakPolarHBondContact O-CB 3.33Å; W245-Y249 PolarHBondContact O-N 3.17Å; W245-L265 HydrophobicContact CH2-CB 4.47Å; W245-L265 HydrophobicContact CH2-CD1 4.24Å; W245-L265 HydrophobicContact CZ2-CB 4.31Å; W245-P266 VanDerWaalsContact CZ2-O 3.32Å; W245-P266 WeakPolarHBondContact CZ2-O 3.39Å; W245-P266 PolarHBondContact NE1-O 2.73Å; W245-E267 PolarHBondContact NE1-O 3.31Å; W245-L269 HydrophobicContact CB-CB 4.03Å; W245-L269 HydrophobicContact CB-CD2 4.31Å; W245-L269 HydrophobicContact CG-CB 3.87Å; W245-A280 HydrophobicContact CD2-CB 4.16Å; W245-A280 HydrophobicContact CE3-CB 3.66Å; W245-A280 HydrophobicContact CH2-CB 3.96Å; W245-A280 HydrophobicContact CZ2-CB 4.45Å; W245-A280 HydrophobicContact CZ3-CB 3.54Å; W245-M284 WeakPolarHBondContact CA-SD 3.47Å; W245-M284 HydrophobicContact CB-CE 4.39Å; W245-M284 HydrophobicContact CB-SD 3.9Å; W245-M284 HydrophobicContact CE3-CE 4.4Å; W245-M284 HydrophobicContact CE3-CG 4.04Å; W245-M284 HydrophobicContact CE3-SD 3.99Å; W245-M284 PolarHBondContact N-SD 3.3Å; W245-M284 VanDerWaalsContact N-SD 3.41Å
246S93.6Very high90Very high46 Ų4668.7 Ų68.732%0.32235%0.352SS..Hα-helixtrans-59.3-36.4178.2-48.20000112.1E242 S250E242-S246 PolarHBondContact O-N 2.81Å; E242-S246 PolarHBondContact O-OG 3.05Å; S246-S250 WeakPolarHBondContact O-CB 3.37Å; S246-S250 PolarHBondContact O-N 2.62Å; S246-S250 VanDerWaalsContact O-N 3.08Å; S246-S250 PolarHBondContact O-OG 2.95Å
247S93.6Very high88.9Confident65 Ų6572.5 Ų72.546%0.45537%0.372SS..Hα-helixtrans-66-50.3175.2-166.70000111.1R243 E244 W245 Y249 S250 E251R243-S247 PolarHBondContact O-N 3.03Å; E244-S247 WeakPolarHBondContact O-CB 3.29Å; E244-S247 PolarHBondContact O-N 3.27Å; W245-S247 PolarHBondContact O-N 3.03Å; S247-Y249 PolarHBondContact O-N 3.12Å; S247-S250 WeakPolarHBondContact O-CB 3.26Å; S247-S250 PolarHBondContact O-N 2.93Å; S247-E251 WeakPolarHBondContact O-CG 3.46Å; S247-E251 PolarHBondContact O-N 2.88Å
248Y92.7Very high87.9Confident40 Ų4072 Ų7216%0.15737%0.374CS..Hα-helixtrans-60.6-44.2178.3-178.5-98.9000112.2E244 W245 S250 E251 L252 R283 M284E244-Y248 PolarHBondContact O-N 3.43Å; W245-Y248 HydrophobicContact CE3-CD1 4.07Å; W245-Y248 AromaticContact CZ3-CD1 3.76Å; W245-Y248 HydrophobicContact CZ3-CD1 3.76Å; W245-Y248 HydrophobicContact CZ3-CE1 4.16Å; W245-Y248 PolarHBondContact O-N 3.3Å; W245-Y248 VanDerWaalsContact O-N 3.17Å; Y248-S250 VanDerWaalsContact C-N 3.34Å; Y248-S250 PolarHBondContact O-N 3.22Å; Y248-E251 WeakPolarHBondContact O-CB 3.42Å; Y248-E251 PolarHBondContact O-N 3.48Å; Y248-L252 HydrophobicContact CD1-CD1 3.91Å; Y248-L252 HydrophobicContact CD1-CG 4.21Å; Y248-L252 HydrophobicContact CE1-CD1 3.46Å; Y248-L252 VanDerWaalsContact CE1-CD1 3.46Å; Y248-L252 HydrophobicContact CE1-CD2 4.16Å; Y248-L252 HydrophobicContact CE1-CG 3.84Å; Y248-L252 WeakPolarHBondContact O-CG 3.37Å; Y248-L252 PolarHBondContact O-N 2.87Å; Y248-R283 HydrophobicContact CE1-CB 3.76Å; Y248-M284 HydrophobicContact CD1-CG 4.2Å; Y248-M284 HydrophobicContact CG-CG 4.02Å
249Y91.9Very high86.6Confident31 Ų3179.4 Ų79.412%0.12240%0.402CS..Hα-helixtrans-59.4-43.1176.1-175.7-93.9000111.9W245 S247 E251 L252 L253 L265 E267W245-Y249 HydrophobicContact CZ2-CD2 4.19Å; W245-Y249 VanDerWaalsContact O-CB 3.29Å; W245-Y249 WeakPolarHBondContact O-CB 3.33Å; W245-Y249 PolarHBondContact O-N 3.17Å; S247-Y249 PolarHBondContact O-N 3.12Å; Y249-E251 VanDerWaalsContact C-N 3.34Å; Y249-E251 PolarHBondContact O-N 3.44Å; Y249-L252 WeakPolarHBondContact O-CB 3.42Å; Y249-L252 PolarHBondContact O-N 3.04Å; Y249-L253 HydrophobicContact CD1-CD1 3.92Å; Y249-L253 HydrophobicContact CD1-CG 4.46Å; Y249-L253 HydrophobicContact CE1-CD1 3.5Å; Y249-L253 VanDerWaalsContact CE1-CD1 3.5Å; Y249-L253 HydrophobicContact CE1-CG 4.12Å; Y249-L253 PolarHBondContact O-N 2.99Å; Y249-L253 VanDerWaalsContact O-N 3.15Å; Y249-L265 HydrophobicContact CE2-CB 4.26Å; Y249-E267 HydrophobicContact CD1-CG 4.2Å; Y249-E267 HydrophobicContact CE1-CB 4.04Å; Y249-E267 HydrophobicContact CE1-CG 3.86Å
250S91Very high85.7Confident66 Ų6685.8 Ų85.846%0.46243%0.428SS..Hα-helixtrans-64-37.8176.3-60.40000112.4S246 S247 Y248 L253 T254S246-S250 WeakPolarHBondContact O-CB 3.37Å; S246-S250 PolarHBondContact O-N 2.62Å; S246-S250 VanDerWaalsContact O-N 3.08Å; S246-S250 PolarHBondContact O-OG 2.95Å; S247-S250 WeakPolarHBondContact O-CB 3.26Å; S247-S250 PolarHBondContact O-N 2.93Å; Y248-S250 VanDerWaalsContact C-N 3.34Å; Y248-S250 PolarHBondContact O-N 3.22Å; S250-L253 PolarHBondContact O-N 3.35Å; S250-T254 PolarHBondContact O-N 2.88Å; S250-T254 PolarHBondContact O-OG1 3.23Å
251E89.5Confident84.7Confident102 Ų10283.3 Ų83.348%0.47741%0.409SS..Hα-helixtrans-64-45173.5-71.7177-163.100111.4S247 Y248 Y249 L253 T254 Y255S247-E251 WeakPolarHBondContact O-CG 3.46Å; S247-E251 PolarHBondContact O-N 2.88Å; Y248-E251 WeakPolarHBondContact O-CB 3.42Å; Y248-E251 PolarHBondContact O-N 3.48Å; Y249-E251 VanDerWaalsContact C-N 3.34Å; Y249-E251 PolarHBondContact O-N 3.44Å; E251-L253 VanDerWaalsContact C-N 3.27Å; E251-L253 PolarHBondContact O-N 3.28Å; E251-T254 WeakPolarHBondContact O-CB 3.42Å; E251-T254 PolarHBondContact O-N 2.99Å; E251-Y255 WeakPolarHBondContact O-CD2 3.23Å; E251-Y255 PolarHBondContact O-N 3.24Å
252L86.8Confident83.8Confident23 Ų2380.6 Ų80.612%0.1240%0.399CS..Hα-helixtrans-57.8-38.1177.2-70.4178.2000112.9Y248 Y249 T254 A258 A262 L265Y248-L252 HydrophobicContact CD1-CD1 3.91Å; Y248-L252 HydrophobicContact CD1-CG 4.21Å; Y248-L252 HydrophobicContact CE1-CD1 3.46Å; Y248-L252 VanDerWaalsContact CE1-CD1 3.46Å; Y248-L252 HydrophobicContact CE1-CD2 4.16Å; Y248-L252 HydrophobicContact CE1-CG 3.84Å; Y248-L252 WeakPolarHBondContact O-CG 3.37Å; Y248-L252 PolarHBondContact O-N 2.87Å; Y249-L252 WeakPolarHBondContact O-CB 3.42Å; Y249-L252 PolarHBondContact O-N 3.04Å; L252-T254 PolarHBondContact O-N 2.9Å; L252-A258 HydrophobicContact CB-CB 4.5Å; L252-A258 HydrophobicContact CD2-CB 3.88Å; L252-A262 HydrophobicContact CB-CB 3.99Å; L252-L265 HydrophobicContact CD1-CD1 3.91Å
253L85Confident82.9Confident66 Ų6684.6 Ų84.635%0.34642%0.424SS..Hα-helixtrans-66.7-24.3177-73.8174.1000113.3Y249 S250 E251 A262Y249-L253 HydrophobicContact CD1-CD1 3.92Å; Y249-L253 HydrophobicContact CD1-CG 4.46Å; Y249-L253 HydrophobicContact CE1-CD1 3.5Å; Y249-L253 VanDerWaalsContact CE1-CD1 3.5Å; Y249-L253 HydrophobicContact CE1-CG 4.12Å; Y249-L253 PolarHBondContact O-N 2.99Å; Y249-L253 VanDerWaalsContact O-N 3.15Å; S250-L253 PolarHBondContact O-N 3.35Å; E251-L253 VanDerWaalsContact C-N 3.27Å; E251-L253 PolarHBondContact O-N 3.28Å; L253-A262 HydrophobicContact CD2-CB 3.82Å; L253-A262 HydrophobicContact CG-CB 4.29Å
254T84.5Confident82.3Confident110 Ų11078.7 Ų78.768%0.67541%0.413SS*.Hα-helixtrans-79.9-35.5-177.8-55.40000111.8S250 E251 L252S250-T254 PolarHBondContact O-N 2.88Å; S250-T254 PolarHBondContact O-OG1 3.23Å; E251-T254 WeakPolarHBondContact O-CB 3.42Å; E251-T254 PolarHBondContact O-N 2.99Å; L252-T254 PolarHBondContact O-N 2.9Å
255Y78.7Confident82Confident154 Ų15475.3 Ų75.360%0.60440%0.398SS*.SBendtrans-84.7119-180-64.9-75.6000111.8E251 N257 A258 R259E251-Y255 WeakPolarHBondContact O-CD2 3.23Å; E251-Y255 PolarHBondContact O-N 3.24Å; Y255-N257 PolarHBondContact O-N 2.92Å; Y255-N257 VanDerWaalsContact O-N 3.11Å; Y255-A258 PolarHBondContact O-N 2.73Å; Y255-R259 PolarHBondContact O-N 2.91Å
256T61.4Low81.7Confident120 Ų12076.4 Ų76.474%0.73641%0.405SS*.THydrogen-bonded Turntrans-55.5-35.3-174.851.10000114.1
257N67.8Low81.6Confident150 Ų15081.1 Ų81.180%0.80242%0.422SS*.THydrogen-bonded Turntrans-76.7-26.4-179-64.3-10000112.4Y255Y255-N257 PolarHBondContact O-N 2.92Å; Y255-N257 VanDerWaalsContact O-N 3.11Å
258A69.8Low81.5Confident21 Ų2180 Ų8017%0.17442%0.415CS..THydrogen-bonded Turntrans-89.9-16.2178.900000113L252 Y255 K260 T261 A262L252-A258 HydrophobicContact CB-CB 4.5Å; L252-A258 HydrophobicContact CD2-CB 3.88Å; Y255-A258 PolarHBondContact O-N 2.73Å; A258-K260 VanDerWaalsContact C-N 3.28Å; A258-K260 PolarHBondContact O-N 2.96Å; A258-T261 WeakPolarHBondContact O-CB 3.34Å; A258-T261 PolarHBondContact O-N 3.37Å; A258-T261 VanDerWaalsContact O-N 3.08Å; A258-A262 PolarHBondContact O-N 3.12Å
259R69.5Low81.5Confident156 Ų15678.2 Ų78.259%0.58941%0.407SS*.Hα-helixtrans-59.5-33.5-175.9-169172.7179.4158.91.3114Y255 A262 T263Y255-R259 PolarHBondContact O-N 2.91Å; R259-A262 PolarHBondContact O-N 3.11Å; R259-T263 PolarHBondContact O-N 2.96Å
260K75.1Confident81.6Confident176 Ų17677.2 Ų77.277%0.76540%0.404SS*.Hα-helixtrans-64.3-43.7175.8-71.4-174.2178.4-177.50111.5A258 T263A258-K260 VanDerWaalsContact C-N 3.28Å; A258-K260 PolarHBondContact O-N 2.96Å; K260-T263 PolarHBondContact O-OG1 2.9Å
261T73.4Confident81.5Confident37 Ų3777.8 Ų77.823%0.22740%0.4CS..Hα-helixtrans-68.1-38.2175.4-450000111.1A258 T263 T264 L265 Q318A258-T261 WeakPolarHBondContact O-CB 3.34Å; A258-T261 PolarHBondContact O-N 3.37Å; A258-T261 VanDerWaalsContact O-N 3.08Å; T261-T263 VanDerWaalsContact C-N 3.27Å; T261-T263 PolarHBondContact O-N 3.11Å; T261-T264 PolarHBondContact O-N 3.42Å; T261-T264 PolarHBondContact O-OG1 3.1Å; T261-L265 HydrophobicContact CG2-CD1 4.29Å; T261-L265 WeakPolarHBondContact O-CG 3.12Å; T261-Q318 HydrophobicContact CG2-CB 3.89Å; T261-Q318 HydrophobicContact CG2-CG 4.02Å
262A75.1Confident81.6Confident0 Ų075.4 Ų75.40%039%0.389CS..Hα-helixtrans-60.3-35.917900000112.7L252 L253 A258 R259 T264 L265L252-A262 HydrophobicContact CB-CB 3.99Å; L253-A262 HydrophobicContact CD2-CB 3.82Å; L253-A262 HydrophobicContact CG-CB 4.29Å; A258-A262 PolarHBondContact O-N 3.12Å; R259-A262 PolarHBondContact O-N 3.11Å; A262-T264 PolarHBondContact O-N 3.19Å; A262-L265 PolarHBondContact O-N 3.25Å
263T76.3Confident81.8Confident104 Ų10477.5 Ų77.564%0.63841%0.405SS*.THydrogen-bonded Turntrans-69.3-14.9-179.949.90000114.7R259 K260 T261R259-T263 PolarHBondContact O-N 2.96Å; K260-T263 PolarHBondContact O-OG1 2.9Å; T261-T263 VanDerWaalsContact C-N 3.27Å; T261-T263 PolarHBondContact O-N 3.11Å
264T83.4Confident82.1Confident100 Ų10076.5 Ų76.561%0.61340%0.399SS*.THydrogen-bonded Turntrans-97.3-7.9176.1610000112.7T261 A262T261-T264 PolarHBondContact O-N 3.42Å; T261-T264 PolarHBondContact O-OG1 3.1Å; A262-T264 PolarHBondContact O-N 3.19Å
265L88.6Confident82.5Confident12 Ų1273.7 Ų73.76%0.06338%0.383CS..SBendtrans-97.9148.2-177.2-65.4170.9000111.2W245 Y249 L252 T261 A262W245-L265 HydrophobicContact CH2-CB 4.47Å; W245-L265 HydrophobicContact CH2-CD1 4.24Å; W245-L265 HydrophobicContact CZ2-CB 4.31Å; Y249-L265 HydrophobicContact CE2-CB 4.26Å; L252-L265 HydrophobicContact CD1-CD1 3.91Å; T261-L265 HydrophobicContact CG2-CD1 4.29Å; T261-L265 WeakPolarHBondContact O-CG 3.12Å; A262-L265 PolarHBondContact O-N 3.25Å
266P89Confident83.2Confident26 Ų2669.8 Ų69.817%0.16937%0.371CS..  trans-70.7137177.130-35000111.4W245 S268 Q272W245-P266 VanDerWaalsContact CZ2-O 3.32Å; W245-P266 WeakPolarHBondContact CZ2-O 3.39Å; W245-P266 PolarHBondContact NE1-O 2.73Å; P266-S268 VanDerWaalsContact C-N 3.28Å; P266-S268 PolarHBondContact O-N 3.12Å; P266-Q272 HydrophobicContact CB-CG 3.97Å; P266-Q272 HydrophobicContact CG-CG 3.73Å
267E90.1Very high84.8Confident145 Ų14564.1 Ų64.168%0.67834%0.336SS*.SBendtrans-64.4-34177.6-176.6177177.600112.4W245 Y249W245-E267 PolarHBondContact NE1-O 3.31Å; Y249-E267 HydrophobicContact CD1-CG 4.2Å; Y249-E267 HydrophobicContact CE1-CB 4.04Å; Y249-E267 HydrophobicContact CE1-CG 3.86Å
268S92.3Very high86.1Confident42 Ų4257 Ų5729%0.29430%0.298SS..  trans-112.8139.8179.2165.20000110.4E242 P266 L270 Q272E242-S268 PolarHBondContact OE1-OG 3.36Å; P266-S268 VanDerWaalsContact C-N 3.28Å; P266-S268 PolarHBondContact O-N 3.12Å; S268-L270 WeakPolarHBondContact OG-CB 3.47Å; S268-L270 PolarHBondContact OG-N 3.36Å; S268-Q272 VanDerWaalsContact O-CG 3.28Å; S268-Q272 WeakPolarHBondContact O-CG 3.45Å; S268-Q272 PolarHBondContact O-NE2 2.61Å
269L93.4Very high87.2Confident1 Ų156 Ų561%0.00529%0.29CS..SBendtrans-79.2-27.6174.6-174.361.5000111.2Q238 E242 W245 Q272 T277 A280Q238-L269 HydrophobicContact CB-CD2 4.37Å; Q238-L269 HydrophobicContact CB-CG 4.05Å; Q238-L269 HydrophobicContact CG-CG 3.99Å; Q238-L269 WeakPolarHBondContact CG-O 3.18Å; Q238-L269 PolarHBondContact NE2-O 3.42Å; Q238-L269 PolarHBondContact OE1-O 2.92Å; E242-L269 VanDerWaalsContact OE2-CA 3.32Å; E242-L269 WeakPolarHBondContact OE2-CA 3.25Å; E242-L269 WeakPolarHBondContact OE2-CB 3.23Å; E242-L269 PolarHBondContact OE2-N 3.38Å; W245-L269 HydrophobicContact CB-CB 4.03Å; W245-L269 HydrophobicContact CB-CD2 4.31Å; W245-L269 HydrophobicContact CG-CB 3.87Å; L269-Q272 WeakPolarHBondContact O-CB 3.27Å; L269-Q272 VanDerWaalsContact O-CG 3.29Å; L269-Q272 WeakPolarHBondContact O-CG 3.46Å; L269-Q272 PolarHBondContact O-N 2.71Å; L269-T277 HydrophobicContact CD1-CG2 4.21Å; L269-A280 HydrophobicContact CD1-CB 3.51Å
270L92.9Very high88.4Confident10 Ų1048.7 Ų48.75%0.05226%0.263CS..THydrogen-bonded Turntrans-56.5142.3174.5-61.4175.6000112.1L195 V200 Q238 N239 E242 S268 Q272L195-L270 HydrophobicContact CD2-CB 4.29Å; L195-L270 HydrophobicContact CG-CD1 4.48Å; V200-L270 HydrophobicContact CG2-CD1 4.46Å; V200-L270 HydrophobicContact CG2-CD2 3.9Å; Q238-L270 HydrophobicContact CB-CD2 4.09Å; N239-L270 HydrophobicContact CB-CD2 4.17Å; E242-L270 HydrophobicContact CG-CD1 4.43Å; E242-L270 HydrophobicContact CG-CG 4.26Å; E242-L270 PolarHBondContact OE2-N 3.16Å; S268-L270 WeakPolarHBondContact OG-CB 3.47Å; S268-L270 PolarHBondContact OG-N 3.36Å; L270-Q272 PolarHBondContact O-N 2.85Å; L270-Q272 VanDerWaalsContact O-N 3.1Å
271M89.6Confident89.3Confident78 Ų7840.3 Ų40.338%0.38423%0.227SC..THydrogen-bonded Turntrans63.16.6178.5-67.9-64.1-60.200115.2L192 L195 L235L192-M271 HydrophobicContact CB-CE 4Å; L192-M271 HydrophobicContact CB-SD 4.18Å; L192-M271 HydrophobicContact CD1-CE 4.48Å; L192-M271 HydrophobicContact CD2-CE 4.15Å; L192-M271 HydrophobicContact CD2-SD 3.56Å; L192-M271 VanDerWaalsContact CD2-SD 3.56Å; L192-M271 HydrophobicContact CG-CE 4.44Å; L192-M271 HydrophobicContact CG-SD 4.39Å; L195-M271 HydrophobicContact CB-CG 4.39Å; L195-M271 HydrophobicContact CD2-CG 3.78Å; L195-M271 HydrophobicContact CD2-SD 4.01Å; L235-M271 HydrophobicContact CD2-CG 4.43Å; L235-M271 HydrophobicContact CD2-SD 3.85Å
272Q91.3Very high90.3Very high52 Ų5238.7 Ų38.724%0.24322%0.217CC..  trans-72148.6174.2-62-51.2-47.300110.5Q238 P266 S268 L269 L270 E276Q238-Q272 PolarHBondContact NE2-O 3.25Å; P266-Q272 HydrophobicContact CB-CG 3.97Å; P266-Q272 HydrophobicContact CG-CG 3.73Å; S268-Q272 VanDerWaalsContact O-CG 3.28Å; S268-Q272 WeakPolarHBondContact O-CG 3.45Å; S268-Q272 PolarHBondContact O-NE2 2.61Å; L269-Q272 WeakPolarHBondContact O-CB 3.27Å; L269-Q272 VanDerWaalsContact O-CG 3.29Å; L269-Q272 WeakPolarHBondContact O-CG 3.46Å; L269-Q272 PolarHBondContact O-N 2.71Å; L270-Q272 PolarHBondContact O-N 2.85Å; L270-Q272 VanDerWaalsContact O-N 3.1Å; Q272-E276 HydrophobicContact CB-CB 3.92Å
273P90.8Very high91.1Very high68 Ų6839.2 Ų39.244%0.44222%0.219SC..  trans-64.9165.817328.7-35.3000111.1C275 E276 T277P273-C275 VanDerWaalsContact C-N 3.27Å; P273-C275 PolarHBondContact O-N 3.06Å; P273-E276 HydrophobicContact CG-CB 4.01Å; P273-E276 HydrophobicContact CG-CG 3.69Å; P273-E276 PolarHBondContact O-N 3.29Å; P273-T277 PolarHBondContact O-N 3.13Å; P273-T277 PolarHBondContact O-OG1 2.86Å
274L92Very high91.9Very high44 Ų4435 Ų3523%0.2319%0.192CC..Hα-helixtrans-56.4-39.2-179.4-178.158.1000112.9I234 T277 L278 L297 F301 I303I234-L274 HydrophobicContact CD1-CB 3.96Å; I234-L274 HydrophobicContact CD1-CD1 4.04Å; L274-T277 PolarHBondContact O-N 3.04Å; L274-L278 HydrophobicContact CD1-CD1 4.3Å; L274-L278 HydrophobicContact CD1-CG 4.24Å; L274-L278 HydrophobicContact CG-CD1 4.11Å; L274-L278 WeakPolarHBondContact O-CB 3.46Å; L274-L278 VanDerWaalsContact O-CG 3.25Å; L274-L278 WeakPolarHBondContact O-CG 3.5Å; L274-L278 PolarHBondContact O-N 2.78Å; L274-L297 HydrophobicContact CD1-CD1 4.46Å; L274-L297 HydrophobicContact CD1-CD2 3.8Å; L274-L297 HydrophobicContact CD1-CG 3.88Å; L274-F301 HydrophobicContact CD1-CD2 3.96Å; L274-F301 HydrophobicContact CD1-CE2 4.31Å; L274-F301 HydrophobicContact CD1-CG 4.13Å; L274-F301 HydrophobicContact CD2-CB 3.69Å; L274-F301 HydrophobicContact CD2-CD1 3.88Å; L274-F301 HydrophobicContact CD2-CD2 4.39Å; L274-F301 HydrophobicContact CD2-CG 3.73Å; L274-I303 HydrophobicContact CD2-CD1 3.67Å; L274-I303 HydrophobicContact CD2-CG1 4.16Å; L274-I303 HydrophobicContact CG-CD1 4.08Å
275C92.2Very high92.3Very high51 Ų5132.5 Ų32.535%0.34518%0.175SC..Hα-helixtrans-60.3-49.7176.851.60000112.5P273 T277 L278 G279 L311P273-C275 VanDerWaalsContact C-N 3.27Å; P273-C275 PolarHBondContact O-N 3.06Å; C275-T277 VanDerWaalsContact C-N 3.32Å; C275-T277 PolarHBondContact O-N 3.44Å; C275-L278 PolarHBondContact O-N 3.16Å; C275-G279 PolarHBondContact O-N 2.73Å; C275-L311 HydrophobicContact CB-CD2 3.55Å
276E93Very high92.2Very high73 Ų7338.7 Ų38.734%0.34120%0.204SC..Hα-helixtrans-65.5-37.7177.7-69.7-55.4148.400111.6Q272 P273 G279 A280Q272-E276 HydrophobicContact CB-CB 3.92Å; P273-E276 HydrophobicContact CG-CB 4.01Å; P273-E276 HydrophobicContact CG-CG 3.69Å; P273-E276 PolarHBondContact O-N 3.29Å; E276-G279 PolarHBondContact O-N 3.15Å; E276-A280 WeakPolarHBondContact O-CB 3.37Å; E276-A280 PolarHBondContact O-N 3.17Å
277T95Very high92.2Very high0 Ų039 Ų390%021%0.206CC..Hα-helixtrans-63.1-46.9176-53.10000111.2Q238 L269 P273 L274 C275 G279 A280 L281 L297Q238-T277 HydrophobicContact CG-CG2 3.88Å; Q238-T277 PolarHBondContact NE2-OG1 3.27Å; L269-T277 HydrophobicContact CD1-CG2 4.21Å; P273-T277 PolarHBondContact O-N 3.13Å; P273-T277 PolarHBondContact O-OG1 2.86Å; L274-T277 PolarHBondContact O-N 3.04Å; C275-T277 VanDerWaalsContact C-N 3.32Å; C275-T277 PolarHBondContact O-N 3.44Å; T277-G279 VanDerWaalsContact C-N 3.32Å; T277-G279 PolarHBondContact O-N 3.42Å; T277-A280 PolarHBondContact O-N 2.61Å; T277-L281 HydrophobicContact CG2-CD1 4.27Å; T277-L281 WeakPolarHBondContact O-CD1 3.26Å; T277-L281 WeakPolarHBondContact O-CG 3.41Å; T277-L281 PolarHBondContact O-N 2.93Å; T277-L297 HydrophobicContact CG2-CD2 3.69Å
278L95.1Very high92.2Very high0 Ų032.2 Ų32.20%018%0.175CC..Hα-helixtrans-60.4-43.7175-73.5168.4000111.7L274 C275 L281 A282 A294 L297 I303 F308 L311L274-L278 HydrophobicContact CD1-CD1 4.3Å; L274-L278 HydrophobicContact CD1-CG 4.24Å; L274-L278 HydrophobicContact CG-CD1 4.11Å; L274-L278 WeakPolarHBondContact O-CB 3.46Å; L274-L278 VanDerWaalsContact O-CG 3.25Å; L274-L278 WeakPolarHBondContact O-CG 3.5Å; L274-L278 PolarHBondContact O-N 2.78Å; C275-L278 PolarHBondContact O-N 3.16Å; L278-L281 PolarHBondContact O-N 3.26Å; L278-A282 WeakPolarHBondContact O-CB 3.37Å; L278-A282 PolarHBondContact O-N 2.8Å; L278-A294 HydrophobicContact CD2-CB 4.2Å; L278-A294 WeakPolarHBondContact CD2-O 3.41Å; L278-L297 HydrophobicContact CD2-CB 3.94Å; L278-L297 HydrophobicContact CD2-CD2 3.95Å; L278-L297 HydrophobicContact CD2-CG 4.13Å; L278-L297 HydrophobicContact CG-CD2 4.28Å; L278-I303 HydrophobicContact CD1-CD1 3.46Å; L278-I303 VanDerWaalsContact CD1-CD1 3.46Å; L278-F308 HydrophobicContact CD2-CE2 4.18Å; L278-L311 HydrophobicContact CD1-CD1 3.84Å
279G93.7Very high92Very high1 Ų135.4 Ų35.41%0.0118%0.183CC..Hα-helixtrans-60.7-44.717600000112.3C275 E276 T277 A282 R283C275-G279 PolarHBondContact O-N 2.73Å; E276-G279 PolarHBondContact O-N 3.15Å; T277-G279 VanDerWaalsContact C-N 3.32Å; T277-G279 PolarHBondContact O-N 3.42Å; G279-A282 PolarHBondContact O-N 2.64Å; G279-R283 VanDerWaalsContact CA-NH1 3.25Å; G279-R283 WeakPolarHBondContact O-CG 3.23Å; G279-R283 PolarHBondContact O-N 3.23Å; G279-R283 VanDerWaalsContact O-N 3.07Å; G279-R283 PolarHBondContact O-NH1 3.16Å
280A94Very high91.7Very high3 Ų340 Ų403%0.02521%0.211CC..Hα-helixtrans-60.7-45.4177.900000111.3W245 L269 E276 T277 R283 M284W245-A280 HydrophobicContact CD2-CB 4.16Å; W245-A280 HydrophobicContact CE3-CB 3.66Å; W245-A280 HydrophobicContact CH2-CB 3.96Å; W245-A280 HydrophobicContact CZ2-CB 4.45Å; W245-A280 HydrophobicContact CZ3-CB 3.54Å; L269-A280 HydrophobicContact CD1-CB 3.51Å; E276-A280 WeakPolarHBondContact O-CB 3.37Å; E276-A280 PolarHBondContact O-N 3.17Å; T277-A280 PolarHBondContact O-N 2.61Å; A280-R283 PolarHBondContact O-N 3.46Å; A280-M284 WeakPolarHBondContact O-CG 3.36Å; A280-M284 PolarHBondContact O-N 2.99Å
281L94.9Very high91.5Very high0 Ų045.7 Ų45.70%024%0.242CC..Hα-helixtrans-61.8-44.7176.8-64.6165.5000112.1Y237 Y241 T277 L278 R283 M284 D285 R293 A294 L297Y237-L281 HydrophobicContact CD1-CD1 4.2Å; Y237-L281 HydrophobicContact CE1-CD1 3.51Å; Y237-L281 HydrophobicContact CE1-CD2 4.02Å; Y237-L281 HydrophobicContact CE1-CG 4.4Å; Y241-L281 HydrophobicContact CD2-CD2 3.82Å; Y241-L281 HydrophobicContact CE2-CD2 4.24Å; Y241-L281 HydrophobicContact CG-CD2 4.17Å; T277-L281 HydrophobicContact CG2-CD1 4.27Å; T277-L281 WeakPolarHBondContact O-CD1 3.26Å; T277-L281 WeakPolarHBondContact O-CG 3.41Å; T277-L281 PolarHBondContact O-N 2.93Å; L278-L281 PolarHBondContact O-N 3.26Å; L281-R283 VanDerWaalsContact C-N 3.27Å; L281-R283 PolarHBondContact O-N 2.87Å; L281-M284 HydrophobicContact CD2-CE 3.95Å; L281-M284 PolarHBondContact O-N 3.22Å; L281-D285 WeakPolarHBondContact O-CB 3.46Å; L281-D285 PolarHBondContact O-N 2.92Å; L281-R293 HydrophobicContact CB-CB 4.3Å; L281-R293 HydrophobicContact CD1-CB 4.37Å; L281-R293 HydrophobicContact CD2-CB 3.92Å; L281-R293 HydrophobicContact CG-CB 4.41Å; L281-A294 HydrophobicContact CB-CB 4.2Å; L281-L297 HydrophobicContact CD1-CB 4.29Å; L281-L297 HydrophobicContact CD1-CD2 3.64Å
282A94.2Very high91.7Very high3 Ų342.5 Ų42.53%0.02523%0.228CC..Hα-helixtrans-60.8-36.7177.800000112.4L278 G279 Q286 V288 L312 P315L278-A282 WeakPolarHBondContact O-CB 3.37Å; L278-A282 PolarHBondContact O-N 2.8Å; G279-A282 PolarHBondContact O-N 2.64Å; A282-Q286 PolarHBondContact O-N 3.44Å; A282-V288 HydrophobicContact CB-CG1 3.54Å; A282-L312 HydrophobicContact CB-CD2 3.74Å; A282-P315 HydrophobicContact CB-CB 4.36Å
283R92Very high91.8Very high11 Ų1141.6 Ų41.64%0.04222%0.222CC..Hα-helixtrans-70.1-45.5175.9-71.6179.5-170.982.6-9.6112Y248 G279 A280 L281 Q286 P315Y248-R283 HydrophobicContact CE1-CB 3.76Å; G279-R283 VanDerWaalsContact CA-NH1 3.25Å; G279-R283 WeakPolarHBondContact O-CG 3.23Å; G279-R283 PolarHBondContact O-N 3.23Å; G279-R283 VanDerWaalsContact O-N 3.07Å; G279-R283 PolarHBondContact O-NH1 3.16Å; A280-R283 PolarHBondContact O-N 3.46Å; L281-R283 VanDerWaalsContact C-N 3.27Å; L281-R283 PolarHBondContact O-N 2.87Å; R283-Q286 PolarHBondContact O-N 2.94Å; R283-P315 HydrophobicContact CG-CB 4.45Å
284M92.5Very high92Very high16 Ų1638.4 Ų38.48%0.07920%0.201CC..Hα-helixtrans-67.5-41.9179.4-69.8-172.4-65.600112.6E244 W245 Y248 A280 L281 Q286E244-M284 HydrophobicContact CB-SD 4.1Å; E244-M284 HydrophobicContact CG-SD 3.89Å; W245-M284 WeakPolarHBondContact CA-SD 3.47Å; W245-M284 HydrophobicContact CB-CE 4.39Å; W245-M284 HydrophobicContact CB-SD 3.9Å; W245-M284 HydrophobicContact CE3-CE 4.4Å; W245-M284 HydrophobicContact CE3-CG 4.04Å; W245-M284 HydrophobicContact CE3-SD 3.99Å; W245-M284 PolarHBondContact N-SD 3.3Å; W245-M284 VanDerWaalsContact N-SD 3.41Å; Y248-M284 HydrophobicContact CD1-CG 4.2Å; Y248-M284 HydrophobicContact CG-CG 4.02Å; A280-M284 WeakPolarHBondContact O-CG 3.36Å; A280-M284 PolarHBondContact O-N 2.99Å; L281-M284 HydrophobicContact CD2-CE 3.95Å; L281-M284 PolarHBondContact O-N 3.22Å; M284-Q286 PolarHBondContact O-N 3.26Å
285D91.7Very high92.1Very high47 Ų4738.2 Ų38.225%0.25120%0.199SC..Hα-helixtrans-66.2-25.2178.6-79.3-16.5000112.5L281 S287 R293L281-D285 WeakPolarHBondContact O-CB 3.46Å; L281-D285 PolarHBondContact O-N 2.92Å; D285-S287 VanDerWaalsContact CB-O 3.23Å; D285-S287 WeakPolarHBondContact CB-O 3.41Å; D285-S287 PolarHBondContact O-N 3.02Å; D285-R293 IonicContact OD1-CZ 2.66Å; D285-R293 IonicContact OD1-NE 2.75Å; D285-R293 PolarHBondContact OD1-NE 3.47Å; D285-R293 IonicContact OD1-NH2 3.36Å; D285-R293 PolarHBondContact OD1-NH2 3.28Å; D285-R293 WeakPolarHBondContact OD2-CB 3.23Å; D285-R293 PolarHBondContact OD2-N 3.39Å; D285-R293 IonicContact OD2-NE 3.06Å
286Q86.1Confident92.2Very high142 Ų14239 Ų3966%0.66420%0.203SC*.SBendtrans53.38.3-167.4-57.5-179.6300113.6A282 R283 M284 N321A282-Q286 PolarHBondContact O-N 3.44Å; R283-Q286 PolarHBondContact O-N 2.94Å; M284-Q286 PolarHBondContact O-N 3.26Å; Q286-N321 PolarHBondContact O-ND2 3.4Å
287S90.3Very high92.2Very high31 Ų3135.6 Ų35.622%0.21719%0.186CC..  trans-153.8139.9172.8-1720000112D285 K289 D324D285-S287 VanDerWaalsContact CB-O 3.23Å; D285-S287 WeakPolarHBondContact CB-O 3.41Å; D285-S287 PolarHBondContact O-N 3.02Å; S287-K289 WeakPolarHBondContact OG-CD 3.33Å; S287-K289 WeakPolarHBondContact OG-CG 3.46Å; S287-K289 PolarHBondContact OG-N 3.47Å; S287-D324 VanDerWaalsContact C-OD2 3.3Å; S287-D324 WeakPolarHBondContact CA-OD2 3.4Å; S287-D324 VanDerWaalsContact CB-OD2 3.32Å; S287-D324 WeakPolarHBondContact CB-OD2 3.41Å; S287-D324 PolarHBondContact OG-OD2 3.45Å
288V89.3Confident92.2Very high4 Ų435.7 Ų35.72%0.02419%0.187CC..  trans-11224.6177.7-65.60000112.1A282 L312 L316 D324 I328A282-V288 HydrophobicContact CB-CG1 3.54Å; V288-L312 HydrophobicContact CB-CD1 4.02Å; V288-L312 HydrophobicContact CG1-CD1 3.93Å; V288-L312 HydrophobicContact CG1-CD2 4.37Å; V288-L312 HydrophobicContact CG2-CD1 4.29Å; V288-L316 HydrophobicContact CG1-CD2 4.27Å; V288-L316 HydrophobicContact CG2-CD1 4Å; V288-L316 HydrophobicContact CG2-CD2 4.07Å; V288-D324 HydrophobicContact CG2-CB 3.85Å; V288-D324 PolarHBondContact N-OD2 2.96Å; V288-I328 HydrophobicContact CG2-CG2 3.6Å
289K88Confident92.1Very high109 Ų10941.5 Ų41.547%0.47421%0.213SC..SBendtrans-65.4178.1175.1-70.8172.8-170.2167.20112S287 N291 S292 D324 F327S287-K289 WeakPolarHBondContact OG-CD 3.33Å; S287-K289 WeakPolarHBondContact OG-CG 3.46Å; S287-K289 PolarHBondContact OG-N 3.47Å; K289-N291 PolarHBondContact O-N 2.9Å; K289-S292 VanDerWaalsContact O-CB 3.25Å; K289-S292 WeakPolarHBondContact O-CB 3.23Å; K289-S292 PolarHBondContact O-N 3.27Å; K289-S292 PolarHBondContact O-OG 3.18Å; K289-S292 VanDerWaalsContact O-OG 3.09Å; K289-D324 WeakPolarHBondContact CE-OD1 3.22Å; K289-D324 IonicContact NZ-OD1 3.73Å; K289-F327 HydrophobicContact CB-CE1 4.47Å; K289-F327 HydrophobicContact CG-CD1 4.26Å; K289-F327 HydrophobicContact CG-CE1 4.16Å; K289-F327 HydrophobicContact CG-CZ 4.45Å
290T87.1Confident92Very high96 Ų9647.1 Ų47.159%0.58924%0.237SC*.THydrogen-bonded Turntrans-53129.8-178.3-49.20000111.8S292 E295T290-S292 VanDerWaalsContact C-N 3.33Å; T290-E295 WeakPolarHBondContact CA-OE2 3.45Å
291N89.2Confident91.9Very high130 Ų13048.6 Ų48.670%0.69524%0.243SC*.THydrogen-bonded Turntrans68.618.7-174.8-49.2-47.2000115.6K289 E295K289-N291 PolarHBondContact O-N 2.9Å; N291-E295 PolarHBondContact N-OE2 3.23Å
292S93.3Very high91.8Very high12 Ų1257.8 Ų57.88%0.08428%0.283CS..  trans-58.6158.4166.5610000111.4K289 T290 A294 E295 T296K289-S292 VanDerWaalsContact O-CB 3.25Å; K289-S292 WeakPolarHBondContact O-CB 3.23Å; K289-S292 PolarHBondContact O-N 3.27Å; K289-S292 PolarHBondContact O-OG 3.18Å; K289-S292 VanDerWaalsContact O-OG 3.09Å; T290-S292 VanDerWaalsContact C-N 3.33Å; S292-A294 VanDerWaalsContact C-N 3.25Å; S292-A294 PolarHBondContact O-N 3.24Å; S292-E295 PolarHBondContact O-N 3.38Å; S292-E295 WeakPolarHBondContact OG-CB 3.4Å; S292-E295 PolarHBondContact OG-N 3.4Å; S292-T296 WeakPolarHBondContact O-CB 3.46Å; S292-T296 PolarHBondContact O-N 2.86Å; S292-T296 PolarHBondContact O-OG1 3.11Å
293R94.6Very high91.7Very high33 Ų3359 Ų5913%0.12529%0.288CS..Hα-helixtrans-64.9-35.5178.6-67.3-178.6-74-171.2-11.5111.1Y237 Y241 E244 L281 D285 L297Y237-R293 PolarHBondContact OH-O 2.78Å; Y241-R293 VanDerWaalsContact CE1-NH1 3.28Å; Y241-R293 WeakPolarHBondContact OH-CD 3.45Å; E244-R293 IonicContact OE1-CZ 2.71Å; E244-R293 IonicContact OE1-NH1 3.37Å; E244-R293 PolarHBondContact OE1-NH1 3.44Å; E244-R293 IonicContact OE1-NH2 3.8Å; E244-R293 PolarHBondContact OE1-NH2 3.14Å; E244-R293 IonicContact OE2-CZ 3.32Å; E244-R293 IonicContact OE2-NH1 3.06Å; E244-R293 PolarHBondContact OE2-NH1 3.11Å; E244-R293 IonicContact OE2-NH2 2.78Å; L281-R293 HydrophobicContact CB-CB 4.3Å; L281-R293 HydrophobicContact CD1-CB 4.37Å; L281-R293 HydrophobicContact CD2-CB 3.92Å; L281-R293 HydrophobicContact CG-CB 4.41Å; D285-R293 IonicContact OD1-CZ 2.66Å; D285-R293 IonicContact OD1-NE 2.75Å; D285-R293 PolarHBondContact OD1-NE 3.47Å; D285-R293 IonicContact OD1-NH2 3.36Å; D285-R293 PolarHBondContact OD1-NH2 3.28Å; D285-R293 WeakPolarHBondContact OD2-CB 3.23Å; D285-R293 PolarHBondContact OD2-N 3.39Å; D285-R293 IonicContact OD2-NE 3.06Å; R293-L297 WeakPolarHBondContact O-CB 3.43Å; R293-L297 PolarHBondContact O-N 2.97Å
294A94.4Very high91.7Very high0 Ų060.9 Ų60.90%030%0.303CS..Hα-helixtrans-62.6-49.1174.500000111.5L278 L281 S292 T296 L297 G298 F308 L312L278-A294 HydrophobicContact CD2-CB 4.2Å; L278-A294 WeakPolarHBondContact CD2-O 3.41Å; L281-A294 HydrophobicContact CB-CB 4.2Å; S292-A294 VanDerWaalsContact C-N 3.25Å; S292-A294 PolarHBondContact O-N 3.24Å; A294-T296 VanDerWaalsContact C-N 3.34Å; A294-T296 PolarHBondContact O-N 3.34Å; A294-L297 PolarHBondContact O-N 3.39Å; A294-G298 PolarHBondContact O-N 2.88Å; A294-F308 HydrophobicContact CB-CZ 4.37Å; A294-F308 WeakPolarHBondContact O-CE2 3.44Å; A294-L312 HydrophobicContact CB-CD2 4.5Å
295E93.5Very high91.6Very high41 Ų4165.2 Ų65.219%0.19233%0.327CS..Hα-helixtrans-62.5-41.6178.6-168.4-164-168.100111.7T290 N291 S292 L297 G298 K299 F308T290-E295 WeakPolarHBondContact CA-OE2 3.45Å; N291-E295 PolarHBondContact N-OE2 3.23Å; S292-E295 PolarHBondContact O-N 3.38Å; S292-E295 WeakPolarHBondContact OG-CB 3.4Å; S292-E295 PolarHBondContact OG-N 3.4Å; E295-L297 PolarHBondContact O-N 2.86Å; E295-G298 PolarHBondContact O-N 3.42Å; E295-K299 HydrophobicContact CG-CD 4.36Å; E295-K299 WeakPolarHBondContact O-CG 3.37Å; E295-K299 PolarHBondContact O-N 3.32Å; E295-K299 VanDerWaalsContact OE1-CE 3.23Å; E295-K299 WeakPolarHBondContact OE1-CE 3.43Å; E295-K299 IonicContact OE1-NZ 2.73Å; E295-K299 PolarHBondContact OE1-NZ 3.17Å; E295-K299 IonicContact OE2-NZ 3.16Å; E295-K299 PolarHBondContact OE2-NZ 3.46Å; E295-F308 HydrophobicContact CB-CZ 4.1Å
296T93.9Very high91.6Very high68 Ų6867.4 Ų67.442%0.41734%0.336SS..Hα-helixtrans-61.3-45.3178.1-57.80000111.3S292 A294 K300S292-T296 WeakPolarHBondContact O-CB 3.46Å; S292-T296 PolarHBondContact O-N 2.86Å; S292-T296 PolarHBondContact O-OG1 3.11Å; A294-T296 VanDerWaalsContact C-N 3.34Å; A294-T296 PolarHBondContact O-N 3.34Å; T296-K300 PolarHBondContact O-N 3.33Å; T296-K300 VanDerWaalsContact O-N 3.07Å
297L94.1Very high91.8Very high0 Ų066 Ų660%033%0.329CS..Hα-helixtrans-65.2-44.8176.4-174.564.2000111.4Y237 L274 T277 L278 L281 R293 A294 E295 K299 K300 F301Y237-L297 HydrophobicContact CD1-CD1 3.94Å; Y237-L297 HydrophobicContact CD1-CD2 4.01Å; Y237-L297 HydrophobicContact CD1-CG 4.44Å; Y237-L297 HydrophobicContact CD2-CD1 4.07Å; Y237-L297 HydrophobicContact CE1-CB 4.11Å; Y237-L297 HydrophobicContact CE1-CD1 4.19Å; Y237-L297 HydrophobicContact CE1-CD2 4.07Å; Y237-L297 HydrophobicContact CE1-CG 4.36Å; Y237-L297 HydrophobicContact CE2-CD1 4.31Å; Y237-L297 HydrophobicContact CG-CD1 3.86Å; L274-L297 HydrophobicContact CD1-CD1 4.46Å; L274-L297 HydrophobicContact CD1-CD2 3.8Å; L274-L297 HydrophobicContact CD1-CG 3.88Å; T277-L297 HydrophobicContact CG2-CD2 3.69Å; L278-L297 HydrophobicContact CD2-CB 3.94Å; L278-L297 HydrophobicContact CD2-CD2 3.95Å; L278-L297 HydrophobicContact CD2-CG 4.13Å; L278-L297 HydrophobicContact CG-CD2 4.28Å; L281-L297 HydrophobicContact CD1-CB 4.29Å; L281-L297 HydrophobicContact CD1-CD2 3.64Å; R293-L297 WeakPolarHBondContact O-CB 3.43Å; R293-L297 PolarHBondContact O-N 2.97Å; A294-L297 PolarHBondContact O-N 3.39Å; E295-L297 PolarHBondContact O-N 2.86Å; L297-K299 VanDerWaalsContact C-N 3.34Å; L297-K299 PolarHBondContact O-N 2.96Å; L297-K300 WeakPolarHBondContact O-CB 3.43Å; L297-K300 PolarHBondContact O-N 3.25Å; L297-K300 VanDerWaalsContact O-N 3.1Å; L297-F301 HydrophobicContact CD1-CD2 3.69Å; L297-F301 HydrophobicContact CD1-CE2 3.51Å; L297-F301 HydrophobicContact CG-CD2 4.2Å; L297-F301 HydrophobicContact CG-CE2 4.41Å; L297-F301 WeakPolarHBondContact O-CD2 3.43Å; L297-F301 PolarHBondContact O-N 3.4Å; L297-F301 VanDerWaalsContact O-N 3.08Å
298G93.7Very high92Very high2 Ų265.9 Ų65.92%0.02133%0.325CS..Hα-helixtrans-58-44177.700000112.8A294 E295 F301 K302 I303A294-G298 PolarHBondContact O-N 2.88Å; E295-G298 PolarHBondContact O-N 3.42Å; G298-F301 CarbonylContact O-C 3.56Å; G298-F301 PolarHBondContact O-N 2.98Å; G298-K302 PolarHBondContact O-N 3.2Å; G298-K302 VanDerWaalsContact O-N 3.13Å; G298-I303 PolarHBondContact O-N 3.39Å
299K93.1Very high92.2Very high123 Ų12367.4 Ų67.454%0.53533%0.33SS..Hα-helixtrans-63-40.6174-73.7174.1-177.3164.30112.4E295 L297 F301 K302E295-K299 HydrophobicContact CG-CD 4.36Å; E295-K299 WeakPolarHBondContact O-CG 3.37Å; E295-K299 PolarHBondContact O-N 3.32Å; E295-K299 VanDerWaalsContact OE1-CE 3.23Å; E295-K299 WeakPolarHBondContact OE1-CE 3.43Å; E295-K299 IonicContact OE1-NZ 2.73Å; E295-K299 PolarHBondContact OE1-NZ 3.17Å; E295-K299 IonicContact OE2-NZ 3.16Å; E295-K299 PolarHBondContact OE2-NZ 3.46Å; L297-K299 VanDerWaalsContact C-N 3.34Å; L297-K299 PolarHBondContact O-N 2.96Å; K299-F301 VanDerWaalsContact C-N 3.29Å; K299-F301 PolarHBondContact O-N 3.29Å; K299-K302 PolarHBondContact O-N 2.93Å; K299-K302 VanDerWaalsContact O-N 3.11Å
300K92.4Very high92.5Very high118 Ų11865.8 Ų65.851%0.51332%0.321SS..Hα-helixtrans-60.5-40.1178.7-169.3176.4-170.7-179.20111.9V233 T296 L297 K302V233-K300 HydrophobicContact CG1-CD 3.8Å; T296-K300 PolarHBondContact O-N 3.33Å; T296-K300 VanDerWaalsContact O-N 3.07Å; L297-K300 WeakPolarHBondContact O-CB 3.43Å; L297-K300 PolarHBondContact O-N 3.25Å; L297-K300 VanDerWaalsContact O-N 3.1Å; K300-K302 VanDerWaalsContact C-N 3.32Å
301F91.4Very high92.8Very high35 Ų3564.1 Ų64.115%0.15431%0.308CS..THydrogen-bonded Turntrans-89.910.1177.4-77.7-92.9000113.8E230 V233 I234 L274 L297 G298 K299 I303E230-F301 HydrophobicContact CB-CE1 3.91Å; E230-F301 HydrophobicContact CG-CD1 4.46Å; E230-F301 HydrophobicContact CG-CE1 4.08Å; V233-F301 HydrophobicContact CB-CZ 4.2Å; V233-F301 HydrophobicContact CG1-CE2 3.75Å; V233-F301 HydrophobicContact CG1-CZ 3.67Å; I234-F301 HydrophobicContact CB-CE2 4.43Å; I234-F301 HydrophobicContact CB-CZ 3.82Å; L274-F301 HydrophobicContact CD1-CD2 3.96Å; L274-F301 HydrophobicContact CD1-CE2 4.31Å; L274-F301 HydrophobicContact CD1-CG 4.13Å; L274-F301 HydrophobicContact CD2-CB 3.69Å; L274-F301 HydrophobicContact CD2-CD1 3.88Å; L274-F301 HydrophobicContact CD2-CD2 4.39Å; L274-F301 HydrophobicContact CD2-CG 3.73Å; L297-F301 HydrophobicContact CD1-CD2 3.69Å; L297-F301 HydrophobicContact CD1-CE2 3.51Å; L297-F301 HydrophobicContact CG-CD2 4.2Å; L297-F301 HydrophobicContact CG-CE2 4.41Å; L297-F301 WeakPolarHBondContact O-CD2 3.43Å; L297-F301 PolarHBondContact O-N 3.4Å; L297-F301 VanDerWaalsContact O-N 3.08Å; G298-F301 CarbonylContact O-C 3.56Å; G298-F301 PolarHBondContact O-N 2.98Å; K299-F301 VanDerWaalsContact C-N 3.29Å; K299-F301 PolarHBondContact O-N 3.29Å; F301-I303 HydrophobicContact CB-CG1 4.12Å; F301-I303 PolarHBondContact O-N 2.93Å; F301-I303 VanDerWaalsContact O-N 3.12Å
302K92.1Very high93.1Very high193 Ų19357.9 Ų57.984%0.83928%0.275SS*.THydrogen-bonded Turntrans52.733.6178.1-54.4175.9-176.2170.10113.5G298 K299 K300 S304G298-K302 PolarHBondContact O-N 3.2Å; G298-K302 VanDerWaalsContact O-N 3.13Å; K299-K302 PolarHBondContact O-N 2.93Å; K299-K302 VanDerWaalsContact O-N 3.11Å; K300-K302 VanDerWaalsContact C-N 3.32Å; K302-S304 PolarHBondContact O-N 3.07Å
303I92.2Very high93.1Very high27 Ų2757.3 Ų57.314%0.13827%0.271CS..  trans-64.5131.3175.8-55.6-179.4000108L274 L278 G298 F301 Q307 F308 L311L274-I303 HydrophobicContact CD2-CD1 3.67Å; L274-I303 HydrophobicContact CD2-CG1 4.16Å; L274-I303 HydrophobicContact CG-CD1 4.08Å; L278-I303 HydrophobicContact CD1-CD1 3.46Å; L278-I303 VanDerWaalsContact CD1-CD1 3.46Å; G298-I303 PolarHBondContact O-N 3.39Å; F301-I303 HydrophobicContact CB-CG1 4.12Å; F301-I303 PolarHBondContact O-N 2.93Å; F301-I303 VanDerWaalsContact O-N 3.12Å; I303-Q307 HydrophobicContact CG2-CB 3.57Å; I303-F308 HydrophobicContact CG2-CB 4.02Å; I303-L311 HydrophobicContact CD1-CD1 4.22Å; I303-L311 HydrophobicContact CG2-CD1 4.39Å
304S92.1Very high93Very high52 Ų5260 Ų6036%0.36429%0.285SS..  trans-62.8149.5175.966.50000110.8K302 E306 Q307 F308K302-S304 PolarHBondContact O-N 3.07Å; S304-E306 PolarHBondContact O-N 3.46Å; S304-E306 VanDerWaalsContact O-N 3.13Å; S304-Q307 PolarHBondContact O-N 3.3Å; S304-Q307 VanDerWaalsContact O-N 3.13Å; S304-Q307 WeakPolarHBondContact OG-CB 3.46Å; S304-Q307 VanDerWaalsContact OG-CD 3.24Å; S304-Q307 WeakPolarHBondContact OG-CG 3.41Å; S304-Q307 PolarHBondContact OG-N 2.64Å; S304-Q307 PolarHBondContact OG-OE1 2.72Å; S304-F308 WeakPolarHBondContact O-CB 3.37Å; S304-F308 PolarHBondContact O-N 3.03Å
305D90.8Very high92.9Very high107 Ų10760.4 Ų60.457%0.57229%0.287SS*.Hα-helixtrans-54.6-36179-723.7000112.5R309D305-R309 VanDerWaalsContact C-NH1 3.26Å; D305-R309 VanDerWaalsContact CB-NH1 3.32Å; D305-R309 VanDerWaalsContact O-CG 3.28Å; D305-R309 WeakPolarHBondContact O-CG 3.36Å; D305-R309 PolarHBondContact O-N 2.9Å; D305-R309 VanDerWaalsContact O-N 3.13Å; D305-R309 PolarHBondContact O-NH1 3.42Å; D305-R309 VanDerWaalsContact O-NH1 3.14Å; D305-R309 IonicContact OD2-NH2 3.89Å
306E91.2Very high92.9Very high93 Ų9358.5 Ų58.544%0.43528%0.279SS..Hα-helixtrans-67.3-49.5177.2175.3166.4-168.500112S304 F308 R309 W310 I343S304-E306 PolarHBondContact O-N 3.46Å; S304-E306 VanDerWaalsContact O-N 3.13Å; E306-F308 VanDerWaalsContact C-N 3.31Å; E306-F308 PolarHBondContact O-N 3.46Å; E306-R309 WeakPolarHBondContact O-CB 3.23Å; E306-R309 PolarHBondContact O-N 2.9Å; E306-W310 VanDerWaalsContact O-CD1 3.24Å; E306-W310 PolarHBondContact O-N 2.81Å; E306-W310 VanDerWaalsContact O-N 3.09Å; E306-I343 HydrophobicContact CG-CG2 4.02Å
307Q91.9Very high92.9Very high112 Ų11256 Ų5652%0.52326%0.263SS..Hα-helixtrans-60.5-43.2176.2-73.8166.8-38.700111.2I303 S304 R309 W310 L311I303-Q307 HydrophobicContact CG2-CB 3.57Å; S304-Q307 PolarHBondContact O-N 3.3Å; S304-Q307 VanDerWaalsContact O-N 3.13Å; S304-Q307 WeakPolarHBondContact OG-CB 3.46Å; S304-Q307 VanDerWaalsContact OG-CD 3.24Å; S304-Q307 WeakPolarHBondContact OG-CG 3.41Å; S304-Q307 PolarHBondContact OG-N 2.64Å; S304-Q307 PolarHBondContact OG-OE1 2.72Å; Q307-R309 VanDerWaalsContact C-N 3.28Å; Q307-R309 PolarHBondContact O-N 3.36Å; Q307-W310 PolarHBondContact O-N 3.39Å; Q307-L311 VanDerWaalsContact O-CG 3.25Å; Q307-L311 WeakPolarHBondContact O-CG 3.41Å; Q307-L311 PolarHBondContact O-N 2.93Å
308F93.7Very high92.6Very high28 Ų2858.4 Ų58.412%0.12327%0.274CS..Hα-helixtrans-57.7-42.7178.3-176.8-101.1000111.6L278 A294 E295 I303 S304 E306 L311 L312L278-F308 HydrophobicContact CD2-CE2 4.18Å; A294-F308 HydrophobicContact CB-CZ 4.37Å; A294-F308 WeakPolarHBondContact O-CE2 3.44Å; E295-F308 HydrophobicContact CB-CZ 4.1Å; I303-F308 HydrophobicContact CG2-CB 4.02Å; S304-F308 WeakPolarHBondContact O-CB 3.37Å; S304-F308 PolarHBondContact O-N 3.03Å; E306-F308 VanDerWaalsContact C-N 3.31Å; E306-F308 PolarHBondContact O-N 3.46Å; F308-L311 PolarHBondContact O-N 2.69Å; F308-L312 HydrophobicContact CD1-CD1 3.95Å; F308-L312 HydrophobicContact CE1-CD1 3.31Å; F308-L312 HydrophobicContact CE1-CG 4.34Å; F308-L312 HydrophobicContact CE2-CD1 4.16Å; F308-L312 HydrophobicContact CZ-CD1 3.44Å; F308-L312 VanDerWaalsContact CZ-CD1 3.44Å; F308-L312 HydrophobicContact CZ-CG 4.3Å; F308-L312 WeakPolarHBondContact O-CG 3.42Å; F308-L312 PolarHBondContact O-N 3.38Å
309R93.9Very high92.3Very high37 Ų3760.7 Ų60.714%0.1429%0.29CS..Hα-helixtrans-61.7-49.7175.3-76.9177.4-162103.87.7112.1D305 E306 Q307 L311 L312 I313 I328 M329 T342 I343D305-R309 VanDerWaalsContact C-NH1 3.26Å; D305-R309 VanDerWaalsContact CB-NH1 3.32Å; D305-R309 VanDerWaalsContact O-CG 3.28Å; D305-R309 WeakPolarHBondContact O-CG 3.36Å; D305-R309 PolarHBondContact O-N 2.9Å; D305-R309 VanDerWaalsContact O-N 3.13Å; D305-R309 PolarHBondContact O-NH1 3.42Å; D305-R309 VanDerWaalsContact O-NH1 3.14Å; D305-R309 IonicContact OD2-NH2 3.89Å; E306-R309 WeakPolarHBondContact O-CB 3.23Å; E306-R309 PolarHBondContact O-N 2.9Å; Q307-R309 VanDerWaalsContact C-N 3.28Å; Q307-R309 PolarHBondContact O-N 3.36Å; R309-L311 VanDerWaalsContact C-N 3.29Å; R309-L311 PolarHBondContact O-N 3.04Å; R309-L312 PolarHBondContact O-N 3.47Å; R309-L312 VanDerWaalsContact O-N 3.13Å; R309-I313 WeakPolarHBondContact O-CG1 3.37Å; R309-I313 PolarHBondContact O-N 3.49Å; R309-I328 VanDerWaalsContact CD-O 3.23Å; R309-I328 WeakPolarHBondContact CD-O 3.48Å; R309-I328 PolarHBondContact NE-O 2.88Å; R309-M329 HydrophobicContact CB-CE 3.56Å; R309-M329 HydrophobicContact CB-SD 4.25Å; R309-M329 HydrophobicContact CG-CE 4.09Å; R309-M329 WeakPolarHBondContact O-CE 3.46Å; R309-T342 WeakPolarHBondContact CD-OG1 3.16Å; R309-T342 PolarHBondContact NE-OG1 3.05Å; R309-I343 HydrophobicContact CB-CG2 4.16Å
310W93.8Very high92.2Very high74 Ų7461.7 Ų61.728%0.2830%0.296SS..Hα-helixtrans-56.9-43177.9-79.3112000112.3E306 Q307 L312 I313 I343 R347 F348 H351E306-W310 VanDerWaalsContact O-CD1 3.24Å; E306-W310 PolarHBondContact O-N 2.81Å; E306-W310 VanDerWaalsContact O-N 3.09Å; Q307-W310 PolarHBondContact O-N 3.39Å; W310-L312 PolarHBondContact O-N 3.09Å; W310-I313 HydrophobicContact CD2-CD1 4.11Å; W310-I313 HydrophobicContact CE3-CD1 3.4Å; W310-I313 HydrophobicContact CZ3-CD1 3.72Å; W310-I313 PolarHBondContact O-N 3.31Å; W310-I343 HydrophobicContact CD2-CD1 4.2Å; W310-I343 HydrophobicContact CE3-CD1 4.5Å; W310-I343 HydrophobicContact CH2-CD1 4.11Å; W310-I343 HydrophobicContact CZ2-CB 4.32Å; W310-I343 HydrophobicContact CZ2-CD1 3.8Å; W310-I343 HydrophobicContact CZ2-CG1 4.41Å; W310-I343 HydrophobicContact CZ3-CD1 4.45Å; W310-R347 HydrophobicContact CH2-CB 3.9Å; W310-R347 HydrophobicContact CZ2-CB 4.19Å; W310-F348 HydrophobicContact CH2-CB 4.35Å; W310-H351 HydrophobicContact CZ3-CB 4.12Å; W310-H351 AromaticContact CZ3-CD2 3.77Å
311L93.5Very high92.3Very high61 Ų6157.4 Ų57.432%0.31928%0.279SS..Hα-helixtrans-64.7-23179.6-69.4175.8000114C275 L278 I303 Q307 F308 R309 P315C275-L311 HydrophobicContact CB-CD2 3.55Å; L278-L311 HydrophobicContact CD1-CD1 3.84Å; I303-L311 HydrophobicContact CD1-CD1 4.22Å; I303-L311 HydrophobicContact CG2-CD1 4.39Å; Q307-L311 VanDerWaalsContact O-CG 3.25Å; Q307-L311 WeakPolarHBondContact O-CG 3.41Å; Q307-L311 PolarHBondContact O-N 2.93Å; F308-L311 PolarHBondContact O-N 2.69Å; R309-L311 VanDerWaalsContact C-N 3.29Å; R309-L311 PolarHBondContact O-N 3.04Å; L311-P315 WeakPolarHBondContact O-CD 3.48Å
312L94.7Very high92.4Very high0 Ų058.5 Ų58.50%028%0.282CS..Hα-helixtrans-96.3-11.4-178-69.6-174.5000114.4A282 V288 A294 F308 R309 W310 P315 L316 I328A282-L312 HydrophobicContact CB-CD2 3.74Å; V288-L312 HydrophobicContact CB-CD1 4.02Å; V288-L312 HydrophobicContact CG1-CD1 3.93Å; V288-L312 HydrophobicContact CG1-CD2 4.37Å; V288-L312 HydrophobicContact CG2-CD1 4.29Å; A294-L312 HydrophobicContact CB-CD2 4.5Å; F308-L312 HydrophobicContact CD1-CD1 3.95Å; F308-L312 HydrophobicContact CE1-CD1 3.31Å; F308-L312 HydrophobicContact CE1-CG 4.34Å; F308-L312 HydrophobicContact CE2-CD1 4.16Å; F308-L312 HydrophobicContact CZ-CD1 3.44Å; F308-L312 VanDerWaalsContact CZ-CD1 3.44Å; F308-L312 HydrophobicContact CZ-CG 4.3Å; F308-L312 WeakPolarHBondContact O-CG 3.42Å; F308-L312 PolarHBondContact O-N 3.38Å; R309-L312 PolarHBondContact O-N 3.47Å; R309-L312 VanDerWaalsContact O-N 3.13Å; W310-L312 PolarHBondContact O-N 3.09Å; L312-P315 WeakPolarHBondContact O-CD 3.49Å; L312-L316 HydrophobicContact CB-CD1 4.14Å; L312-L316 WeakPolarHBondContact O-CB 3.27Å; L312-L316 WeakPolarHBondContact O-CD1 3.38Å; L312-L316 WeakPolarHBondContact O-CG 3.5Å; L312-L316 PolarHBondContact O-N 3.28Å; L312-L316 VanDerWaalsContact O-N 3.11Å; L312-I328 HydrophobicContact CB-CD1 3.71Å; L312-I328 HydrophobicContact CD1-CD1 4.18Å
313I94.2Very high92.5Very high0 Ų055.1 Ų55.10%027%0.274CS..Hα-helixtrans-58.6-59.1-177.2-68.5165.6000110.6R309 W310 L316 V317 L325 M329 I343 F348 L352 L355R309-I313 WeakPolarHBondContact O-CG1 3.37Å; R309-I313 PolarHBondContact O-N 3.49Å; W310-I313 HydrophobicContact CD2-CD1 4.11Å; W310-I313 HydrophobicContact CE3-CD1 3.4Å; W310-I313 HydrophobicContact CZ3-CD1 3.72Å; W310-I313 PolarHBondContact O-N 3.31Å; I313-L316 PolarHBondContact O-N 3.4Å; I313-V317 HydrophobicContact CG2-CG2 4Å; I313-V317 WeakPolarHBondContact O-CB 3.32Å; I313-V317 VanDerWaalsContact O-CG2 3.23Å; I313-V317 WeakPolarHBondContact O-CG2 3.49Å; I313-V317 PolarHBondContact O-N 3.47Å; I313-L325 HydrophobicContact CG1-CD1 4.28Å; I313-M329 HydrophobicContact CD1-CE 3.98Å; I313-M329 HydrophobicContact CG1-CE 3.48Å; I313-M329 VanDerWaalsContact CG1-CE 3.48Å; I313-I343 HydrophobicContact CD1-CD1 4.04Å; I313-F348 HydrophobicContact CD1-CD2 3.71Å; I313-F348 HydrophobicContact CD1-CE2 3.84Å; I313-F348 HydrophobicContact CG1-CD2 4.41Å; I313-F348 HydrophobicContact CG1-CE2 4.04Å; I313-F348 HydrophobicContact CG2-CE2 4.39Å; I313-L352 HydrophobicContact CG2-CD2 3.99Å; I313-L355 HydrophobicContact CG2-CD1 3.97Å
314E92Very high92.6Very high89 Ų8954.1 Ų54.142%0.41627%0.268SS..Hα-helixtrans-61.9-45.7-175.7179.6172.1-169.700112.8L316 V317 Q318 L355E314-L316 VanDerWaalsContact C-N 3.33Å; E314-L316 PolarHBondContact O-N 2.96Å; E314-V317 PolarHBondContact O-N 2.89Å; E314-Q318 HydrophobicContact CG-CG 4.09Å; E314-Q318 VanDerWaalsContact O-CB 3.32Å; E314-Q318 WeakPolarHBondContact O-CB 3.28Å; E314-Q318 VanDerWaalsContact O-CG 3.26Å; E314-Q318 WeakPolarHBondContact O-CG 3.36Å; E314-Q318 PolarHBondContact O-N 3.25Å; E314-Q318 PolarHBondContact OE1-NE2 3.41Å; E314-L355 HydrophobicContact CB-CD1 4.28Å; E314-L355 HydrophobicContact CG-CD2 4.37Å
315P92.2Very high92.7Very high8 Ų851.6 Ų51.65%0.05225%0.251CS..Hα-helixtrans-53.3-43.6172.1-28.834.4000115A282 R283 L311 L312 S319A282-P315 HydrophobicContact CB-CB 4.36Å; R283-P315 HydrophobicContact CG-CB 4.45Å; L311-P315 WeakPolarHBondContact O-CD 3.48Å; L312-P315 WeakPolarHBondContact O-CD 3.49Å; P315-S319 WeakPolarHBondContact O-CB 3.34Å; P315-S319 PolarHBondContact O-N 3.15Å; P315-S319 PolarHBondContact O-OG 3.47Å
316L94.2Very high92.8Very high2 Ų250.4 Ų50.41%0.0124%0.242CC..Hα-helixtrans-73.6-40.5-179.6-66.3171000111.7V288 L312 I313 E314 S319 Q320 N321 D324 L325 I328V288-L316 HydrophobicContact CG1-CD2 4.27Å; V288-L316 HydrophobicContact CG2-CD1 4Å; V288-L316 HydrophobicContact CG2-CD2 4.07Å; L312-L316 HydrophobicContact CB-CD1 4.14Å; L312-L316 WeakPolarHBondContact O-CB 3.27Å; L312-L316 WeakPolarHBondContact O-CD1 3.38Å; L312-L316 WeakPolarHBondContact O-CG 3.5Å; L312-L316 PolarHBondContact O-N 3.28Å; L312-L316 VanDerWaalsContact O-N 3.11Å; I313-L316 PolarHBondContact O-N 3.4Å; E314-L316 VanDerWaalsContact C-N 3.33Å; E314-L316 PolarHBondContact O-N 2.96Å; L316-S319 CarbonylContact O-C 3.48Å; L316-S319 PolarHBondContact O-N 3.04Å; L316-Q320 PolarHBondContact O-N 3.24Å; L316-N321 HydrophobicContact CD2-CB 3.94Å; L316-N321 PolarHBondContact O-N 2.85Å; L316-D324 HydrophobicContact CD2-CB 4.11Å; L316-L325 HydrophobicContact CB-CB 4.35Å; L316-L325 HydrophobicContact CD1-CB 4.33Å; L316-L325 HydrophobicContact CD1-CD1 4.38Å; L316-I328 HydrophobicContact CD1-CD1 3.46Å; L316-I328 VanDerWaalsContact CD1-CD1 3.46Å; L316-I328 HydrophobicContact CD1-CG1 4.17Å
317V92.9Very high92.9Very high14 Ų1451 Ų519%0.08524%0.243CC..Hα-helixtrans-61.1-49175.4166.90000110.8I313 E314 S319 Q320 W322 L325 L352 L355 V357I313-V317 HydrophobicContact CG2-CG2 4Å; I313-V317 WeakPolarHBondContact O-CB 3.32Å; I313-V317 VanDerWaalsContact O-CG2 3.23Å; I313-V317 WeakPolarHBondContact O-CG2 3.49Å; I313-V317 PolarHBondContact O-N 3.47Å; E314-V317 PolarHBondContact O-N 2.89Å; V317-S319 PolarHBondContact O-N 3.14Å; V317-Q320 PolarHBondContact O-N 3.25Å; V317-W322 HydrophobicContact CB-CZ3 4.48Å; V317-W322 HydrophobicContact CG1-CH2 4.33Å; V317-W322 HydrophobicContact CG1-CZ3 4.5Å; V317-W322 HydrophobicContact CG2-CZ3 4.12Å; V317-L325 HydrophobicContact CG2-CD2 4.22Å; V317-L352 HydrophobicContact CG2-CD2 3.89Å; V317-L355 HydrophobicContact CB-CD1 4.37Å; V317-L355 HydrophobicContact CG1-CB 4.09Å; V317-L355 HydrophobicContact CG1-CD1 4.3Å; V317-L355 HydrophobicContact CG2-CD1 4.23Å; V317-V357 HydrophobicContact CB-CG2 4.42Å; V317-V357 HydrophobicContact CG1-CG2 3.54Å; V317-V357 HydrophobicContact CG2-CG2 3.93Å
318Q88.3Confident92.9Very high51 Ų5146.5 Ų46.524%0.23822%0.222CC..Hα-helixtrans-62.4-30.8178.5-73.5178.7-3.700112.5T261 E314 Q320T261-Q318 HydrophobicContact CG2-CB 3.89Å; T261-Q318 HydrophobicContact CG2-CG 4.02Å; E314-Q318 HydrophobicContact CG-CG 4.09Å; E314-Q318 VanDerWaalsContact O-CB 3.32Å; E314-Q318 WeakPolarHBondContact O-CB 3.28Å; E314-Q318 VanDerWaalsContact O-CG 3.26Å; E314-Q318 WeakPolarHBondContact O-CG 3.36Å; E314-Q318 PolarHBondContact O-N 3.25Å; E314-Q318 PolarHBondContact OE1-NE2 3.41Å; Q318-Q320 VanDerWaalsContact C-N 3.32Å
319S88.2Confident92.9Very high50 Ų5045.1 Ų45.135%0.3522%0.217SC..THydrogen-bonded Turntrans-87.60.3175.9-49.80000113.2P315 L316 V317 N321P315-S319 WeakPolarHBondContact O-CB 3.34Å; P315-S319 PolarHBondContact O-N 3.15Å; P315-S319 PolarHBondContact O-OG 3.47Å; L316-S319 CarbonylContact O-C 3.48Å; L316-S319 PolarHBondContact O-N 3.04Å; V317-S319 PolarHBondContact O-N 3.14Å; S319-N321 PolarHBondContact O-N 3.4Å
320Q91.3Very high92.9Very high144 Ų14444.2 Ų44.267%0.67321%0.214SC*.THydrogen-bonded Turntrans51.431.9-172.9-56.6-177.72900113.6L316 V317 Q318 W322L316-Q320 PolarHBondContact O-N 3.24Å; V317-Q320 PolarHBondContact O-N 3.25Å; Q318-Q320 VanDerWaalsContact C-N 3.32Å; Q320-W322 VanDerWaalsContact C-N 3.29Å; Q320-W322 HydrophobicContact CB-CZ2 4.04Å; Q320-W322 HydrophobicContact CG-CZ2 4.08Å; Q320-W322 VanDerWaalsContact O-CD1 3.28Å; Q320-W322 PolarHBondContact O-N 3.26Å; Q320-W322 VanDerWaalsContact O-N 3.07Å; Q320-W322 PolarHBondContact O-NE1 3.4Å
321N93.1Very high92.6Very high29 Ų2946.4 Ų46.416%0.15523%0.226CC..  trans-88.368.2-177.6-165.3-7.8000110.7Q286 L316 S319 D323 D324 L325Q286-N321 PolarHBondContact O-ND2 3.4Å; L316-N321 HydrophobicContact CD2-CB 3.94Å; L316-N321 PolarHBondContact O-N 2.85Å; S319-N321 PolarHBondContact O-N 3.4Å; N321-D323 VanDerWaalsContact C-N 3.33Å; N321-D323 PolarHBondContact O-N 3.23Å; N321-D324 PolarHBondContact O-N 3.47Å; N321-D324 PolarHBondContact OD1-N 3.11Å; N321-L325 PolarHBondContact O-N 3.27Å
322W94Very high92.3Very high57 Ų5749.9 Ų49.922%0.21624%0.238CC..Hα-helixtrans-65.2-34.7-174.4-48.9117.6000113V317 Q320 L325 E326 V357 P358 I361V317-W322 HydrophobicContact CB-CZ3 4.48Å; V317-W322 HydrophobicContact CG1-CH2 4.33Å; V317-W322 HydrophobicContact CG1-CZ3 4.5Å; V317-W322 HydrophobicContact CG2-CZ3 4.12Å; Q320-W322 VanDerWaalsContact C-N 3.29Å; Q320-W322 HydrophobicContact CB-CZ2 4.04Å; Q320-W322 HydrophobicContact CG-CZ2 4.08Å; Q320-W322 VanDerWaalsContact O-CD1 3.28Å; Q320-W322 PolarHBondContact O-N 3.26Å; Q320-W322 VanDerWaalsContact O-N 3.07Å; Q320-W322 PolarHBondContact O-NE1 3.4Å; W322-L325 HydrophobicContact CE3-CD2 4.01Å; W322-L325 HydrophobicContact CZ3-CD2 4.27Å; W322-L325 PolarHBondContact O-N 3.12Å; W322-E326 WeakPolarHBondContact O-CB 3.27Å; W322-E326 PolarHBondContact O-N 3.04Å; W322-V357 HydrophobicContact CH2-CG1 3.97Å; W322-V357 HydrophobicContact CH2-CG2 4.29Å; W322-V357 HydrophobicContact CZ3-CG1 3.87Å; W322-V357 HydrophobicContact CZ3-CG2 4.28Å; W322-P358 HydrophobicContact CZ2-CG 4.35Å; W322-I361 HydrophobicContact CB-CD1 4.42Å; W322-I361 HydrophobicContact CD2-CD1 4.09Å; W322-I361 HydrophobicContact CD2-CG1 4.09Å; W322-I361 HydrophobicContact CD2-CG2 4.42Å; W322-I361 HydrophobicContact CE3-CG1 4.27Å; W322-I361 HydrophobicContact CE3-CG2 3.87Å; W322-I361 HydrophobicContact CG-CD1 3.98Å; W322-I361 HydrophobicContact CZ3-CG2 4.19Å
323D93.6Very high91.6Very high123 Ų12355 Ų5566%0.65826%0.261SS*.Hα-helixtrans-62.4-45.3179.7-69.9-16.1000111.1N321 E326 F327N321-D323 VanDerWaalsContact C-N 3.33Å; N321-D323 PolarHBondContact O-N 3.23Å; D323-E326 PolarHBondContact O-N 3.08Å; D323-F327 WeakPolarHBondContact O-CB 3.33Å; D323-F327 PolarHBondContact O-N 3.18Å
324D94Very high90.6Very high5 Ų560.1 Ų60.13%0.02730%0.296CS..Hα-helixtrans-76.8-30.6179.1-85.228.1000112.1S287 V288 K289 L316 N321 F327 I328S287-D324 VanDerWaalsContact C-OD2 3.3Å; S287-D324 WeakPolarHBondContact CA-OD2 3.4Å; S287-D324 VanDerWaalsContact CB-OD2 3.32Å; S287-D324 WeakPolarHBondContact CB-OD2 3.41Å; S287-D324 PolarHBondContact OG-OD2 3.45Å; V288-D324 HydrophobicContact CG2-CB 3.85Å; V288-D324 PolarHBondContact N-OD2 2.96Å; K289-D324 WeakPolarHBondContact CE-OD1 3.22Å; K289-D324 IonicContact NZ-OD1 3.73Å; L316-D324 HydrophobicContact CD2-CB 4.11Å; N321-D324 PolarHBondContact O-N 3.47Å; N321-D324 PolarHBondContact OD1-N 3.11Å; D324-F327 PolarHBondContact O-N 3.31Å; D324-I328 WeakPolarHBondContact O-CG1 3.35Å; D324-I328 WeakPolarHBondContact O-CG2 3.4Å; D324-I328 PolarHBondContact O-N 2.98Å
325L95Very high89.7Confident0 Ų064.8 Ų64.80%032%0.323CS..Hα-helixtrans-59.7-46.7168.7-17866.6000110.8I313 L316 V317 N321 W322 I328 M329 F348 L352I313-L325 HydrophobicContact CG1-CD1 4.28Å; L316-L325 HydrophobicContact CB-CB 4.35Å; L316-L325 HydrophobicContact CD1-CB 4.33Å; L316-L325 HydrophobicContact CD1-CD1 4.38Å; V317-L325 HydrophobicContact CG2-CD2 4.22Å; N321-L325 PolarHBondContact O-N 3.27Å; W322-L325 HydrophobicContact CE3-CD2 4.01Å; W322-L325 HydrophobicContact CZ3-CD2 4.27Å; W322-L325 PolarHBondContact O-N 3.12Å; L325-I328 WeakPolarHBondContact O-CG1 3.48Å; L325-I328 PolarHBondContact O-N 3.3Å; L325-M329 HydrophobicContact CD1-CE 4.29Å; L325-M329 HydrophobicContact CD1-CG 4.06Å; L325-M329 HydrophobicContact CG-CG 4.46Å; L325-M329 VanDerWaalsContact O-CB 3.28Å; L325-M329 WeakPolarHBondContact O-CB 3.15Å; L325-M329 WeakPolarHBondContact O-CG 3.34Å; L325-M329 PolarHBondContact O-N 3.14Å; L325-M329 VanDerWaalsContact O-N 3.09Å; L325-F348 HydrophobicContact CD1-CE2 4.36Å; L325-F348 HydrophobicContact CD1-CZ 4.34Å; L325-F348 HydrophobicContact CD2-CZ 4.49Å; L325-F348 HydrophobicContact CG-CZ 4.46Å; L325-L352 HydrophobicContact CD2-CD2 4.13Å
326E93.7Very high88.9Confident82 Ų8266.1 Ų66.138%0.38333%0.332SS..Hα-helixtrans-62.5-43.6175.6-169.8175-154.100111.4W322 D323 I328 M329 L330W322-E326 WeakPolarHBondContact O-CB 3.27Å; W322-E326 PolarHBondContact O-N 3.04Å; D323-E326 PolarHBondContact O-N 3.08Å; E326-I328 PolarHBondContact O-N 3.11Å; E326-M329 PolarHBondContact O-N 3.28Å; E326-L330 HydrophobicContact CG-CD1 3.36Å; E326-L330 HydrophobicContact CG-CG 3.86Å; E326-L330 VanDerWaalsContact O-CB 3.31Å; E326-L330 WeakPolarHBondContact O-CB 3.48Å; E326-L330 WeakPolarHBondContact O-CG 3.3Å; E326-L330 PolarHBondContact O-N 3.06Å; E326-L330 VanDerWaalsContact OE1-CD1 3.29Å; E326-L330 WeakPolarHBondContact OE1-CD1 3.35Å
327F92.2Very high88Confident106 Ų10677.5 Ų77.547%0.46538%0.375SS..Hα-helixtrans-58.6-45178.2174.5-98.6000113.1K289 D323 D324K289-F327 HydrophobicContact CB-CE1 4.47Å; K289-F327 HydrophobicContact CG-CD1 4.26Å; K289-F327 HydrophobicContact CG-CE1 4.16Å; K289-F327 HydrophobicContact CG-CZ 4.45Å; D323-F327 WeakPolarHBondContact O-CB 3.33Å; D323-F327 PolarHBondContact O-N 3.18Å; D324-F327 PolarHBondContact O-N 3.31Å
328I92.9Very high87.4Confident16 Ų1686.2 Ų86.28%0.08241%0.407CS..Hα-helixtrans-77.4-29.8-178.266.1167.9000112.8V288 R309 L312 L316 D324 L325 E326V288-I328 HydrophobicContact CG2-CG2 3.6Å; R309-I328 VanDerWaalsContact CD-O 3.23Å; R309-I328 WeakPolarHBondContact CD-O 3.48Å; R309-I328 PolarHBondContact NE-O 2.88Å; L312-I328 HydrophobicContact CB-CD1 3.71Å; L312-I328 HydrophobicContact CD1-CD1 4.18Å; L316-I328 HydrophobicContact CD1-CD1 3.46Å; L316-I328 VanDerWaalsContact CD1-CD1 3.46Å; L316-I328 HydrophobicContact CD1-CG1 4.17Å; D324-I328 WeakPolarHBondContact O-CG1 3.35Å; D324-I328 WeakPolarHBondContact O-CG2 3.4Å; D324-I328 PolarHBondContact O-N 2.98Å; L325-I328 WeakPolarHBondContact O-CG1 3.48Å; L325-I328 PolarHBondContact O-N 3.3Å; E326-I328 PolarHBondContact O-N 3.11Å
329M94.3Very high87.4Confident0 Ų087.4 Ų87.40%041%0.413CS..Hα-helixtrans-86.1-31.7-175.6-68.2-60144.600113.1R309 I313 L325 E326 V341 T342 I343 F348R309-M329 HydrophobicContact CB-CE 3.56Å; R309-M329 HydrophobicContact CB-SD 4.25Å; R309-M329 HydrophobicContact CG-CE 4.09Å; R309-M329 WeakPolarHBondContact O-CE 3.46Å; I313-M329 HydrophobicContact CD1-CE 3.98Å; I313-M329 HydrophobicContact CG1-CE 3.48Å; I313-M329 VanDerWaalsContact CG1-CE 3.48Å; L325-M329 HydrophobicContact CD1-CE 4.29Å; L325-M329 HydrophobicContact CD1-CG 4.06Å; L325-M329 HydrophobicContact CG-CG 4.46Å; L325-M329 VanDerWaalsContact O-CB 3.28Å; L325-M329 WeakPolarHBondContact O-CB 3.15Å; L325-M329 WeakPolarHBondContact O-CG 3.34Å; L325-M329 PolarHBondContact O-N 3.14Å; L325-M329 VanDerWaalsContact O-N 3.09Å; E326-M329 PolarHBondContact O-N 3.28Å; M329-V341 WeakPolarHBondContact O-CA 3.31Å; M329-T342 PolarHBondContact O-N 3.39Å; M329-T342 PolarHBondContact O-OG1 3.03Å; M329-T342 VanDerWaalsContact O-OG1 3.07Å; M329-I343 HydrophobicContact CE-CD1 4.27Å; M329-I343 HydrophobicContact SD-CD1 3.46Å; M329-I343 WeakPolarHBondContact SD-CD1 3.42Å; M329-I343 HydrophobicContact SD-CG1 3.96Å; M329-F348 HydrophobicContact CB-CZ 4.44Å; M329-F348 HydrophobicContact CG-CE1 4.23Å; M329-F348 HydrophobicContact CG-CE2 4.08Å; M329-F348 HydrophobicContact CG-CZ 3.71Å; M329-F348 HydrophobicContact SD-CD2 4.39Å; M329-F348 HydrophobicContact SD-CE2 4.06Å; M329-F348 HydrophobicContact SD-CZ 4.23Å
330L93Very high87.5Confident17 Ų1788.3 Ų88.39%0.08941%0.412CS..EExtended strand (participates in β ladder)trans-99.4126-175.8-59.9-170.2000111.9E326 M339 E340 V341 Y365 Y368E326-L330 HydrophobicContact CG-CD1 3.36Å; E326-L330 HydrophobicContact CG-CG 3.86Å; E326-L330 VanDerWaalsContact O-CB 3.31Å; E326-L330 WeakPolarHBondContact O-CB 3.48Å; E326-L330 WeakPolarHBondContact O-CG 3.3Å; E326-L330 PolarHBondContact O-N 3.06Å; E326-L330 VanDerWaalsContact OE1-CD1 3.29Å; E326-L330 WeakPolarHBondContact OE1-CD1 3.35Å; L330-M339 HydrophobicContact CB-CB 4.48Å; L330-M339 HydrophobicContact CB-CE 3.56Å; L330-M339 HydrophobicContact CD1-CB 4.45Å; L330-E340 WeakPolarHBondContact CA-O 3.38Å; L330-V341 HydrophobicContact CD2-CG2 3.68Å; L330-Y365 HydrophobicContact CD2-CD1 4.4Å; L330-Y365 HydrophobicContact CD2-CE1 4.2Å; L330-Y365 HydrophobicContact CG-CE1 4.43Å; L330-Y368 HydrophobicContact CD1-CE2 3.95Å; L330-Y368 WeakPolarHBondContact CD1-OH 3.42Å; L330-Y368 HydrophobicContact CD2-CD2 3.98Å; L330-Y368 HydrophobicContact CD2-CE1 4.42Å; L330-Y368 HydrophobicContact CD2-CE2 3.57Å; L330-Y368 HydrophobicContact CG-CE2 4.43Å
331K88.3Confident87.4Confident120 Ų12082.2 Ų82.252%0.52238%0.384SS..EExtended strand (participates in β ladder)trans-119.6146.9170.1-171171.8-179.8177.50110.1K333 M339 E340 T342K331-K333 PolarHBondContact O-N 3.15Å; K331-M339 CarbonylContact O-C 3.56Å; K331-M339 WeakPolarHBondContact O-CA 3.36Å; K331-E340 PolarHBondContact N-O 3.01Å; K331-E340 PolarHBondContact O-N 2.88Å; K331-T342 HydrophobicContact CB-CG2 3.33Å; K331-T342 HydrophobicContact CD-CG2 4.19Å; K331-T342 HydrophobicContact CG-CG2 4.42Å
332K85.4Confident87.2Confident135 Ų13582.5 Ų82.559%0.58739%0.387SS*.EExtended strand (participates in β ladder)trans-69.2120.9170-174.9178.7178.2-178.30108.9S334 S336 M339K332-S334 PolarHBondContact O-N 2.84Å; K332-S336 WeakPolarHBondContact CE-O 3.39Å; K332-S336 WeakPolarHBondContact CG-O 3.45Å; K332-M339 HydrophobicContact CB-SD 4.09Å
333K80.8Confident87.1Confident108 Ų10880.1 Ų80.147%0.4738%0.378SS..PPolyproline II helixtrans-61.3131.7175.6-177.2170.6-162.8148.80109.8K331 L335 S336 R338 E340K331-K333 PolarHBondContact O-N 3.15Å; K333-L335 PolarHBondContact O-N 3.13Å; K333-S336 PolarHBondContact O-N 3.01Å; K333-R338 PolarHBondContact N-O 3.19Å; K333-E340 HydrophobicContact CB-CG 4.27Å; K333-E340 VanDerWaalsContact CD-OE2 3.26Å; K333-E340 WeakPolarHBondContact CD-OE2 3.35Å; K333-E340 WeakPolarHBondContact CG-OE2 3.36Å; K333-E340 IonicContact NZ-OE2 3.17Å
334S72.6Confident86.9Confident106 Ų10676.5 Ų76.574%0.74136%0.362SS*.THydrogen-bonded Turntrans-53.3131.6179.9-171.10000110.3K332 S336K332-S334 PolarHBondContact O-N 2.84Å; S334-S336 PolarHBondContact O-N 2.98Å
335L73.9Confident86.8Confident188 Ų18877.3 Ų77.398%0.98437%0.367SS*.THydrogen-bonded Turntrans65.44.4-176-56.5166.3000116.8K333K333-L335 PolarHBondContact O-N 3.13Å
336S74.6Confident86.4Confident35 Ų3579.3 Ų79.325%0.24538%0.378CS..SBendtrans-115.8156.7178-173.50000112.1K332 K333 S334 R338K332-S336 WeakPolarHBondContact CE-O 3.39Å; K332-S336 WeakPolarHBondContact CG-O 3.45Å; K333-S336 PolarHBondContact O-N 3.01Å; S334-S336 PolarHBondContact O-N 2.98Å; S336-R338 VanDerWaalsContact C-N 3.26Å; S336-R338 WeakPolarHBondContact OG-CB 3.36Å; S336-R338 WeakPolarHBondContact OG-CG 3.42Å; S336-R338 PolarHBondContact OG-N 3.26Å
337R76Confident86.2Confident241 Ų24181.8 Ų81.891%0.90938%0.384SS*.SBendtrans-83.1-6164.8-66.1-174.5-174.4178.31.5112.3
338R80.8Confident86.3Confident197 Ų19776.8 Ų76.874%0.74336%0.362SS*.  trans-81.7139.3-178.2-60.4-177.1-175.5179.40.8110.4K333 S336K333-R338 PolarHBondContact N-O 3.19Å; S336-R338 VanDerWaalsContact C-N 3.26Å; S336-R338 WeakPolarHBondContact OG-CB 3.36Å; S336-R338 WeakPolarHBondContact OG-CG 3.42Å; S336-R338 PolarHBondContact OG-N 3.26Å
339M88.2Confident86.3Confident77 Ų7776 Ų7638%0.37936%0.358SS..EExtended strand (participates in β ladder)trans-80.6151.8166.1-57.2-61.3-71.600109L330 K331 K332 Y368L330-M339 HydrophobicContact CB-CB 4.48Å; L330-M339 HydrophobicContact CB-CE 3.56Å; L330-M339 HydrophobicContact CD1-CB 4.45Å; K331-M339 CarbonylContact O-C 3.56Å; K331-M339 WeakPolarHBondContact O-CA 3.36Å; K332-M339 HydrophobicContact CB-SD 4.09Å; M339-Y368 HydrophobicContact CB-CE1 3.91Å
340E89.2Confident86.1Confident69 Ų6978.5 Ų78.532%0.32237%0.371SS..EExtended strand (participates in β ladder)trans-133.9149.8170.867.8-16716900109.4L330 K331 K333L330-E340 WeakPolarHBondContact CA-O 3.38Å; K331-E340 PolarHBondContact N-O 3.01Å; K331-E340 PolarHBondContact O-N 2.88Å; K333-E340 HydrophobicContact CB-CG 4.27Å; K333-E340 VanDerWaalsContact CD-OE2 3.26Å; K333-E340 WeakPolarHBondContact CD-OE2 3.35Å; K333-E340 WeakPolarHBondContact CG-OE2 3.36Å; K333-E340 IonicContact NZ-OE2 3.17Å
341V90.8Very high86.1Confident15 Ų1580.3 Ų80.39%0.09138%0.378CS..EExtended strand (participates in β ladder)trans-76.6131.5171179.80000107.8M329 L330 I343 T345 F348 Y365 Y368M329-V341 WeakPolarHBondContact O-CA 3.31Å; L330-V341 HydrophobicContact CD2-CG2 3.68Å; V341-I343 VanDerWaalsContact C-N 3.3Å; V341-I343 HydrophobicContact CG1-CG1 3.87Å; V341-I343 PolarHBondContact O-N 2.93Å; V341-T345 HydrophobicContact CB-CG2 4.43Å; V341-T345 HydrophobicContact CG2-CG2 4.2Å; V341-F348 HydrophobicContact CG1-CD1 4.09Å; V341-Y365 HydrophobicContact CG2-CD1 4.22Å; V341-Y368 HydrophobicContact CG2-CD2 3.7Å; V341-Y368 HydrophobicContact CG2-CG 3.89Å
342T88.5Confident86.4Confident35 Ų3574.6 Ų74.622%0.21535%0.354CS..SBendtrans-86.12.3-171.851.30000115.1R309 M329 K331R309-T342 WeakPolarHBondContact CD-OG1 3.16Å; R309-T342 PolarHBondContact NE-OG1 3.05Å; M329-T342 PolarHBondContact O-N 3.39Å; M329-T342 PolarHBondContact O-OG1 3.03Å; M329-T342 VanDerWaalsContact O-OG1 3.07Å; K331-T342 HydrophobicContact CB-CG2 3.33Å; K331-T342 HydrophobicContact CD-CG2 4.19Å; K331-T342 HydrophobicContact CG-CG2 4.42Å
343I90.6Very high86.7Confident7 Ų771.2 Ų71.24%0.03634%0.342CS..SBendtrans-129.6162.8176.760.1174.3000108.5E306 R309 W310 I313 M329 V341 T345 F348E306-I343 HydrophobicContact CG-CG2 4.02Å; R309-I343 HydrophobicContact CB-CG2 4.16Å; W310-I343 HydrophobicContact CD2-CD1 4.2Å; W310-I343 HydrophobicContact CE3-CD1 4.5Å; W310-I343 HydrophobicContact CH2-CD1 4.11Å; W310-I343 HydrophobicContact CZ2-CB 4.32Å; W310-I343 HydrophobicContact CZ2-CD1 3.8Å; W310-I343 HydrophobicContact CZ2-CG1 4.41Å; W310-I343 HydrophobicContact CZ3-CD1 4.45Å; I313-I343 HydrophobicContact CD1-CD1 4.04Å; M329-I343 HydrophobicContact CE-CD1 4.27Å; M329-I343 HydrophobicContact SD-CD1 3.46Å; M329-I343 WeakPolarHBondContact SD-CD1 3.42Å; M329-I343 HydrophobicContact SD-CG1 3.96Å; V341-I343 VanDerWaalsContact C-N 3.3Å; V341-I343 HydrophobicContact CG1-CG1 3.87Å; V341-I343 PolarHBondContact O-N 2.93Å; I343-T345 PolarHBondContact O-N 3.19Å; I343-F348 HydrophobicContact CD1-CB 3.76Å; I343-F348 HydrophobicContact CD1-CD2 3.72Å; I343-F348 HydrophobicContact CD1-CG 3.83Å; I343-F348 HydrophobicContact CG1-CB 4.02Å; I343-F348 HydrophobicContact CG1-CG 4.29Å
344P90Very high87.2Confident48 Ų4869.7 Ų69.731%0.31235%0.345SS..  trans-51.2113.4177-28.136.2000111.5D346 R347 F348P344-D346 VanDerWaalsContact C-N 3.34Å; P344-D346 WeakPolarHBondContact CB-OD1 3.17Å; P344-D346 PolarHBondContact O-N 3.12Å; P344-R347 HydrophobicContact CB-CB 4.31Å; P344-R347 HydrophobicContact CB-CG 4.22Å; P344-R347 PolarHBondContact O-N 3.19Å; P344-F348 WeakPolarHBondContact O-CB 3.37Å; P344-F348 PolarHBondContact O-N 3.28Å
345T91.3Very high88.1Confident22 Ų2266.6 Ų66.614%0.13532%0.32CS..Hα-helixtrans-69.2-35.4-164.3-57.30000111.6V341 I343 I349 I369V341-T345 HydrophobicContact CB-CG2 4.43Å; V341-T345 HydrophobicContact CG2-CG2 4.2Å; I343-T345 PolarHBondContact O-N 3.19Å; T345-I349 HydrophobicContact CG2-CD1 3.76Å; T345-I349 WeakPolarHBondContact O-CB 3.37Å; T345-I349 WeakPolarHBondContact O-CD1 3.39Å; T345-I349 VanDerWaalsContact O-CG1 3.26Å; T345-I349 WeakPolarHBondContact O-CG1 3.44Å; T345-I349 PolarHBondContact O-N 2.97Å; T345-I369 HydrophobicContact CG2-CG1 3.66Å
346D88.2Confident88.8Confident42 Ų4264.9 Ų64.923%0.22531%0.312CS..Hα-helixtrans-58.1-54.5172.962.6-36.9000112.7P344 F348 I349 L350 E374 I378P344-D346 VanDerWaalsContact C-N 3.34Å; P344-D346 WeakPolarHBondContact CB-OD1 3.17Å; P344-D346 PolarHBondContact O-N 3.12Å; D346-F348 VanDerWaalsContact C-N 3.3Å; D346-F348 PolarHBondContact O-N 3.34Å; D346-I349 PolarHBondContact O-N 3.27Å; D346-L350 WeakPolarHBondContact O-CB 3.47Å; D346-L350 WeakPolarHBondContact O-CG 3.16Å; D346-L350 PolarHBondContact O-N 3.21Å; D346-E374 HydrophobicContact CB-CG 4.22Å; D346-E374 WeakPolarHBondContact CB-OE1 3.47Å; D346-E374 VanDerWaalsContact CG-OE1 3.29Å; D346-I378 HydrophobicContact CB-CD1 3.51Å; D346-I378 HydrophobicContact CB-CG1 4.27Å
347R89.7Confident89.7Confident134 Ų13463.6 Ų63.651%0.50630%0.303SS..Hα-helixtrans-63.4-41.5-179.5-62.9-173.4-177.8-174.4-1.6110.4W310 P344 L350 H351W310-R347 HydrophobicContact CH2-CB 3.9Å; W310-R347 HydrophobicContact CZ2-CB 4.19Å; P344-R347 HydrophobicContact CB-CB 4.31Å; P344-R347 HydrophobicContact CB-CG 4.22Å; P344-R347 PolarHBondContact O-N 3.19Å; R347-L350 PolarHBondContact O-N 3.24Å; R347-H351 VanDerWaalsContact O-CB 3.23Å; R347-H351 WeakPolarHBondContact O-CB 3.49Å; R347-H351 PolarHBondContact O-N 3.03Å
348F93.4Very high90.5Very high0 Ų054.9 Ų54.90%028%0.277CS..Hα-helixtrans-59.3-49.1177.1174.7-126.2000111.5W310 I313 L325 M329 V341 I343 P344 D346 H351 L352 Y365W310-F348 HydrophobicContact CH2-CB 4.35Å; I313-F348 HydrophobicContact CD1-CD2 3.71Å; I313-F348 HydrophobicContact CD1-CE2 3.84Å; I313-F348 HydrophobicContact CG1-CD2 4.41Å; I313-F348 HydrophobicContact CG1-CE2 4.04Å; I313-F348 HydrophobicContact CG2-CE2 4.39Å; L325-F348 HydrophobicContact CD1-CE2 4.36Å; L325-F348 HydrophobicContact CD1-CZ 4.34Å; L325-F348 HydrophobicContact CD2-CZ 4.49Å; L325-F348 HydrophobicContact CG-CZ 4.46Å; M329-F348 HydrophobicContact CB-CZ 4.44Å; M329-F348 HydrophobicContact CG-CE1 4.23Å; M329-F348 HydrophobicContact CG-CE2 4.08Å; M329-F348 HydrophobicContact CG-CZ 3.71Å; M329-F348 HydrophobicContact SD-CD2 4.39Å; M329-F348 HydrophobicContact SD-CE2 4.06Å; M329-F348 HydrophobicContact SD-CZ 4.23Å; V341-F348 HydrophobicContact CG1-CD1 4.09Å; I343-F348 HydrophobicContact CD1-CB 3.76Å; I343-F348 HydrophobicContact CD1-CD2 3.72Å; I343-F348 HydrophobicContact CD1-CG 3.83Å; I343-F348 HydrophobicContact CG1-CB 4.02Å; I343-F348 HydrophobicContact CG1-CG 4.29Å; P344-F348 WeakPolarHBondContact O-CB 3.37Å; P344-F348 PolarHBondContact O-N 3.28Å; D346-F348 VanDerWaalsContact C-N 3.3Å; D346-F348 PolarHBondContact O-N 3.34Å; F348-H351 PolarHBondContact O-N 3.47Å; F348-L352 HydrophobicContact CD1-CD1 4.39Å; F348-L352 HydrophobicContact CD2-CD2 4.48Å; F348-L352 HydrophobicContact CD2-CG 4.18Å; F348-L352 HydrophobicContact CE1-CD1 3.8Å; F348-L352 HydrophobicContact CE1-CG 4.46Å; F348-L352 HydrophobicContact CE2-CD1 3.95Å; F348-L352 HydrophobicContact CE2-CD2 3.72Å; F348-L352 HydrophobicContact CE2-CG 3.77Å; F348-L352 HydrophobicContact CZ-CD1 3.55Å; F348-L352 HydrophobicContact CZ-CD2 4.01Å; F348-L352 HydrophobicContact CZ-CG 3.93Å; F348-L352 WeakPolarHBondContact O-CG 3.47Å; F348-L352 PolarHBondContact O-N 2.99Å; F348-Y365 AromaticContact CE1-CD1 3.73Å; F348-Y365 HydrophobicContact CE1-CD1 3.73Å; F348-Y365 AromaticContact CE1-CD2 3.95Å; F348-Y365 HydrophobicContact CE1-CD2 3.95Å; F348-Y365 AromaticContact CE1-CE1 3.81Å; F348-Y365 HydrophobicContact CE1-CE1 3.81Å; F348-Y365 HydrophobicContact CE1-CE2 4.02Å; F348-Y365 AromaticContact CE1-CG 3.8Å; F348-Y365 HydrophobicContact CE1-CG 3.8Å; F348-Y365 AromaticContact CE1-CZ 3.95Å; F348-Y365 HydrophobicContact CZ-CD2 4.5Å; F348-Y365 HydrophobicContact CZ-CE1 4.36Å; F348-Y365 HydrophobicContact CZ-CE2 4.19Å
349I93.2Very high91Very high0 Ų050.5 Ų50.50%026%0.264CS..Hα-helixtrans-65-43.7-179.4-76168.3000111.9T345 D346 H351 L352 N353 I362 L366 I369 I378 L382T345-I349 HydrophobicContact CG2-CD1 3.76Å; T345-I349 WeakPolarHBondContact O-CB 3.37Å; T345-I349 WeakPolarHBondContact O-CD1 3.39Å; T345-I349 VanDerWaalsContact O-CG1 3.26Å; T345-I349 WeakPolarHBondContact O-CG1 3.44Å; T345-I349 PolarHBondContact O-N 2.97Å; D346-I349 PolarHBondContact O-N 3.27Å; I349-H351 VanDerWaalsContact C-N 3.28Å; I349-H351 PolarHBondContact O-N 2.98Å; I349-L352 PolarHBondContact O-N 3.01Å; I349-N353 PolarHBondContact O-N 2.8Å; I349-I362 HydrophobicContact CG2-CG2 3.85Å; I349-L366 HydrophobicContact CD1-CD2 4.09Å; I349-L366 HydrophobicContact CG2-CD2 4.34Å; I349-I369 HydrophobicContact CD1-CD1 3.73Å; I349-I369 HydrophobicContact CD1-CG1 4.02Å; I349-I378 HydrophobicContact CG2-CG2 3.61Å; I349-L382 HydrophobicContact CG2-CD1 3.49Å; I349-L382 VanDerWaalsContact CG2-CD1 3.49Å
350L90.3Very high91.1Very high52 Ų5251.6 Ų51.627%0.27227%0.271SS..Hα-helixtrans-62.9-37.8175.3-69173.2000111.4D346 R347 N353 S354 R381 L382D346-L350 WeakPolarHBondContact O-CB 3.47Å; D346-L350 WeakPolarHBondContact O-CG 3.16Å; D346-L350 PolarHBondContact O-N 3.21Å; R347-L350 PolarHBondContact O-N 3.24Å; L350-N353 PolarHBondContact O-N 2.89Å; L350-S354 PolarHBondContact O-N 2.98Å; L350-R381 HydrophobicContact CD2-CB 4.47Å; L350-L382 HydrophobicContact CD2-CD2 4.07Å; L350-L382 HydrophobicContact CD2-CG 4.48Å
351H92.6Very high91.4Very high55 Ų5549.5 Ų49.526%0.25526%0.262SS..Hα-helixtrans-67.1-44.1175.6-173.743.9000112.1W310 R347 F348 I349 N353 S354 L355W310-H351 HydrophobicContact CZ3-CB 4.12Å; W310-H351 AromaticContact CZ3-CD2 3.77Å; R347-H351 VanDerWaalsContact O-CB 3.23Å; R347-H351 WeakPolarHBondContact O-CB 3.49Å; R347-H351 PolarHBondContact O-N 3.03Å; F348-H351 PolarHBondContact O-N 3.47Å; I349-H351 VanDerWaalsContact C-N 3.28Å; I349-H351 PolarHBondContact O-N 2.98Å; H351-N353 VanDerWaalsContact C-N 3.27Å; H351-N353 PolarHBondContact O-N 3.48Å; H351-S354 WeakPolarHBondContact CA-OG 3.15Å; H351-S354 PolarHBondContact ND1-OG 3.42Å; H351-S354 WeakPolarHBondContact O-CA 3.4Å; H351-S354 WeakPolarHBondContact O-CB 3.49Å; H351-S354 PolarHBondContact O-N 3.31Å; H351-S354 PolarHBondContact O-OG 3.29Å; H351-L355 WeakPolarHBondContact O-CG 3.34Å; H351-L355 PolarHBondContact O-N 3.25Å; H351-L355 VanDerWaalsContact O-N 3.11Å
352L94.4Very high91.5Very high0 Ų048.8 Ų48.80%026%0.257CS..Hα-helixtrans-56.6-43.4173-69.2-178.1000111.6I313 V317 L325 F348 I349 S354 L355 V357 I362 Y365I313-L352 HydrophobicContact CG2-CD2 3.99Å; V317-L352 HydrophobicContact CG2-CD2 3.89Å; L325-L352 HydrophobicContact CD2-CD2 4.13Å; F348-L352 HydrophobicContact CD1-CD1 4.39Å; F348-L352 HydrophobicContact CD2-CD2 4.48Å; F348-L352 HydrophobicContact CD2-CG 4.18Å; F348-L352 HydrophobicContact CE1-CD1 3.8Å; F348-L352 HydrophobicContact CE1-CG 4.46Å; F348-L352 HydrophobicContact CE2-CD1 3.95Å; F348-L352 HydrophobicContact CE2-CD2 3.72Å; F348-L352 HydrophobicContact CE2-CG 3.77Å; F348-L352 HydrophobicContact CZ-CD1 3.55Å; F348-L352 HydrophobicContact CZ-CD2 4.01Å; F348-L352 HydrophobicContact CZ-CG 3.93Å; F348-L352 WeakPolarHBondContact O-CG 3.47Å; F348-L352 PolarHBondContact O-N 2.99Å; I349-L352 PolarHBondContact O-N 3.01Å; L352-S354 VanDerWaalsContact C-N 3.31Å; L352-S354 PolarHBondContact O-N 3.14Å; L352-L355 PolarHBondContact O-N 3.03Å; L352-L355 VanDerWaalsContact O-N 3.14Å; L352-V357 HydrophobicContact CB-CB 4.12Å; L352-V357 HydrophobicContact CB-CG1 4.44Å; L352-V357 HydrophobicContact CB-CG2 4.01Å; L352-V357 HydrophobicContact CD2-CG2 3.97Å; L352-V357 VanDerWaalsContact O-CB 3.27Å; L352-V357 WeakPolarHBondContact O-CB 3.17Å; L352-V357 WeakPolarHBondContact O-CG2 3.39Å; L352-V357 PolarHBondContact O-N 2.76Å; L352-I362 HydrophobicContact CB-CG1 4.14Å; L352-Y365 HydrophobicContact CD1-CD2 3.83Å; L352-Y365 HydrophobicContact CD1-CE2 4Å
353N92.4Very high91.7Very high64 Ų6450.4 Ų50.434%0.34226%0.262SS..Hα-helixtrans-63.2-37.4175.7-17578.3000112.4I349 L350 H351 L355 D356 I362 L382I349-N353 PolarHBondContact O-N 2.8Å; L350-N353 PolarHBondContact O-N 2.89Å; H351-N353 VanDerWaalsContact C-N 3.27Å; H351-N353 PolarHBondContact O-N 3.48Å; N353-L355 PolarHBondContact O-N 3.01Å; N353-D356 PolarHBondContact O-N 3.43Å; N353-I362 HydrophobicContact CB-CD1 3.97Å; N353-L382 HydrophobicContact CB-CD2 3.43Å; N353-L382 VanDerWaalsContact CB-CD2 3.43Å; N353-L382 WeakPolarHBondContact ND2-CD2 3.29Å
354S90.9Very high91.7Very high76 Ų7652 Ų5253%0.53127%0.274SS..Hα-helixtrans-66.2-20.7175.675.70000113.8L350 H351 L352 D356L350-S354 PolarHBondContact O-N 2.98Å; H351-S354 WeakPolarHBondContact CA-OG 3.15Å; H351-S354 PolarHBondContact ND1-OG 3.42Å; H351-S354 WeakPolarHBondContact O-CA 3.4Å; H351-S354 WeakPolarHBondContact O-CB 3.49Å; H351-S354 PolarHBondContact O-N 3.31Å; H351-S354 PolarHBondContact O-OG 3.29Å; L352-S354 VanDerWaalsContact C-N 3.31Å; L352-S354 PolarHBondContact O-N 3.14Å; S354-D356 VanDerWaalsContact C-N 3.35Å
355L90.6Very high91.9Very high42 Ų4249.9 Ų49.922%0.2226%0.26CS..THydrogen-bonded Turntrans-94.514.8176.1-63.2176.1000112.8I313 E314 V317 H351 L352 N353 V357I313-L355 HydrophobicContact CG2-CD1 3.97Å; E314-L355 HydrophobicContact CB-CD1 4.28Å; E314-L355 HydrophobicContact CG-CD2 4.37Å; V317-L355 HydrophobicContact CB-CD1 4.37Å; V317-L355 HydrophobicContact CG1-CB 4.09Å; V317-L355 HydrophobicContact CG1-CD1 4.3Å; V317-L355 HydrophobicContact CG2-CD1 4.23Å; H351-L355 WeakPolarHBondContact O-CG 3.34Å; H351-L355 PolarHBondContact O-N 3.25Å; H351-L355 VanDerWaalsContact O-N 3.11Å; L352-L355 PolarHBondContact O-N 3.03Å; L352-L355 VanDerWaalsContact O-N 3.14Å; N353-L355 PolarHBondContact O-N 3.01Å; L355-V357 HydrophobicContact CB-CG2 4.2Å; L355-V357 PolarHBondContact O-N 3.39Å
356D89.2Confident91.9Very high151 Ų15148.8 Ų48.881%0.80725%0.253SS*.THydrogen-bonded Turntrans55.431.5-178.9-64.4-47.2000114N353 S354N353-D356 PolarHBondContact O-N 3.43Å; S354-D356 VanDerWaalsContact C-N 3.35Å
357V93Very high91.8Very high9 Ų951.9 Ų51.96%0.05527%0.265CS..  trans-62.3138.5178.5172.10000110.4V317 W322 L352 L355 K359 I361 I362V317-V357 HydrophobicContact CB-CG2 4.42Å; V317-V357 HydrophobicContact CG1-CG2 3.54Å; V317-V357 HydrophobicContact CG2-CG2 3.93Å; W322-V357 HydrophobicContact CH2-CG1 3.97Å; W322-V357 HydrophobicContact CH2-CG2 4.29Å; W322-V357 HydrophobicContact CZ3-CG1 3.87Å; W322-V357 HydrophobicContact CZ3-CG2 4.28Å; L352-V357 HydrophobicContact CB-CB 4.12Å; L352-V357 HydrophobicContact CB-CG1 4.44Å; L352-V357 HydrophobicContact CB-CG2 4.01Å; L352-V357 HydrophobicContact CD2-CG2 3.97Å; L352-V357 VanDerWaalsContact O-CB 3.27Å; L352-V357 WeakPolarHBondContact O-CB 3.17Å; L352-V357 WeakPolarHBondContact O-CG2 3.39Å; L352-V357 PolarHBondContact O-N 2.76Å; L355-V357 HydrophobicContact CB-CG2 4.2Å; L355-V357 PolarHBondContact O-N 3.39Å; V357-K359 PolarHBondContact O-N 3.26Å; V357-I361 HydrophobicContact CG1-CB 3.73Å; V357-I361 HydrophobicContact CG1-CG1 4.41Å; V357-I361 HydrophobicContact CG1-CG2 3.82Å; V357-I362 HydrophobicContact CB-CD1 4.36Å; V357-I362 HydrophobicContact CB-CG1 4.31Å; V357-I362 HydrophobicContact CG1-CG1 4.07Å
358P93.3Very high91.8Very high58 Ų5847.7 Ų47.738%0.37725%0.249SC..  trans-53.7133.6177.4-27.935.8000112.6W322 N360 I361 I362W322-P358 HydrophobicContact CZ2-CG 4.35Å; P358-N360 WeakPolarHBondContact CB-OD1 3.28Å; P358-N360 PolarHBondContact O-N 3.33Å; P358-N360 VanDerWaalsContact O-N 3.12Å; P358-I361 HydrophobicContact CB-CG1 4.28Å; P358-I361 WeakPolarHBondContact O-CB 3.27Å; P358-I361 PolarHBondContact O-N 3.1Å; P358-I362 PolarHBondContact O-N 3.37Å
359K90.8Very high91.6Very high105 Ų10547.8 Ų47.846%0.45725%0.25SC..Hα-helixtrans-54-37.8-174.9-71-169.6174.8-167.60113.2V357 I361 I362 E363V357-K359 PolarHBondContact O-N 3.26Å; K359-I361 PolarHBondContact O-N 3.04Å; K359-I362 CarbonylContact O-C 3.6Å; K359-I362 WeakPolarHBondContact O-CB 3.32Å; K359-I362 PolarHBondContact O-N 3.01Å; K359-E363 VanDerWaalsContact O-CG 3.23Å; K359-E363 WeakPolarHBondContact O-CG 3.35Å; K359-E363 PolarHBondContact O-N 3.36Å
360N91.9Very high91.1Very high99 Ų9953 Ų5353%0.52929%0.286SS..Hα-helixtrans-60.3-29.5177.565.9-64.2000113.6P358 S364P358-N360 WeakPolarHBondContact CB-OD1 3.28Å; P358-N360 PolarHBondContact O-N 3.33Å; P358-N360 VanDerWaalsContact O-N 3.12Å; N360-S364 PolarHBondContact O-N 3.32Å
361I94.2Very high90.9Very high26 Ų2654.1 Ų54.113%0.13329%0.292CS..Hα-helixtrans-74.2-44.3173.8-56.8-60.4000109.7W322 V357 P358 K359 E363 S364 Y365W322-I361 HydrophobicContact CB-CD1 4.42Å; W322-I361 HydrophobicContact CD2-CD1 4.09Å; W322-I361 HydrophobicContact CD2-CG1 4.09Å; W322-I361 HydrophobicContact CD2-CG2 4.42Å; W322-I361 HydrophobicContact CE3-CG1 4.27Å; W322-I361 HydrophobicContact CE3-CG2 3.87Å; W322-I361 HydrophobicContact CG-CD1 3.98Å; W322-I361 HydrophobicContact CZ3-CG2 4.19Å; V357-I361 HydrophobicContact CG1-CB 3.73Å; V357-I361 HydrophobicContact CG1-CG1 4.41Å; V357-I361 HydrophobicContact CG1-CG2 3.82Å; P358-I361 HydrophobicContact CB-CG1 4.28Å; P358-I361 WeakPolarHBondContact O-CB 3.27Å; P358-I361 PolarHBondContact O-N 3.1Å; K359-I361 PolarHBondContact O-N 3.04Å; I361-E363 VanDerWaalsContact C-N 3.33Å; I361-E363 PolarHBondContact O-N 2.77Å; I361-S364 WeakPolarHBondContact O-CB 3.14Å; I361-S364 PolarHBondContact O-N 3.44Å; I361-S364 VanDerWaalsContact O-N 3.13Å; I361-S364 PolarHBondContact O-OG 3.03Å; I361-Y365 HydrophobicContact CG2-CE2 3.98Å; I361-Y365 VanDerWaalsContact O-CD2 3.25Å; I361-Y365 WeakPolarHBondContact O-CD2 3.48Å
362I93.5Very high90.6Very high0 Ų053 Ų530%029%0.289CS..Hα-helixtrans-60.5-43.3176.4-61.7173.7000111I349 L352 N353 V357 P358 K359 S364 Y365 L366 L382 M384I349-I362 HydrophobicContact CG2-CG2 3.85Å; L352-I362 HydrophobicContact CB-CG1 4.14Å; N353-I362 HydrophobicContact CB-CD1 3.97Å; V357-I362 HydrophobicContact CB-CD1 4.36Å; V357-I362 HydrophobicContact CB-CG1 4.31Å; V357-I362 HydrophobicContact CG1-CG1 4.07Å; P358-I362 PolarHBondContact O-N 3.37Å; K359-I362 CarbonylContact O-C 3.6Å; K359-I362 WeakPolarHBondContact O-CB 3.32Å; K359-I362 PolarHBondContact O-N 3.01Å; I362-S364 PolarHBondContact O-N 2.89Å; I362-Y365 PolarHBondContact O-N 3.34Å; I362-L366 PolarHBondContact O-N 3.4Å; I362-L382 HydrophobicContact CG2-CD1 3.93Å; I362-M384 HydrophobicContact CB-CE 4.44Å; I362-M384 HydrophobicContact CG2-CE 4.18Å; I362-M384 HydrophobicContact CG2-SD 3.94Å
363E91.7Very high90.2Very high68 Ų6860 Ų6032%0.31832%0.321SS..Hα-helixtrans-53.4-39.5175.3-71166.1-164.800111.8K359 I361 Y365 L366 M384 E387K359-E363 VanDerWaalsContact O-CG 3.23Å; K359-E363 WeakPolarHBondContact O-CG 3.35Å; K359-E363 PolarHBondContact O-N 3.36Å; I361-E363 VanDerWaalsContact C-N 3.33Å; I361-E363 PolarHBondContact O-N 2.77Å; E363-Y365 PolarHBondContact O-N 2.72Å; E363-Y365 VanDerWaalsContact O-N 3.17Å; E363-L366 PolarHBondContact O-N 3.35Å; E363-M384 HydrophobicContact CB-CE 4.28Å; E363-M384 HydrophobicContact CG-CE 3.21Å; E363-E387 HydrophobicContact CB-CG 4.32Å; E363-E387 HydrophobicContact CG-CB 4.39Å; E363-E387 HydrophobicContact CG-CG 4Å
364S91.6Very high89.9Confident40 Ų4060 Ų6028%0.2832%0.319SS..Hα-helixtrans-62.8-23.5-179.884.50000113.5N360 I361 I362 K367 Y368N360-S364 PolarHBondContact O-N 3.32Å; I361-S364 WeakPolarHBondContact O-CB 3.14Å; I361-S364 PolarHBondContact O-N 3.44Å; I361-S364 VanDerWaalsContact O-N 3.13Å; I361-S364 PolarHBondContact O-OG 3.03Å; I362-S364 PolarHBondContact O-N 2.89Å; S364-K367 WeakPolarHBondContact O-CD 3.41Å; S364-K367 WeakPolarHBondContact O-CE 3.47Å; S364-K367 WeakPolarHBondContact O-CG 3.18Å; S364-K367 PolarHBondContact O-NZ 3.02Å; S364-Y368 WeakPolarHBondContact O-CE2 3.28Å
365Y93.1Very high89.8Confident4 Ų456.4 Ų56.42%0.01629%0.294CS..Hα-helixtrans-96.9-24.7179.4-65.7-72.4000114.1L330 V341 F348 L352 I361 I362 E363 K367 Y368L330-Y365 HydrophobicContact CD2-CD1 4.4Å; L330-Y365 HydrophobicContact CD2-CE1 4.2Å; L330-Y365 HydrophobicContact CG-CE1 4.43Å; V341-Y365 HydrophobicContact CG2-CD1 4.22Å; F348-Y365 AromaticContact CE1-CD1 3.73Å; F348-Y365 HydrophobicContact CE1-CD1 3.73Å; F348-Y365 AromaticContact CE1-CD2 3.95Å; F348-Y365 HydrophobicContact CE1-CD2 3.95Å; F348-Y365 AromaticContact CE1-CE1 3.81Å; F348-Y365 HydrophobicContact CE1-CE1 3.81Å; F348-Y365 HydrophobicContact CE1-CE2 4.02Å; F348-Y365 AromaticContact CE1-CG 3.8Å; F348-Y365 HydrophobicContact CE1-CG 3.8Å; F348-Y365 AromaticContact CE1-CZ 3.95Å; F348-Y365 HydrophobicContact CZ-CD2 4.5Å; F348-Y365 HydrophobicContact CZ-CE1 4.36Å; F348-Y365 HydrophobicContact CZ-CE2 4.19Å; L352-Y365 HydrophobicContact CD1-CD2 3.83Å; L352-Y365 HydrophobicContact CD1-CE2 4Å; I361-Y365 HydrophobicContact CG2-CE2 3.98Å; I361-Y365 VanDerWaalsContact O-CD2 3.25Å; I361-Y365 WeakPolarHBondContact O-CD2 3.48Å; I362-Y365 PolarHBondContact O-N 3.34Å; E363-Y365 PolarHBondContact O-N 2.72Å; E363-Y365 VanDerWaalsContact O-N 3.17Å; Y365-K367 PolarHBondContact O-N 2.78Å; Y365-K367 VanDerWaalsContact O-N 3.11Å; Y365-Y368 HydrophobicContact CD1-CD2 4.07Å; Y365-Y368 HydrophobicContact CD1-CE2 4.09Å; Y365-Y368 WeakPolarHBondContact O-CB 3.41Å; Y365-Y368 WeakPolarHBondContact O-CD2 3.26Å; Y365-Y368 PolarHBondContact O-N 3.38Å
366L91.3Very high89.6Confident0 Ų054.5 Ų54.50%028%0.284CS..Hα-helixtrans-54.7-33.8178.8-73.8174000112.7I349 I362 E363 Y368 I369 L375 I378 V379 M384 E387 L391I349-L366 HydrophobicContact CD1-CD2 4.09Å; I349-L366 HydrophobicContact CG2-CD2 4.34Å; I362-L366 PolarHBondContact O-N 3.4Å; E363-L366 PolarHBondContact O-N 3.35Å; L366-Y368 PolarHBondContact O-N 3.4Å; L366-Y368 VanDerWaalsContact O-N 3.11Å; L366-I369 HydrophobicContact CD2-CD1 3.83Å; L366-I369 PolarHBondContact O-N 2.8Å; L366-I369 VanDerWaalsContact O-N 3.12Å; L366-L375 HydrophobicContact CB-CD1 4.39Å; L366-L375 HydrophobicContact CD2-CD1 4.21Å; L366-I378 HydrophobicContact CD2-CG2 4.05Å; L366-V379 HydrophobicContact CD1-CG1 3.95Å; L366-V379 HydrophobicContact CD2-CG1 3.79Å; L366-M384 HydrophobicContact CD1-CE 3.7Å; L366-M384 HydrophobicContact CD1-SD 4.32Å; L366-E387 HydrophobicContact CD1-CB 4.33Å; L366-E387 HydrophobicContact CD1-CG 3.99Å; L366-L391 HydrophobicContact CB-CD1 3.65Å; L366-L391 HydrophobicContact CD1-CD1 4.42Å
367K87.1Confident89.5Confident107 Ų10751 Ų5147%0.46526%0.263SS..THydrogen-bonded Turntrans-61.5-17.917874.5-168.8-178.1-161.60114.3S364 Y365 L391S364-K367 WeakPolarHBondContact O-CD 3.41Å; S364-K367 WeakPolarHBondContact O-CE 3.47Å; S364-K367 WeakPolarHBondContact O-CG 3.18Å; S364-K367 PolarHBondContact O-NZ 3.02Å; Y365-K367 PolarHBondContact O-N 2.78Å; Y365-K367 VanDerWaalsContact O-N 3.11Å; K367-L391 HydrophobicContact CB-CD2 4.16Å
368Y89.1Confident89.3Confident46 Ų4650.8 Ų50.818%0.1826%0.261CS..THydrogen-bonded Turntrans-88.4-10.7179.4-59.9-63.4000113.4L330 M339 V341 S364 Y365 L366 S370L330-Y368 HydrophobicContact CD1-CE2 3.95Å; L330-Y368 WeakPolarHBondContact CD1-OH 3.42Å; L330-Y368 HydrophobicContact CD2-CD2 3.98Å; L330-Y368 HydrophobicContact CD2-CE1 4.42Å; L330-Y368 HydrophobicContact CD2-CE2 3.57Å; L330-Y368 HydrophobicContact CG-CE2 4.43Å; M339-Y368 HydrophobicContact CB-CE1 3.91Å; V341-Y368 HydrophobicContact CG2-CD2 3.7Å; V341-Y368 HydrophobicContact CG2-CG 3.89Å; S364-Y368 WeakPolarHBondContact O-CE2 3.28Å; Y365-Y368 HydrophobicContact CD1-CD2 4.07Å; Y365-Y368 HydrophobicContact CD1-CE2 4.09Å; Y365-Y368 WeakPolarHBondContact O-CB 3.41Å; Y365-Y368 WeakPolarHBondContact O-CD2 3.26Å; Y365-Y368 PolarHBondContact O-N 3.38Å; L366-Y368 PolarHBondContact O-N 3.4Å; L366-Y368 VanDerWaalsContact O-N 3.11Å; Y368-S370 PolarHBondContact O-N 3.17Å; Y368-S370 VanDerWaalsContact O-N 3.16Å
369I88.6Confident89Confident2 Ų248 Ų481%0.0124%0.243CC..  trans-69.2113.1172.8-57.7163.9000108.4T345 I349 L366 D371 E374 L375 I378 K395T345-I369 HydrophobicContact CG2-CG1 3.66Å; I349-I369 HydrophobicContact CD1-CD1 3.73Å; I349-I369 HydrophobicContact CD1-CG1 4.02Å; L366-I369 HydrophobicContact CD2-CD1 3.83Å; L366-I369 PolarHBondContact O-N 2.8Å; L366-I369 VanDerWaalsContact O-N 3.12Å; I369-D371 VanDerWaalsContact CG2-O 3.31Å; I369-D371 WeakPolarHBondContact CG2-O 3.49Å; I369-E374 HydrophobicContact CG2-CB 4.16Å; I369-E374 HydrophobicContact CG2-CG 4.07Å; I369-L375 HydrophobicContact CB-CB 4.33Å; I369-L375 HydrophobicContact CB-CD1 4.36Å; I369-L375 HydrophobicContact CD1-CD1 3.79Å; I369-L375 HydrophobicContact CG2-CB 3.9Å; I369-I378 HydrophobicContact CD1-CD1 3.54Å; I369-I378 HydrophobicContact CD1-CG2 4.46Å; I369-I378 HydrophobicContact CG1-CD1 4.35Å; I369-K395 PolarHBondContact O-NZ 3.04Å
370S83.6Confident88.7Confident109 Ų10945.3 Ų45.376%0.76223%0.233SC*.  trans-78.2-36.1-178.450.10000112.9Y368Y368-S370 PolarHBondContact O-N 3.17Å; Y368-S370 VanDerWaalsContact O-N 3.16Å
371D86.5Confident88.5Confident75 Ų7548.4 Ų48.440%0.40124%0.237SC..  trans-84.1127.9-178.2-175.574.9000111I369 E373 E374 L375I369-D371 VanDerWaalsContact CG2-O 3.31Å; I369-D371 WeakPolarHBondContact CG2-O 3.49Å; D371-E373 WeakPolarHBondContact OD2-CA 3.29Å; D371-E373 WeakPolarHBondContact OD2-CB 3.46Å; D371-E373 PolarHBondContact OD2-N 3.39Å; D371-E374 HydrophobicContact CB-CB 3.89Å; D371-E374 WeakPolarHBondContact OD2-CB 3.23Å; D371-E374 PolarHBondContact OD2-N 2.72Å; D371-L375 WeakPolarHBondContact O-CB 3.46Å; D371-L375 PolarHBondContact O-N 3.1Å
372D85Confident88.1Confident33 Ų3347.6 Ų47.618%0.17623%0.233CC..Hα-helixtrans-79.9-25.3-173.8-70.6-38.7000112.6I376 K395 N397 A400D372-I376 VanDerWaalsContact O-CD1 3.32Å; D372-I376 WeakPolarHBondContact O-CD1 3.42Å; D372-I376 WeakPolarHBondContact O-CG1 3.48Å; D372-I376 PolarHBondContact O-N 3.37Å; D372-I376 VanDerWaalsContact O-N 3.12Å; D372-K395 WeakPolarHBondContact OD1-CD 3.46Å; D372-K395 IonicContact OD1-NZ 3.64Å; D372-K395 PolarHBondContact OD1-NZ 2.94Å; D372-N397 PolarHBondContact OD2-ND2 3.05Å; D372-A400 HydrophobicContact CB-CB 3.89Å
373E85.9Confident87.8Confident147 Ų14752.7 Ų52.769%0.68726%0.261SS*.Hα-helixtrans-70.9-46.6174-63.7-177.3-17800110.1D371 L375 I376 Q377D371-E373 WeakPolarHBondContact OD2-CA 3.29Å; D371-E373 WeakPolarHBondContact OD2-CB 3.46Å; D371-E373 PolarHBondContact OD2-N 3.39Å; E373-L375 VanDerWaalsContact C-N 3.34Å; E373-L375 PolarHBondContact O-N 3.26Å; E373-I376 PolarHBondContact O-N 3.22Å; E373-Q377 WeakPolarHBondContact O-CG 3.41Å; E373-Q377 PolarHBondContact O-N 3.21Å
374E87.5Confident87.7Confident63 Ų6349.9 Ų49.929%0.29425%0.248SC..Hα-helixtrans-57.2-46.1173.6-176178.6-146.900111.3D346 I369 D371 I376 Q377 I378D346-E374 HydrophobicContact CB-CG 4.22Å; D346-E374 WeakPolarHBondContact CB-OE1 3.47Å; D346-E374 VanDerWaalsContact CG-OE1 3.29Å; I369-E374 HydrophobicContact CG2-CB 4.16Å; I369-E374 HydrophobicContact CG2-CG 4.07Å; D371-E374 HydrophobicContact CB-CB 3.89Å; D371-E374 WeakPolarHBondContact OD2-CB 3.23Å; D371-E374 PolarHBondContact OD2-N 2.72Å; E374-I376 VanDerWaalsContact C-N 3.33Å; E374-I376 PolarHBondContact O-N 2.99Å; E374-Q377 PolarHBondContact O-N 3.11Å; E374-I378 HydrophobicContact CG-CD1 3.75Å; E374-I378 WeakPolarHBondContact O-CD1 3.48Å; E374-I378 WeakPolarHBondContact O-CG1 3.08Å; E374-I378 PolarHBondContact O-N 2.64Å
375L88.7Confident87.5Confident1 Ų148.2 Ų48.21%0.00524%0.236CC..Hα-helixtrans-55.5-48.7175.2174.863.9000111.2L366 I369 D371 E373 I378 V379 L391L366-L375 HydrophobicContact CB-CD1 4.39Å; L366-L375 HydrophobicContact CD2-CD1 4.21Å; I369-L375 HydrophobicContact CB-CB 4.33Å; I369-L375 HydrophobicContact CB-CD1 4.36Å; I369-L375 HydrophobicContact CD1-CD1 3.79Å; I369-L375 HydrophobicContact CG2-CB 3.9Å; D371-L375 WeakPolarHBondContact O-CB 3.46Å; D371-L375 PolarHBondContact O-N 3.1Å; E373-L375 VanDerWaalsContact C-N 3.34Å; E373-L375 PolarHBondContact O-N 3.26Å; L375-I378 PolarHBondContact O-N 3.36Å; L375-V379 HydrophobicContact CD1-CG1 3.93Å; L375-V379 WeakPolarHBondContact O-CG1 3.34Å; L375-V379 WeakPolarHBondContact O-CG2 2.96Å; L375-V379 PolarHBondContact O-N 2.92Å; L375-L391 HydrophobicContact CD1-CD1 3.9Å; L375-L391 HydrophobicContact CD2-CB 4.13Å; L375-L391 HydrophobicContact CD2-CD1 4.32Å
376I86.3Confident87.3Confident2 Ų252.5 Ų52.51%0.0126%0.259CS..Hα-helixtrans-63.5-42.2-179.9-70165000111.2D372 E373 E374 V379 I380 A400 E403 L404D372-I376 VanDerWaalsContact O-CD1 3.32Å; D372-I376 WeakPolarHBondContact O-CD1 3.42Å; D372-I376 WeakPolarHBondContact O-CG1 3.48Å; D372-I376 PolarHBondContact O-N 3.37Å; D372-I376 VanDerWaalsContact O-N 3.12Å; E373-I376 PolarHBondContact O-N 3.22Å; E374-I376 VanDerWaalsContact C-N 3.33Å; E374-I376 PolarHBondContact O-N 2.99Å; I376-V379 VanDerWaalsContact O-CG2 3.29Å; I376-V379 WeakPolarHBondContact O-CG2 3.48Å; I376-I380 HydrophobicContact CG2-CD1 3.57Å; I376-I380 HydrophobicContact CG2-CG1 4.44Å; I376-I380 WeakPolarHBondContact O-CB 3.46Å; I376-I380 WeakPolarHBondContact O-CD1 3.41Å; I376-I380 WeakPolarHBondContact O-CG1 3.26Å; I376-I380 PolarHBondContact O-N 2.67Å; I376-I380 VanDerWaalsContact O-N 3.11Å; I376-A400 HydrophobicContact CD1-CB 3.94Å; I376-A400 WeakPolarHBondContact CD1-O 3.18Å; I376-E403 HydrophobicContact CD1-CB 3.82Å; I376-E403 HydrophobicContact CD1-CG 4.05Å; I376-L404 HydrophobicContact CG1-CB 4.45Å; I376-L404 HydrophobicContact CG2-CD1 4.3Å
377Q86.8Confident87.1Confident77 Ų7753.8 Ų53.836%0.3627%0.265SS..Hα-helixtrans-62.2-45.8177.6-70.6-56.4-35.100111.7E373 E374 R381E373-Q377 WeakPolarHBondContact O-CG 3.41Å; E373-Q377 PolarHBondContact O-N 3.21Å; E374-Q377 PolarHBondContact O-N 3.11Å; Q377-R381 WeakPolarHBondContact O-CB 2.79Å; Q377-R381 VanDerWaalsContact O-CG 3.27Å; Q377-R381 WeakPolarHBondContact O-CG 3.43Å; Q377-R381 PolarHBondContact O-N 3.02Å
378I88.6Confident87Confident5 Ų548.7 Ų48.73%0.02624%0.243CC..Hα-helixtrans-64.8-50.5-179.1-69.3158.6000111.1D346 I349 L366 I369 E374 L375 I380 R381 L382D346-I378 HydrophobicContact CB-CD1 3.51Å; D346-I378 HydrophobicContact CB-CG1 4.27Å; I349-I378 HydrophobicContact CG2-CG2 3.61Å; L366-I378 HydrophobicContact CD2-CG2 4.05Å; I369-I378 HydrophobicContact CD1-CD1 3.54Å; I369-I378 HydrophobicContact CD1-CG2 4.46Å; I369-I378 HydrophobicContact CG1-CD1 4.35Å; E374-I378 HydrophobicContact CG-CD1 3.75Å; E374-I378 WeakPolarHBondContact O-CD1 3.48Å; E374-I378 WeakPolarHBondContact O-CG1 3.08Å; E374-I378 PolarHBondContact O-N 2.64Å; L375-I378 PolarHBondContact O-N 3.36Å; I378-I380 VanDerWaalsContact C-N 3.27Å; I378-I380 PolarHBondContact O-N 3.37Å; I378-R381 WeakPolarHBondContact O-CB 3.28Å; I378-R381 PolarHBondContact O-N 3.15Å; I378-R381 VanDerWaalsContact O-N 3.14Å; I378-L382 HydrophobicContact CG2-CD1 3.79Å; I378-L382 HydrophobicContact CG2-CG 4.2Å; I378-L382 WeakPolarHBondContact O-CB 2.99Å; I378-L382 VanDerWaalsContact O-CG 3.27Å; I378-L382 WeakPolarHBondContact O-CG 3.41Å; I378-L382 PolarHBondContact O-N 3.14Å
379V86.9Confident87Confident0 Ų046.6 Ų46.60%024%0.235CC..Hα-helixtrans-65.2-30.4-177.4-63.70000112.9L366 L375 I376 N383 M384 A388 L404L366-V379 HydrophobicContact CD1-CG1 3.95Å; L366-V379 HydrophobicContact CD2-CG1 3.79Å; L375-V379 HydrophobicContact CD1-CG1 3.93Å; L375-V379 WeakPolarHBondContact O-CG1 3.34Å; L375-V379 WeakPolarHBondContact O-CG2 2.96Å; L375-V379 PolarHBondContact O-N 2.92Å; I376-V379 VanDerWaalsContact O-CG2 3.29Å; I376-V379 WeakPolarHBondContact O-CG2 3.48Å; V379-N383 PolarHBondContact O-N 3.37Å; V379-M384 HydrophobicContact CB-CB 4.46Å; V379-M384 PolarHBondContact O-N 3.32Å; V379-A388 HydrophobicContact CB-CB 3.74Å; V379-A388 HydrophobicContact CG1-CB 3.99Å; V379-A388 HydrophobicContact CG2-CB 3.3Å; V379-L404 HydrophobicContact CG2-CD1 4.35Å
380I85.3Confident86.9Confident48 Ų4850.4 Ų50.425%0.24625%0.251CS..Hα-helixtrans-68.4-48.3172.1-70.5168.5000110.1I376 I378 L382 N383 L404 Q407I376-I380 HydrophobicContact CG2-CD1 3.57Å; I376-I380 HydrophobicContact CG2-CG1 4.44Å; I376-I380 WeakPolarHBondContact O-CB 3.46Å; I376-I380 WeakPolarHBondContact O-CD1 3.41Å; I376-I380 WeakPolarHBondContact O-CG1 3.26Å; I376-I380 PolarHBondContact O-N 2.67Å; I376-I380 VanDerWaalsContact O-N 3.11Å; I378-I380 VanDerWaalsContact C-N 3.27Å; I378-I380 PolarHBondContact O-N 3.37Å; I380-L382 PolarHBondContact O-N 2.89Å; I380-N383 PolarHBondContact O-N 3.36Å; I380-L404 HydrophobicContact CD1-CD1 4.37Å; I380-L404 HydrophobicContact CG1-CD1 4.2Å; I380-Q407 HydrophobicContact CD1-CB 3.38Å; I380-Q407 HydrophobicContact CD1-CG 4.21Å
381R86.1Confident87.1Confident163 Ų16345.5 Ų45.562%0.61522%0.217SC*.Hα-helixtrans-57.2-36.6176-73.4175.1-177.6-166.9-0.8112.2L350 Q377 I378L350-R381 HydrophobicContact CD2-CB 4.47Å; Q377-R381 WeakPolarHBondContact O-CB 2.79Å; Q377-R381 VanDerWaalsContact O-CG 3.27Å; Q377-R381 WeakPolarHBondContact O-CG 3.43Å; Q377-R381 PolarHBondContact O-N 3.02Å; I378-R381 WeakPolarHBondContact O-CB 3.28Å; I378-R381 PolarHBondContact O-N 3.15Å; I378-R381 VanDerWaalsContact O-N 3.14Å
382L87.6Confident87.1Confident9 Ų942 Ų425%0.04720%0.198CC..THydrogen-bonded Turntrans-86.7-4.9179.3-63-172.7000114.5I349 L350 N353 I362 I378 I380 M384I349-L382 HydrophobicContact CG2-CD1 3.49Å; I349-L382 VanDerWaalsContact CG2-CD1 3.49Å; L350-L382 HydrophobicContact CD2-CD2 4.07Å; L350-L382 HydrophobicContact CD2-CG 4.48Å; N353-L382 HydrophobicContact CB-CD2 3.43Å; N353-L382 VanDerWaalsContact CB-CD2 3.43Å; N353-L382 WeakPolarHBondContact ND2-CD2 3.29Å; I362-L382 HydrophobicContact CG2-CD1 3.93Å; I378-L382 HydrophobicContact CG2-CD1 3.79Å; I378-L382 HydrophobicContact CG2-CG 4.2Å; I378-L382 WeakPolarHBondContact O-CB 2.99Å; I378-L382 VanDerWaalsContact O-CG 3.27Å; I378-L382 WeakPolarHBondContact O-CG 3.41Å; I378-L382 PolarHBondContact O-N 3.14Å; I380-L382 PolarHBondContact O-N 2.89Å; L382-M384 VanDerWaalsContact C-N 3.3Å; L382-M384 HydrophobicContact CB-CB 4.43Å; L382-M384 HydrophobicContact CB-CG 3.86Å; L382-M384 HydrophobicContact CB-SD 3.79Å; L382-M384 HydrophobicContact CD1-SD 3.83Å; L382-M384 HydrophobicContact CG-SD 4.49Å; L382-M384 PolarHBondContact O-N 3.06Å
383N86.7Confident87.2Confident107 Ų10740.8 Ų40.857%0.57219%0.191SC*.THydrogen-bonded Turntrans51.547.4-172.3-167.234.1000112.5V379 I380V379-N383 PolarHBondContact O-N 3.37Å; I380-N383 PolarHBondContact O-N 3.36Å
384M88.7Confident87.2Confident9 Ų939 Ų394%0.04418%0.183CC..  trans-113.743.1-179.8-65.8177.270.500111.3I362 E363 L366 V379 L382 D386 E387 A388I362-M384 HydrophobicContact CB-CE 4.44Å; I362-M384 HydrophobicContact CG2-CE 4.18Å; I362-M384 HydrophobicContact CG2-SD 3.94Å; E363-M384 HydrophobicContact CB-CE 4.28Å; E363-M384 HydrophobicContact CG-CE 3.21Å; L366-M384 HydrophobicContact CD1-CE 3.7Å; L366-M384 HydrophobicContact CD1-SD 4.32Å; V379-M384 HydrophobicContact CB-CB 4.46Å; V379-M384 PolarHBondContact O-N 3.32Å; L382-M384 VanDerWaalsContact C-N 3.3Å; L382-M384 HydrophobicContact CB-CB 4.43Å; L382-M384 HydrophobicContact CB-CG 3.86Å; L382-M384 HydrophobicContact CB-SD 3.79Å; L382-M384 HydrophobicContact CD1-SD 3.83Å; L382-M384 HydrophobicContact CG-SD 4.49Å; L382-M384 PolarHBondContact O-N 3.06Å; M384-D386 PolarHBondContact O-N 3.42Å; M384-E387 PolarHBondContact O-N 3.07Å; M384-A388 PolarHBondContact O-N 3.13Å; M384-A388 VanDerWaalsContact O-N 3.12Å
385V87.8Confident87Confident5 Ų539.6 Ų39.63%0.0319%0.185CC..Hα-helixtrans-58.9-35.4-174.8178.20000112.2E387 A388 V389 I408 K414V385-E387 PolarHBondContact O-N 3.4Å; V385-A388 WeakPolarHBondContact O-CB 3.13Å; V385-A388 PolarHBondContact O-N 3.48Å; V385-V389 HydrophobicContact CG1-CG2 4.41Å; V385-V389 WeakPolarHBondContact O-CG2 3.21Å; V385-V389 PolarHBondContact O-N 3.21Å; V385-I408 HydrophobicContact CB-CG2 4.47Å; V385-I408 HydrophobicContact CG1-CD1 4.27Å; V385-I408 HydrophobicContact CG1-CG2 3.81Å; V385-I408 HydrophobicContact CG2-CG2 3.74Å; V385-K414 HydrophobicContact CG1-CB 4.17Å; V385-K414 HydrophobicContact CG1-CG 4.35Å
386D88.2Confident86.9Confident95 Ų9544.6 Ų44.651%0.50820%0.203SC..Hα-helixtrans-61.8-44.5-179.4-63.9-14.8000111.7M384 V389 K390 K414M384-D386 PolarHBondContact O-N 3.42Å; D386-V389 PolarHBondContact O-N 2.93Å; D386-K390 PolarHBondContact O-N 3.32Å; D386-K414 WeakPolarHBondContact OD1-CD 3.44Å; D386-K414 WeakPolarHBondContact OD1-CE 3.5Å; D386-K414 WeakPolarHBondContact OD1-CG 3.39Å
387E87.2Confident86.9Confident27 Ų2746.4 Ų46.413%0.12621%0.213CC..Hα-helixtrans-71.5-35.1177.6-16562.2-155.600111.1E363 L366 M384 V385 V389 K390 L391E363-E387 HydrophobicContact CB-CG 4.32Å; E363-E387 HydrophobicContact CG-CB 4.39Å; E363-E387 HydrophobicContact CG-CG 4Å; L366-E387 HydrophobicContact CD1-CB 4.33Å; L366-E387 HydrophobicContact CD1-CG 3.99Å; M384-E387 PolarHBondContact O-N 3.07Å; V385-E387 PolarHBondContact O-N 3.4Å; E387-V389 PolarHBondContact O-N 2.85Å; E387-K390 WeakPolarHBondContact O-CB 3.26Å; E387-K390 PolarHBondContact O-N 3.27Å; E387-K390 IonicContact OE1-NZ 2.7Å; E387-K390 PolarHBondContact OE1-NZ 3.3Å; E387-K390 IonicContact OE2-NZ 2.67Å; E387-K390 PolarHBondContact OE2-NZ 2.73Å; E387-L391 HydrophobicContact CG-CD1 4.24Å; E387-L391 HydrophobicContact CG-CG 4.46Å; E387-L391 WeakPolarHBondContact O-CB 3.3Å; E387-L391 WeakPolarHBondContact O-CG 3.41Å; E387-L391 PolarHBondContact O-N 3.46Å
388A85.4Confident87.1Confident0 Ų045.8 Ų45.80%021%0.212CC..Hα-helixtrans-58.9-46.3173.800000112.1V379 M384 V385 K390 L391 C392 L404V379-A388 HydrophobicContact CB-CB 3.74Å; V379-A388 HydrophobicContact CG1-CB 3.99Å; V379-A388 HydrophobicContact CG2-CB 3.3Å; M384-A388 PolarHBondContact O-N 3.13Å; M384-A388 VanDerWaalsContact O-N 3.12Å; V385-A388 WeakPolarHBondContact O-CB 3.13Å; V385-A388 PolarHBondContact O-N 3.48Å; A388-K390 VanDerWaalsContact C-N 3.33Å; A388-K390 PolarHBondContact O-N 2.92Å; A388-L391 PolarHBondContact O-N 2.62Å; A388-C392 WeakPolarHBondContact O-CB 3.49Å; A388-C392 PolarHBondContact O-N 3.1Å; A388-C392 PolarHBondContact O-SG 2.95Å; A388-L404 HydrophobicContact CB-CD1 4.08Å; A388-L404 HydrophobicContact CB-CD2 3.69Å
389V89.4Confident87.2Confident2 Ų251.1 Ų51.11%0.01224%0.24CC..Hα-helixtrans-58.3-49.3175.8172.50000109.6V385 D386 E387 L391 C392 L393 L404 K414 I418 Y421V385-V389 HydrophobicContact CG1-CG2 4.41Å; V385-V389 WeakPolarHBondContact O-CG2 3.21Å; V385-V389 PolarHBondContact O-N 3.21Å; D386-V389 PolarHBondContact O-N 2.93Å; E387-V389 PolarHBondContact O-N 2.85Å; V389-L391 PolarHBondContact O-N 2.97Å; V389-C392 PolarHBondContact O-N 3.45Å; V389-L393 HydrophobicContact CG1-CD1 3.78Å; V389-L393 HydrophobicContact CG1-CG 4.31Å; V389-L393 WeakPolarHBondContact O-CG 3.31Å; V389-L393 PolarHBondContact O-N 3.4Å; V389-L404 HydrophobicContact CG2-CD2 3.7Å; V389-K414 HydrophobicContact CG2-CB 4.4Å; V389-I418 HydrophobicContact CG1-CG1 4.43Å; V389-I418 HydrophobicContact CG2-CD1 3.67Å; V389-I418 HydrophobicContact CG2-CG1 3.62Å; V389-Y421 HydrophobicContact CG1-CE2 4.46Å
390K87.7Confident87.3Confident82 Ų8251.3 Ų51.336%0.35724%0.242SC..Hα-helixtrans-57.1-47.3178.1178.6175.7155.7-135.80112.2D386 E387 A388 L393 E394D386-K390 PolarHBondContact O-N 3.32Å; E387-K390 WeakPolarHBondContact O-CB 3.26Å; E387-K390 PolarHBondContact O-N 3.27Å; E387-K390 IonicContact OE1-NZ 2.7Å; E387-K390 PolarHBondContact OE1-NZ 3.3Å; E387-K390 IonicContact OE2-NZ 2.67Å; E387-K390 PolarHBondContact OE2-NZ 2.73Å; A388-K390 VanDerWaalsContact C-N 3.33Å; A388-K390 PolarHBondContact O-N 2.92Å; K390-L393 PolarHBondContact O-N 2.92Å; K390-E394 WeakPolarHBondContact CE-OE1 3.4Å; K390-E394 WeakPolarHBondContact O-CG 3.36Å; K390-E394 PolarHBondContact O-N 2.78Å
391L85.9Confident87.6Confident6 Ų649 Ų493%0.03123%0.23CC..Hα-helixtrans-64.4-42.8178.4-71.1170.7000112.6L366 K367 L375 E387 A388 V389 L393 E394 K395L366-L391 HydrophobicContact CB-CD1 3.65Å; L366-L391 HydrophobicContact CD1-CD1 4.42Å; K367-L391 HydrophobicContact CB-CD2 4.16Å; L375-L391 HydrophobicContact CD1-CD1 3.9Å; L375-L391 HydrophobicContact CD2-CB 4.13Å; L375-L391 HydrophobicContact CD2-CD1 4.32Å; E387-L391 HydrophobicContact CG-CD1 4.24Å; E387-L391 HydrophobicContact CG-CG 4.46Å; E387-L391 WeakPolarHBondContact O-CB 3.3Å; E387-L391 WeakPolarHBondContact O-CG 3.41Å; E387-L391 PolarHBondContact O-N 3.46Å; A388-L391 PolarHBondContact O-N 2.62Å; V389-L391 PolarHBondContact O-N 2.97Å; L391-L393 VanDerWaalsContact C-N 3.28Å; L391-L393 PolarHBondContact O-N 3.29Å; L391-E394 PolarHBondContact O-N 3.43Å; L391-K395 WeakPolarHBondContact O-CB 3.36Å; L391-K395 WeakPolarHBondContact O-CG 3.49Å; L391-K395 PolarHBondContact O-N 3.22Å
392C86.8Confident87.9Confident1 Ų146.7 Ų46.71%0.00722%0.224CC..Hα-helixtrans-61-38.4175.1-69.10000111.8A388 V389 R396 N397 L401A388-C392 WeakPolarHBondContact O-CB 3.49Å; A388-C392 PolarHBondContact O-N 3.1Å; A388-C392 PolarHBondContact O-SG 2.95Å; V389-C392 PolarHBondContact O-N 3.45Å; C392-R396 WeakPolarHBondContact O-CA 3.44Å; C392-R396 PolarHBondContact O-N 3.47Å; C392-N397 PolarHBondContact O-N 2.9Å; C392-L401 HydrophobicContact CB-CB 4.23Å; C392-L401 HydrophobicContact CB-CD1 4.16Å
393L88.4Confident88.1Confident8 Ų850.3 Ų50.34%0.04224%0.241CC..Hα-helixtrans-69.8-42.9177.1-65.3170.9000112V389 K390 L391 R396 L401 Y421 W429 V433V389-L393 HydrophobicContact CG1-CD1 3.78Å; V389-L393 HydrophobicContact CG1-CG 4.31Å; V389-L393 WeakPolarHBondContact O-CG 3.31Å; V389-L393 PolarHBondContact O-N 3.4Å; K390-L393 PolarHBondContact O-N 2.92Å; L391-L393 VanDerWaalsContact C-N 3.28Å; L391-L393 PolarHBondContact O-N 3.29Å; L393-R396 PolarHBondContact O-N 3.43Å; L393-R396 VanDerWaalsContact O-N 3.11Å; L393-L401 HydrophobicContact CD2-CD2 4.17Å; L393-Y421 HydrophobicContact CD1-CD1 4.2Å; L393-Y421 HydrophobicContact CD1-CD2 3.97Å; L393-Y421 HydrophobicContact CD1-CE1 3.72Å; L393-Y421 HydrophobicContact CD1-CE2 3.49Å; L393-Y421 VanDerWaalsContact CD1-CE2 3.49Å; L393-Y421 HydrophobicContact CD1-CG 4.31Å; L393-Y421 HydrophobicContact CD2-CD1 3.46Å; L393-Y421 VanDerWaalsContact CD2-CD1 3.46Å; L393-Y421 HydrophobicContact CD2-CD2 3.99Å; L393-Y421 HydrophobicContact CD2-CE1 3.78Å; L393-Y421 HydrophobicContact CD2-CE2 4.3Å; L393-Y421 HydrophobicContact CD2-CG 3.58Å; L393-Y421 HydrophobicContact CG-CD1 4.48Å; L393-Y421 HydrophobicContact CG-CE1 4.4Å; L393-Y421 HydrophobicContact CG-CE2 4.5Å; L393-W429 HydrophobicContact CD2-CD2 3.78Å; L393-W429 HydrophobicContact CD2-CE3 3.55Å; L393-W429 HydrophobicContact CD2-CG 4.24Å; L393-W429 HydrophobicContact CD2-CH2 4.45Å; L393-W429 HydrophobicContact CD2-CZ3 3.91Å; L393-V433 HydrophobicContact CB-CG2 3.76Å; L393-V433 HydrophobicContact CD1-CG2 4.1Å
394E84.8Confident88.2Confident110 Ų11045.2 Ų45.251%0.51421%0.214SC..Hα-helixtrans-62.7-44.3175.4-75.4179.4-175.600111.7K390 L391 R396K390-E394 WeakPolarHBondContact CE-OE1 3.4Å; K390-E394 WeakPolarHBondContact O-CG 3.36Å; K390-E394 PolarHBondContact O-N 2.78Å; L391-E394 PolarHBondContact O-N 3.43Å; E394-R396 PolarHBondContact O-N 2.82Å
395K83.9Confident88.4Confident74 Ų7447.5 Ų47.532%0.32223%0.225SC..THydrogen-bonded Turntrans-71.4-12.1173.7-68.9-174-179.2-170.30113.2I369 D372 L391 N397I369-K395 PolarHBondContact O-NZ 3.04Å; D372-K395 WeakPolarHBondContact OD1-CD 3.46Å; D372-K395 IonicContact OD1-NZ 3.64Å; D372-K395 PolarHBondContact OD1-NZ 2.94Å; L391-K395 WeakPolarHBondContact O-CB 3.36Å; L391-K395 WeakPolarHBondContact O-CG 3.49Å; L391-K395 PolarHBondContact O-N 3.22Å; K395-N397 HydrophobicContact CB-CB 4.49Å; K395-N397 PolarHBondContact O-N 3.04Å
396R86.7Confident88.5Confident107 Ų10750.9 Ų50.940%0.40425%0.249SC..THydrogen-bonded Turntrans55.133.9-175.6-64.2174.8163.7-159.6-14.8113.1C392 L393 E394 V426C392-R396 WeakPolarHBondContact O-CA 3.44Å; C392-R396 PolarHBondContact O-N 3.47Å; L393-R396 PolarHBondContact O-N 3.43Å; L393-R396 VanDerWaalsContact O-N 3.11Å; E394-R396 PolarHBondContact O-N 2.82Å; R396-V426 HydrophobicContact CB-CG1 3.75Å; R396-V426 HydrophobicContact CG-CG1 4.05Å
397N87Confident88.5Confident39 Ų3949.3 Ų49.321%0.20924%0.239CC..  trans-95.4102.1-177.8-170.2-19.8000111.2D372 C392 K395 N399 A400 L401D372-N397 PolarHBondContact OD2-ND2 3.05Å; C392-N397 PolarHBondContact O-N 2.9Å; K395-N397 HydrophobicContact CB-CB 4.49Å; K395-N397 PolarHBondContact O-N 3.04Å; N397-N399 VanDerWaalsContact C-N 3.35Å; N397-N399 WeakPolarHBondContact OD1-CB 3.23Å; N397-N399 PolarHBondContact OD1-N 3.1Å; N397-A400 HydrophobicContact CB-CB 3.83Å; N397-A400 VanDerWaalsContact CG-CB 3.5Å; N397-A400 PolarHBondContact OD1-N 3.43Å; N397-L401 WeakPolarHBondContact O-CB 3.04Å; N397-L401 PolarHBondContact O-N 3.2Å; N397-L401 VanDerWaalsContact O-N 3.14Å
398I90.3Very high88.5Confident65 Ų6548.2 Ų48.233%0.33323%0.233SC..Hα-helixtrans-64.1-39.4177-49.9175.4000111.9L401 K402 L422 V426 W429I398-L401 PolarHBondContact O-N 3.43Å; I398-K402 HydrophobicContact CG2-CD 4.22Å; I398-K402 HydrophobicContact CG2-CG 4.42Å; I398-K402 WeakPolarHBondContact O-CG 3.27Å; I398-K402 PolarHBondContact O-N 2.95Å; I398-L422 HydrophobicContact CG2-CD2 3.83Å; I398-V426 HydrophobicContact CD1-CG2 3.22Å; I398-V426 HydrophobicContact CG1-CG2 3.27Å; I398-W429 HydrophobicContact CB-CH2 4.37Å; I398-W429 HydrophobicContact CG1-CH2 3.9Å; I398-W429 HydrophobicContact CG1-CZ2 4.22Å
399N91.1Very high88.3Confident116 Ų11651.6 Ų51.662%0.6226%0.256SS*.Hα-helixtrans-68.6-44.2-175.7-64.8-23.5000110.2N397 L401 K402 E403N397-N399 VanDerWaalsContact C-N 3.35Å; N397-N399 WeakPolarHBondContact OD1-CB 3.23Å; N397-N399 PolarHBondContact OD1-N 3.1Å; N399-L401 VanDerWaalsContact C-N 3.31Å; N399-L401 PolarHBondContact O-N 3.5Å; N399-K402 WeakPolarHBondContact O-CB 3.45Å; N399-K402 PolarHBondContact O-N 2.95Å; N399-E403 WeakPolarHBondContact O-CB 3.37Å; N399-E403 PolarHBondContact O-N 2.76Å
400A89.3Confident87.9Confident5 Ų554.6 Ų54.64%0.04129%0.287CS..Hα-helixtrans-58.8-43173.300000111.8D372 I376 N397 K402 E403 L404D372-A400 HydrophobicContact CB-CB 3.89Å; I376-A400 HydrophobicContact CD1-CB 3.94Å; I376-A400 WeakPolarHBondContact CD1-O 3.18Å; N397-A400 HydrophobicContact CB-CB 3.83Å; N397-A400 VanDerWaalsContact CG-CB 3.5Å; N397-A400 PolarHBondContact OD1-N 3.43Å; A400-K402 PolarHBondContact O-N 3.38Å; A400-E403 PolarHBondContact O-N 3.13Å; A400-L404 WeakPolarHBondContact O-CB 3.46Å; A400-L404 PolarHBondContact O-N 3.43Å
401L91Very high87.7Confident0 Ų057.6 Ų57.60%031%0.307CS..Hα-helixtrans-65.8-36.9178.4-171.963.6000112.8C392 L393 N397 I398 N399 M405 I418 L422 W429C392-L401 HydrophobicContact CB-CB 4.23Å; C392-L401 HydrophobicContact CB-CD1 4.16Å; L393-L401 HydrophobicContact CD2-CD2 4.17Å; N397-L401 WeakPolarHBondContact O-CB 3.04Å; N397-L401 PolarHBondContact O-N 3.2Å; N397-L401 VanDerWaalsContact O-N 3.14Å; I398-L401 PolarHBondContact O-N 3.43Å; N399-L401 VanDerWaalsContact C-N 3.31Å; N399-L401 PolarHBondContact O-N 3.5Å; L401-M405 PolarHBondContact O-N 3.11Å; L401-I418 HydrophobicContact CD1-CB 4.36Å; L401-I418 HydrophobicContact CD1-CG1 3.95Å; L401-I418 HydrophobicContact CD1-CG2 3.75Å; L401-I418 HydrophobicContact CD2-CG2 4.32Å; L401-I418 HydrophobicContact CG-CG2 3.71Å; L401-L422 HydrophobicContact CB-CD2 4.32Å; L401-L422 HydrophobicContact CD2-CD2 3.85Å; L401-L422 HydrophobicContact CD2-CG 4.04Å; L401-L422 HydrophobicContact CG-CD2 4.12Å; L401-L422 HydrophobicContact CG-CG 4.32Å; L401-W429 HydrophobicContact CD2-CH2 3.64Å; L401-W429 HydrophobicContact CD2-CZ2 3.92Å; L401-W429 HydrophobicContact CD2-CZ3 4.33Å
402K92.4Very high87.6Confident113 Ų11359.3 Ų59.349%0.49132%0.315SS..Hα-helixtrans-65.9-42.9173.8-76.9174.1175.9177.40111.8I398 N399 A400 M405 S406 L422I398-K402 HydrophobicContact CG2-CD 4.22Å; I398-K402 HydrophobicContact CG2-CG 4.42Å; I398-K402 WeakPolarHBondContact O-CG 3.27Å; I398-K402 PolarHBondContact O-N 2.95Å; N399-K402 WeakPolarHBondContact O-CB 3.45Å; N399-K402 PolarHBondContact O-N 2.95Å; A400-K402 PolarHBondContact O-N 3.38Å; K402-M405 WeakPolarHBondContact O-CB 3.42Å; K402-M405 PolarHBondContact O-N 3.26Å; K402-S406 PolarHBondContact O-N 2.96Å; K402-L422 HydrophobicContact CG-CD1 4.05Å; K402-L422 HydrophobicContact CG-CD2 3.77Å
403E91Very high87.5Confident85 Ų8568 Ų6840%0.39736%0.355SS..Hα-helixtrans-67.9-39.5179-171.758.4-148.200111.4I376 N399 A400 M405 S406 Q407I376-E403 HydrophobicContact CD1-CB 3.82Å; I376-E403 HydrophobicContact CD1-CG 4.05Å; N399-E403 WeakPolarHBondContact O-CB 3.37Å; N399-E403 PolarHBondContact O-N 2.76Å; A400-E403 PolarHBondContact O-N 3.13Å; E403-M405 VanDerWaalsContact C-N 3.3Å; E403-M405 PolarHBondContact O-N 3.45Å; E403-S406 PolarHBondContact O-N 3.06Å; E403-S406 PolarHBondContact O-OG 3.26Å; E403-Q407 WeakPolarHBondContact O-CG 3.49Å; E403-Q407 PolarHBondContact O-N 3.01Å; E403-Q407 VanDerWaalsContact O-N 3.15Å; E403-Q407 PolarHBondContact OE1-NE2 3.29Å
404L89.7Confident87.5Confident0 Ų069.3 Ų69.30%036%0.36CS..Hα-helixtrans-59.5-42169.8-175.665.3000111.3I376 V379 I380 A388 V389 A400 S406 Q407 I408 I418I376-L404 HydrophobicContact CG1-CB 4.45Å; I376-L404 HydrophobicContact CG2-CD1 4.3Å; V379-L404 HydrophobicContact CG2-CD1 4.35Å; I380-L404 HydrophobicContact CD1-CD1 4.37Å; I380-L404 HydrophobicContact CG1-CD1 4.2Å; A388-L404 HydrophobicContact CB-CD1 4.08Å; A388-L404 HydrophobicContact CB-CD2 3.69Å; V389-L404 HydrophobicContact CG2-CD2 3.7Å; A400-L404 WeakPolarHBondContact O-CB 3.46Å; A400-L404 PolarHBondContact O-N 3.43Å; L404-S406 VanDerWaalsContact C-N 3.33Å; L404-S406 PolarHBondContact O-N 3.27Å; L404-Q407 PolarHBondContact O-N 3.25Å; L404-I408 HydrophobicContact CD1-CG2 3.76Å; L404-I408 HydrophobicContact CG-CG2 4.13Å; L404-I408 WeakPolarHBondContact O-CG1 3.35Å; L404-I408 VanDerWaalsContact O-CG2 3.26Å; L404-I408 WeakPolarHBondContact O-CG2 3.24Å; L404-I408 PolarHBondContact O-N 3.18Å; L404-I418 HydrophobicContact CD2-CD1 4.3Å; L404-I418 HydrophobicContact CG-CD1 4.44Å
405M91.5Very high87.7Confident58 Ų5866.5 Ų66.529%0.28635%0.347SS..Hα-helixtrans-63.4-35.9178.2-167.5177.6178.100113.3L401 K402 E403 K415 I418 L422L401-M405 PolarHBondContact O-N 3.11Å; K402-M405 WeakPolarHBondContact O-CB 3.42Å; K402-M405 PolarHBondContact O-N 3.26Å; E403-M405 VanDerWaalsContact C-N 3.3Å; E403-M405 PolarHBondContact O-N 3.45Å; M405-K415 WeakPolarHBondContact O-CE 3.24Å; M405-K415 PolarHBondContact O-NZ 3.04Å; M405-I418 HydrophobicContact CB-CG2 3.79Å; M405-I418 HydrophobicContact CG-CG2 4.02Å; M405-I418 HydrophobicContact SD-CG2 3.98Å; M405-L422 HydrophobicContact SD-CD1 3.62Å
406S91Very high87.9Confident76 Ų7671.5 Ų71.553%0.53137%0.368SS..Hα-helixtrans-71.3-36.8179.869.10000111.6K402 E403 L404K402-S406 PolarHBondContact O-N 2.96Å; E403-S406 PolarHBondContact O-N 3.06Å; E403-S406 PolarHBondContact O-OG 3.26Å; L404-S406 VanDerWaalsContact C-N 3.33Å; L404-S406 PolarHBondContact O-N 3.27Å
407Q88.1Confident87.9Confident61 Ų6168.4 Ų68.429%0.28536%0.358SS..Hα-helixtrans-89.9-25.2-174.5-61.8-172.637.600115I380 E403 L404I380-Q407 HydrophobicContact CD1-CB 3.38Å; I380-Q407 HydrophobicContact CD1-CG 4.21Å; E403-Q407 WeakPolarHBondContact O-CG 3.49Å; E403-Q407 PolarHBondContact O-N 3.01Å; E403-Q407 VanDerWaalsContact O-N 3.15Å; E403-Q407 PolarHBondContact OE1-NE2 3.29Å; L404-Q407 PolarHBondContact O-N 3.25Å
408I86.6Confident88.1Confident4 Ų466.5 Ų66.52%0.02135%0.348CS..SBendtrans-70.8148.8-179.964.1-174.3000112.3V385 L404 K415 I418V385-I408 HydrophobicContact CB-CG2 4.47Å; V385-I408 HydrophobicContact CG1-CD1 4.27Å; V385-I408 HydrophobicContact CG1-CG2 3.81Å; V385-I408 HydrophobicContact CG2-CG2 3.74Å; L404-I408 HydrophobicContact CD1-CG2 3.76Å; L404-I408 HydrophobicContact CG-CG2 4.13Å; L404-I408 WeakPolarHBondContact O-CG1 3.35Å; L404-I408 VanDerWaalsContact O-CG2 3.26Å; L404-I408 WeakPolarHBondContact O-CG2 3.24Å; L404-I408 PolarHBondContact O-N 3.18Å; I408-K415 HydrophobicContact CD1-CG 3.56Å; I408-K415 HydrophobicContact CG1-CD 4.29Å; I408-K415 HydrophobicContact CG1-CG 3.79Å; I408-K415 WeakPolarHBondContact O-CE 3.34Å; I408-K415 PolarHBondContact O-NZ 2.84Å; I408-I418 HydrophobicContact CD1-CD1 3.42Å; I408-I418 VanDerWaalsContact CD1-CD1 3.42Å
409P82.1Confident88.1Confident72 Ų7266.4 Ų66.447%0.46835%0.353SS..  trans-53.6140.9178.7-27.935.4000113.3N411 H412 K415P409-N411 WeakPolarHBondContact CB-OD1 3.43Å; P409-N411 PolarHBondContact O-N 3Å; P409-N411 VanDerWaalsContact O-N 3.09Å; P409-H412 VanDerWaalsContact O-CB 3.24Å; P409-H412 WeakPolarHBondContact O-CB 3.36Å; P409-H412 PolarHBondContact O-N 3.41Å; P409-K415 WeakPolarHBondContact O-CE 3.33Å
410G80.8Confident88.1Confident65 Ų6565 Ų6567%0.6734%0.343SS*.THydrogen-bonded Turntrans-55.7-28.9-176.500000115.3
411N83Confident88.1Confident145 Ų14564.9 Ų64.978%0.77534%0.341SS*.THydrogen-bonded Turntrans-90.11.5179.362.7-13.1000114P409 Q413P409-N411 WeakPolarHBondContact CB-OD1 3.43Å; P409-N411 PolarHBondContact O-N 3Å; P409-N411 VanDerWaalsContact O-N 3.09Å; N411-Q413 PolarHBondContact O-N 3.46Å
412H84Confident88.1Confident42 Ų4267.4 Ų67.419%0.19435%0.354CS..  trans-67.3130.4-176.6-162.6-79.9000111.5P409 K414 K415P409-H412 VanDerWaalsContact O-CB 3.24Å; P409-H412 WeakPolarHBondContact O-CB 3.36Å; P409-H412 PolarHBondContact O-N 3.41Å; H412-K414 WeakPolarHBondContact ND1-CB 3.46Å; H412-K414 PolarHBondContact ND1-N 2.84Å; H412-K414 PolarHBondContact O-N 2.93Å; H412-K415 PolarHBondContact O-N 3.11Å
413Q85.8Confident88Confident184 Ų18466.1 Ų66.186%0.8636%0.36SS*.THydrogen-bonded Turntrans-57.7-36.1-174.3-66.7-178-7.800112.7N411 K415N411-Q413 PolarHBondContact O-N 3.46Å; Q413-K415 VanDerWaalsContact C-N 3.28Å; Q413-K415 PolarHBondContact O-N 3.26Å
414K86.6Confident88Confident34 Ų3463.4 Ų63.415%0.14835%0.349CS..Hα-helixtrans-66.2-15177.7-65.7-66.4-175.51740115.5V385 D386 V389 H412 K416 E417 I418V385-K414 HydrophobicContact CG1-CB 4.17Å; V385-K414 HydrophobicContact CG1-CG 4.35Å; D386-K414 WeakPolarHBondContact OD1-CD 3.44Å; D386-K414 WeakPolarHBondContact OD1-CE 3.5Å; D386-K414 WeakPolarHBondContact OD1-CG 3.39Å; V389-K414 HydrophobicContact CG2-CB 4.4Å; H412-K414 WeakPolarHBondContact ND1-CB 3.46Å; H412-K414 PolarHBondContact ND1-N 2.84Å; H412-K414 PolarHBondContact O-N 2.93Å; K414-K416 VanDerWaalsContact C-N 3.26Å; K414-K416 PolarHBondContact O-N 2.64Å; K414-E417 HydrophobicContact CD-CB 4.42Å; K414-E417 WeakPolarHBondContact CD-OE2 3.44Å; K414-E417 WeakPolarHBondContact CE-OE2 2.96Å; K414-E417 IonicContact NZ-OE1 3.71Å; K414-E417 IonicContact NZ-OE2 2.67Å; K414-E417 PolarHBondContact NZ-OE2 3.18Å; K414-E417 PolarHBondContact O-N 3.22Å; K414-E417 VanDerWaalsContact O-N 3.11Å; K414-I418 HydrophobicContact CB-CD1 4.35Å; K414-I418 VanDerWaalsContact O-CG1 3.31Å; K414-I418 WeakPolarHBondContact O-CG1 3.35Å; K414-I418 PolarHBondContact O-N 3.03Å
415K88.8Confident87.9Confident52 Ų5267.2 Ų67.223%0.22637%0.374CS..Hα-helixtrans-58.1-39.1178.1-85.2-162178.9-164.90112.6M405 I408 P409 H412 Q413 S419M405-K415 WeakPolarHBondContact O-CE 3.24Å; M405-K415 PolarHBondContact O-NZ 3.04Å; I408-K415 HydrophobicContact CD1-CG 3.56Å; I408-K415 HydrophobicContact CG1-CD 4.29Å; I408-K415 HydrophobicContact CG1-CG 3.79Å; I408-K415 WeakPolarHBondContact O-CE 3.34Å; I408-K415 PolarHBondContact O-NZ 2.84Å; P409-K415 WeakPolarHBondContact O-CE 3.33Å; H412-K415 PolarHBondContact O-N 3.11Å; Q413-K415 VanDerWaalsContact C-N 3.28Å; Q413-K415 PolarHBondContact O-N 3.26Å; K415-S419 WeakPolarHBondContact O-CB 3.47Å; K415-S419 PolarHBondContact O-N 3.47Å
416K88.2Confident87.6Confident179 Ų17966.1 Ų66.178%0.77837%0.37SS*.Hα-helixtrans-65.9-41.6177.4-68.3-176.6-179.4178.50111.6K414 S419 H420K414-K416 VanDerWaalsContact C-N 3.26Å; K414-K416 PolarHBondContact O-N 2.64Å; K416-S419 PolarHBondContact O-N 3.03Å; K416-H420 PolarHBondContact O-N 3.25Å
417E88.6Confident87.3Confident41 Ų4166.2 Ų66.219%0.19238%0.375CS..Hα-helixtrans-65.7-47.5177.7177.3169-170.500111.3K414 S419 H420 Y421 Q436K414-E417 HydrophobicContact CD-CB 4.42Å; K414-E417 WeakPolarHBondContact CD-OE2 3.44Å; K414-E417 WeakPolarHBondContact CE-OE2 2.96Å; K414-E417 IonicContact NZ-OE1 3.71Å; K414-E417 IonicContact NZ-OE2 2.67Å; K414-E417 PolarHBondContact NZ-OE2 3.18Å; K414-E417 PolarHBondContact O-N 3.22Å; K414-E417 VanDerWaalsContact O-N 3.11Å; E417-S419 VanDerWaalsContact C-N 3.33Å; E417-S419 PolarHBondContact O-N 3.37Å; E417-H420 WeakPolarHBondContact O-CB 3.45Å; E417-H420 PolarHBondContact O-N 3.4Å; E417-Y421 HydrophobicContact CG-CD2 3.78Å; E417-Y421 HydrophobicContact CG-CE2 3.37Å; E417-Y421 WeakPolarHBondContact O-CD2 3.33Å; E417-Y421 PolarHBondContact O-N 2.9Å; E417-Y421 WeakPolarHBondContact OE1-CE2 3.21Å; E417-Q436 PolarHBondContact OE1-NE2 3.46Å
418I90.8Very high87Confident0 Ų067.6 Ų67.60%038%0.382CS..Hα-helixtrans-59-45.2175.3-65164.2000110.9V389 L401 L404 M405 I408 K414 H420 Y421 L422V389-I418 HydrophobicContact CG1-CG1 4.43Å; V389-I418 HydrophobicContact CG2-CD1 3.67Å; V389-I418 HydrophobicContact CG2-CG1 3.62Å; L401-I418 HydrophobicContact CD1-CB 4.36Å; L401-I418 HydrophobicContact CD1-CG1 3.95Å; L401-I418 HydrophobicContact CD1-CG2 3.75Å; L401-I418 HydrophobicContact CD2-CG2 4.32Å; L401-I418 HydrophobicContact CG-CG2 3.71Å; L404-I418 HydrophobicContact CD2-CD1 4.3Å; L404-I418 HydrophobicContact CG-CD1 4.44Å; M405-I418 HydrophobicContact CB-CG2 3.79Å; M405-I418 HydrophobicContact CG-CG2 4.02Å; M405-I418 HydrophobicContact SD-CG2 3.98Å; I408-I418 HydrophobicContact CD1-CD1 3.42Å; I408-I418 VanDerWaalsContact CD1-CD1 3.42Å; K414-I418 HydrophobicContact CB-CD1 4.35Å; K414-I418 VanDerWaalsContact O-CG1 3.31Å; K414-I418 WeakPolarHBondContact O-CG1 3.35Å; K414-I418 PolarHBondContact O-N 3.03Å; I418-H420 PolarHBondContact O-N 3.18Å; I418-Y421 PolarHBondContact O-N 3.15Å; I418-L422 HydrophobicContact CG2-CD1 3.78Å; I418-L422 HydrophobicContact CG2-CG 4.2Å; I418-L422 WeakPolarHBondContact O-CB 3.5Å; I418-L422 WeakPolarHBondContact O-CG 3.37Å; I418-L422 PolarHBondContact O-N 3.16Å
419S90.1Very high86.9Confident62 Ų6267.6 Ų67.643%0.43438%0.382SS..Hα-helixtrans-59.3-35.5175.9-173.70000112.4K415 K416 E417 S423K415-S419 WeakPolarHBondContact O-CB 3.47Å; K415-S419 PolarHBondContact O-N 3.47Å; K416-S419 PolarHBondContact O-N 3.03Å; E417-S419 VanDerWaalsContact C-N 3.33Å; E417-S419 PolarHBondContact O-N 3.37Å; S419-S423 PolarHBondContact O-N 3.08Å
420H89.8Confident86.2Confident86 Ų8670.4 Ų70.440%0.39839%0.387SS..Hα-helixtrans-66.9-47.9175.4-177.462.9000111.1K416 E417 I418 L422 S423 V424 F432K416-H420 PolarHBondContact O-N 3.25Å; E417-H420 WeakPolarHBondContact O-CB 3.45Å; E417-H420 PolarHBondContact O-N 3.4Å; I418-H420 PolarHBondContact O-N 3.18Å; H420-L422 VanDerWaalsContact C-N 3.31Å; H420-L422 PolarHBondContact O-N 3.37Å; H420-S423 WeakPolarHBondContact O-CB 3.2Å; H420-S423 PolarHBondContact O-N 3.02Å; H420-S423 PolarHBondContact O-OG 3.05Å; H420-V424 PolarHBondContact O-N 2.89Å; H420-F432 AromaticContact CD2-CE1 3.83Å; H420-F432 AromaticContact NE2-CE1 3.21Å; H420-F432 WeakPolarHBondContact NE2-CE1 3.29Å; H420-F432 AromaticContact NE2-CZ 3.41Å; H420-F432 WeakPolarHBondContact NE2-CZ 3.44Å
421Y90Very high85.3Confident4 Ų471.7 Ų71.72%0.01638%0.378CS..Hα-helixtrans-59.5-40.3176-75.6-67.4000113.1V389 L393 E417 I418 S423 V424 W429 F432V389-Y421 HydrophobicContact CG1-CE2 4.46Å; L393-Y421 HydrophobicContact CD1-CD1 4.2Å; L393-Y421 HydrophobicContact CD1-CD2 3.97Å; L393-Y421 HydrophobicContact CD1-CE1 3.72Å; L393-Y421 HydrophobicContact CD1-CE2 3.49Å; L393-Y421 VanDerWaalsContact CD1-CE2 3.49Å; L393-Y421 HydrophobicContact CD1-CG 4.31Å; L393-Y421 HydrophobicContact CD2-CD1 3.46Å; L393-Y421 VanDerWaalsContact CD2-CD1 3.46Å; L393-Y421 HydrophobicContact CD2-CD2 3.99Å; L393-Y421 HydrophobicContact CD2-CE1 3.78Å; L393-Y421 HydrophobicContact CD2-CE2 4.3Å; L393-Y421 HydrophobicContact CD2-CG 3.58Å; L393-Y421 HydrophobicContact CG-CD1 4.48Å; L393-Y421 HydrophobicContact CG-CE1 4.4Å; L393-Y421 HydrophobicContact CG-CE2 4.5Å; E417-Y421 HydrophobicContact CG-CD2 3.78Å; E417-Y421 HydrophobicContact CG-CE2 3.37Å; E417-Y421 WeakPolarHBondContact O-CD2 3.33Å; E417-Y421 PolarHBondContact O-N 2.9Å; E417-Y421 WeakPolarHBondContact OE1-CE2 3.21Å; I418-Y421 PolarHBondContact O-N 3.15Å; Y421-S423 PolarHBondContact O-N 3.45Å; Y421-V424 WeakPolarHBondContact O-CG2 3.34Å; Y421-V424 PolarHBondContact O-N 3.09Å; Y421-W429 HydrophobicContact CD1-CG 4.32Å; Y421-W429 PolarHBondContact O-NE1 2.92Å; Y421-F432 HydrophobicContact CD1-CB 4.47Å; Y421-F432 HydrophobicContact CE1-CB 3.37Å; Y421-F432 HydrophobicContact CE1-CD1 4.48Å; Y421-F432 HydrophobicContact CE1-CD2 4.3Å; Y421-F432 AromaticContact CE1-CG 3.84Å; Y421-F432 HydrophobicContact CE1-CG 3.84Å; Y421-F432 WeakPolarHBondContact OH-CB 3.16Å
422L91.5Very high84.2Confident52 Ų5267.2 Ų67.227%0.27235%0.352SS..Hα-helixtrans-69.7-16.3176.9-68.4174.8000113.5I398 L401 K402 M405 I418 H420I398-L422 HydrophobicContact CG2-CD2 3.83Å; L401-L422 HydrophobicContact CB-CD2 4.32Å; L401-L422 HydrophobicContact CD2-CD2 3.85Å; L401-L422 HydrophobicContact CD2-CG 4.04Å; L401-L422 HydrophobicContact CG-CD2 4.12Å; L401-L422 HydrophobicContact CG-CG 4.32Å; K402-L422 HydrophobicContact CG-CD1 4.05Å; K402-L422 HydrophobicContact CG-CD2 3.77Å; M405-L422 HydrophobicContact SD-CD1 3.62Å; I418-L422 HydrophobicContact CG2-CD1 3.78Å; I418-L422 HydrophobicContact CG2-CG 4.2Å; I418-L422 WeakPolarHBondContact O-CB 3.5Å; I418-L422 WeakPolarHBondContact O-CG 3.37Å; I418-L422 PolarHBondContact O-N 3.16Å; H420-L422 VanDerWaalsContact C-N 3.31Å; H420-L422 PolarHBondContact O-N 3.37Å
423S90.8Very high83Confident86 Ų8667 Ų6760%0.60135%0.354SS*.Hα-helixtrans-86.7-17.2177.176.30000114.2S419 H420 Y421S419-S423 PolarHBondContact O-N 3.08Å; H420-S423 WeakPolarHBondContact O-CB 3.2Å; H420-S423 PolarHBondContact O-N 3.02Å; H420-S423 PolarHBondContact O-OG 3.05Å; Y421-S423 PolarHBondContact O-N 3.45Å
424V89.8Confident81.3Confident28 Ų2862.5 Ų62.517%0.1734%0.341CS..SBendtrans-108.2148-178.6-64.20000111.4H420 Y421 V426 W429 F432H420-V424 PolarHBondContact O-N 2.89Å; Y421-V424 WeakPolarHBondContact O-CG2 3.34Å; Y421-V424 PolarHBondContact O-N 3.09Å; V424-V426 PolarHBondContact O-N 3.32Å; V424-W429 PolarHBondContact O-NE1 3.35Å; V424-F432 HydrophobicContact CG2-CE2 4.26Å
425P88.1Confident79.4Confident81 Ų8169.9 Ų69.953%0.52637%0.368SS..  trans-56.2138.5174.7-24.633.4000112.3A427 Q428P425-A427 PolarHBondContact O-N 3.48Å; P425-Q428 WeakPolarHBondContact O-CB 3.41Å; P425-Q428 PolarHBondContact O-N 3.34Å
426V86.1Confident77.4Confident35 Ų3573.1 Ų73.121%0.21238%0.384CS..G310 helixtrans-51.1-31.9179.8177.50000113.7R396 I398 V424 Q428 W429R396-V426 HydrophobicContact CB-CG1 3.75Å; R396-V426 HydrophobicContact CG-CG1 4.05Å; I398-V426 HydrophobicContact CD1-CG2 3.22Å; I398-V426 HydrophobicContact CG1-CG2 3.27Å; V424-V426 PolarHBondContact O-N 3.32Å; V426-Q428 PolarHBondContact O-N 2.97Å; V426-W429 HydrophobicContact CB-CD2 4.37Å; V426-W429 HydrophobicContact CG1-CD2 4.21Å; V426-W429 HydrophobicContact CG1-CE3 4.09Å; V426-W429 HydrophobicContact CG1-CZ3 4.46Å; V426-W429 HydrophobicContact CG2-CD2 4.38Å; V426-W429 HydrophobicContact CG2-CH2 4.18Å; V426-W429 HydrophobicContact CG2-CZ2 3.9Å; V426-W429 WeakPolarHBondContact O-CB 3.37Å; V426-W429 PolarHBondContact O-N 3.29Å; V426-W429 VanDerWaalsContact O-N 3.13Å
427A83.2Confident74.9Confident77 Ų7769.6 Ų69.664%0.63638%0.378SS*.G310 helixtrans-56.9-31.1176.400000112.9P425P425-A427 PolarHBondContact O-N 3.48Å
428Q83.3Confident72.1Confident91 Ų9180 Ų8043%0.42542%0.423SS..G310 helixtrans-85.2-12.2-178.5-62.9-179.2-10.600113.2P425 V426 K430 D431 F432P425-Q428 WeakPolarHBondContact O-CB 3.41Å; P425-Q428 PolarHBondContact O-N 3.34Å; V426-Q428 PolarHBondContact O-N 2.97Å; Q428-K430 PolarHBondContact O-N 2.82Å; Q428-K430 VanDerWaalsContact O-N 3.15Å; Q428-D431 PolarHBondContact O-N 3.47Å; Q428-D431 VanDerWaalsContact O-N 3.11Å; Q428-F432 VanDerWaalsContact O-CD2 3.3Å; Q428-F432 WeakPolarHBondContact O-CD2 3.37Å
429W83.8Confident71.2Confident3 Ų384 Ų841%0.01144%0.444CS..THydrogen-bonded Turntrans-60.5-29.2-176.7-66.82.7000113.3L393 I398 L401 Y421 V424 V426 D431 F432 V433L393-W429 HydrophobicContact CD2-CD2 3.78Å; L393-W429 HydrophobicContact CD2-CE3 3.55Å; L393-W429 HydrophobicContact CD2-CG 4.24Å; L393-W429 HydrophobicContact CD2-CH2 4.45Å; L393-W429 HydrophobicContact CD2-CZ3 3.91Å; I398-W429 HydrophobicContact CB-CH2 4.37Å; I398-W429 HydrophobicContact CG1-CH2 3.9Å; I398-W429 HydrophobicContact CG1-CZ2 4.22Å; L401-W429 HydrophobicContact CD2-CH2 3.64Å; L401-W429 HydrophobicContact CD2-CZ2 3.92Å; L401-W429 HydrophobicContact CD2-CZ3 4.33Å; Y421-W429 HydrophobicContact CD1-CG 4.32Å; Y421-W429 PolarHBondContact O-NE1 2.92Å; V424-W429 PolarHBondContact O-NE1 3.35Å; V426-W429 HydrophobicContact CB-CD2 4.37Å; V426-W429 HydrophobicContact CG1-CD2 4.21Å; V426-W429 HydrophobicContact CG1-CE3 4.09Å; V426-W429 HydrophobicContact CG1-CZ3 4.46Å; V426-W429 HydrophobicContact CG2-CD2 4.38Å; V426-W429 HydrophobicContact CG2-CH2 4.18Å; V426-W429 HydrophobicContact CG2-CZ2 3.9Å; V426-W429 WeakPolarHBondContact O-CB 3.37Å; V426-W429 PolarHBondContact O-N 3.29Å; V426-W429 VanDerWaalsContact O-N 3.13Å; W429-D431 PolarHBondContact O-N 3.29Å; W429-F432 PolarHBondContact O-N 3.18Å; W429-F432 VanDerWaalsContact O-N 3.08Å; W429-V433 PolarHBondContact O-N 3.41Å
430K67Low70.2Confident132 Ų13285.2 Ų85.257%0.57444%0.444SS*.Hα-helixtrans-58.2-35.2177.4-86-172.3171.2-179.70112.9Q428 F432 C434Q428-K430 PolarHBondContact O-N 2.82Å; Q428-K430 VanDerWaalsContact O-N 3.15Å; K430-F432 PolarHBondContact O-N 3.09Å; K430-C434 PolarHBondContact O-N 2.87Å
431D62Low69.1Low91 Ų9185.1 Ų85.149%0.48745%0.447SS..Hα-helixtrans-70.3-18.5-178.4-63.4-27.4000112.3Q428 W429 R435Q428-D431 PolarHBondContact O-N 3.47Å; Q428-D431 VanDerWaalsContact O-N 3.11Å; W429-D431 PolarHBondContact O-N 3.29Å; D431-R435 WeakPolarHBondContact O-CD 3.29Å; D431-R435 WeakPolarHBondContact O-CG 3.4Å; D431-R435 PolarHBondContact O-NE 2.95Å; D431-R435 VanDerWaalsContact O-NE 3.15Å
432F59.3Low67.9Low52 Ų5289.9 Ų89.923%0.22847%0.472CS..Hα-helixtrans-96-39.1-177.8-71.2-84.7000112.5H420 Y421 V424 Q428 W429 K430 C434 R435H420-F432 AromaticContact CD2-CE1 3.83Å; H420-F432 AromaticContact NE2-CE1 3.21Å; H420-F432 WeakPolarHBondContact NE2-CE1 3.29Å; H420-F432 AromaticContact NE2-CZ 3.41Å; H420-F432 WeakPolarHBondContact NE2-CZ 3.44Å; Y421-F432 HydrophobicContact CD1-CB 4.47Å; Y421-F432 HydrophobicContact CE1-CB 3.37Å; Y421-F432 HydrophobicContact CE1-CD1 4.48Å; Y421-F432 HydrophobicContact CE1-CD2 4.3Å; Y421-F432 AromaticContact CE1-CG 3.84Å; Y421-F432 HydrophobicContact CE1-CG 3.84Å; Y421-F432 WeakPolarHBondContact OH-CB 3.16Å; V424-F432 HydrophobicContact CG2-CE2 4.26Å; Q428-F432 VanDerWaalsContact O-CD2 3.3Å; Q428-F432 WeakPolarHBondContact O-CD2 3.37Å; W429-F432 PolarHBondContact O-N 3.18Å; W429-F432 VanDerWaalsContact O-N 3.08Å; K430-F432 PolarHBondContact O-N 3.09Å; F432-C434 VanDerWaalsContact C-N 3.3Å; F432-C434 PolarHBondContact O-N 2.97Å; F432-R435 PolarHBondContact O-N 3.18Å; F432-R435 VanDerWaalsContact O-N 3.14Å
433V58.9Low66.4Low38 Ų3892.3 Ų92.323%0.2349%0.485CS..Hα-helixtrans-63-37.5177.2179.80000111.4L393 W429 R435L393-V433 HydrophobicContact CB-CG2 3.76Å; L393-V433 HydrophobicContact CD1-CG2 4.1Å; W429-V433 PolarHBondContact O-N 3.41Å; V433-R435 VanDerWaalsContact C-N 3.3Å; V433-R435 PolarHBondContact O-N 3.27Å
434C51.2Low64.8Low89 Ų8992.7 Ų92.760%0.60148%0.477SS*.THydrogen-bonded Turntrans-75.1-12.6177.3-72.10000114.3K430 F432K430-C434 PolarHBondContact O-N 2.87Å; F432-C434 VanDerWaalsContact C-N 3.3Å; F432-C434 PolarHBondContact O-N 2.97Å
435R45.8Very low63Low188 Ų18897.3 Ų97.371%0.70950%0.499SS*.THydrogen-bonded Turntrans-90.3-10.1-176.9-76.9178.2-166.2-175.55.8114.3D431 F432 V433D431-R435 WeakPolarHBondContact O-CD 3.29Å; D431-R435 WeakPolarHBondContact O-CG 3.4Å; D431-R435 PolarHBondContact O-NE 2.95Å; D431-R435 VanDerWaalsContact O-NE 3.15Å; F432-R435 PolarHBondContact O-N 3.18Å; F432-R435 VanDerWaalsContact O-N 3.14Å; V433-R435 VanDerWaalsContact C-N 3.3Å; V433-R435 PolarHBondContact O-N 3.27Å
436Q47.1Very low61Low121 Ų12198.5 Ų98.557%0.56550%0.497SS*.SBendtrans-103.42.6-179.9-66.5-171.110.600114.1E417E417-Q436 PolarHBondContact OE1-NE2 3.46Å
437T35.9Very low59Low105 Ų105103.8 Ų103.864%0.64452%0.521SS*.  trans-102.727.3-176.332.20000114.4
438F30.2Very low56.7Low259 Ų259106.3 Ų106.3100%1.13651%0.51SS*.  trans-130.60169.7-75.7-77.4000112.1

Retrieved 438 of 438 residues in 141.4 ms (Link to these results)