G4VTP8_SCHMA Loading...

BZIP domain-containing protein

AlphaFold DB , UniProt , Accession G4VTP8, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 442 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
1M46.7Very low47.2Very low233 Ų233154.6 Ų154.6100%1.14883%0.826SS**  0113.90-62.387.5157.600105.9
2D52.2Low46.5Very low154 Ų154151 Ų15182%0.82482%0.822SS**  cis-146.7124.66.8-83.2-43.3000104.8
3K44.8Very low45.9Very low204 Ų204147 Ų14789%0.88782%0.822SS**  58.6133.169.2-98.2-169.7177.5-168.90117.2
4S57.2Low45.5Very low118 Ų118150.5 Ų150.583%0.82583%0.829SS**  trans89.9113.6170.568.80000116.3
5Q44.3Very low44.8Very low167 Ų167148.8 Ų148.878%0.7883%0.832SS**  cis7899.727.8-15897.74900115.7
6I48.4Very low44.6Very low134 Ų134146.6 Ų146.669%0.68783%0.829SS**  trans72.3143.5145.8-69.5176.4000116.3
7P49.4Very low44.4Very low120 Ų120145 Ų14578%0.77983%0.83SS**  cis-142.7166.146.324.32.6000121.2
8N40.5Very low44.5Very low142 Ų142145.6 Ų145.676%0.75983%0.828SS**  trans-56.7143.1163.4-71.8-47.4000113.3
9E48.2Very low44.6Very low188 Ų188147.8 Ų147.888%0.87983%0.827SS**  trans-151127.3145.5-82-64.1125.500107.3
10T43Very low44.5Very low122 Ų122148.3 Ų148.375%0.74883%0.827SS**  trans-102.4146.5169.4-360000106.8
11P44.8Very low44.6Very low119 Ų119147.1 Ų147.177%0.77382%0.824SS**  -149.2138.4114.929.9-10000115.9
12S37.9Very low44.5Very low111 Ų111142.5 Ų142.578%0.77681%0.809SS**  trans30.8118.8137-53.50000122.6
13A39.2Very low44.5Very low99 Ų99139.2 Ų139.282%0.81880%0.803SS**  66.3100.5129.300000119.8
14E39.7Very low45.3Very low196 Ų196135.2 Ų135.292%0.91680%0.798SS**  trans-138.2119.2142.1-102.7-174.9163.500111.2
15S35.6Very low44.9Very low125 Ų125139.8 Ų139.887%0.87480%0.797SS**  trans-65.5120.1175.536.60000112
16S41.7Very low45.5Very low113 Ų113136.9 Ų136.979%0.7979%0.793SS**  trans-115.1123.2169.149.40000111.7
17S41.2Very low45.9Very low120 Ų120137.4 Ų137.484%0.83980%0.803SS**  trans-43.5121.4-177.8-65.40000116.3K19S17-K19 PolarHBondContact O-N 2.99Å
18I47.1Very low46.5Very low155 Ų155136.3 Ų136.380%0.79579%0.794SS**  trans-77.3103.8159.8-58.4173.6000107.7L20I18-L20 PolarHBondContact O-N 3.22Å
19K45.9Very low46.9Very low188 Ų188136.3 Ų136.382%0.81779%0.793SS**  trans-6796.2169.8-123.8178.5-175.5-177.40108.4S17 T21S17-K19 PolarHBondContact O-N 2.99Å; K19-T21 PolarHBondContact O-N 3.49Å
20L41.3Very low47.2Very low158 Ų158133.9 Ų133.983%0.82779%0.786SS**  trans-66.697.6165.6-85.6140.8000108.4I18 T22I18-L20 PolarHBondContact O-N 3.22Å; L20-T22 PolarHBondContact O-N 3.48Å
21T47.5Very low47.9Very low124 Ų124134 Ų13476%0.76178%0.781SS**  trans-77.8107.5170.9570000108.4K19 A23K19-T21 PolarHBondContact O-N 3.49Å; T21-A23 PolarHBondContact O-N 3.25Å
22T44.9Very low48.1Very low135 Ų135135.4 Ų135.483%0.82878%0.781SS**  trans-66.7100175-52.40000109.4L20L20-T22 PolarHBondContact O-N 3.48Å
23A51.8Low48.8Very low85 Ų85135.6 Ų135.670%0.70277%0.773SS**PPolyproline II helixtrans-67.6130.6168.600000109.6T21T21-A23 PolarHBondContact O-N 3.25Å
24P61.2Low49.2Very low120 Ų120137 Ų13778%0.77977%0.767SS**PPolyproline II helixtrans-68.8134.8178.329.1-31.8000109.3
25R49.9Very low49.3Very low214 Ų214135.2 Ų135.281%0.80876%0.763SS**PPolyproline II helixtrans-56.1134.5174.7-80.2178.4167.5-168.4-5.4110T27R25-T27 PolarHBondContact O-N 3.43Å
26P56.6Low49.8Very low107 Ų107135.2 Ų135.270%0.69576%0.758SS**PPolyproline II helixtrans-65.9122.4174.226.4-31.4000109.7T28P26-T28 PolarHBondContact O-N 2.93Å
27T56.5Low50Low145 Ų145136.6 Ų136.689%0.8976%0.755SS**  trans-88.724.3179.9-30.50000112.2R25R25-T27 PolarHBondContact O-N 3.43Å
28T61.2Low50Low97 Ų97141.2 Ų141.260%0.59576%0.76SS**SBendtrans-128.1131.8179.554.80000109.6P26 N30P26-T28 PolarHBondContact O-N 2.93Å; T28-N30 VanDerWaalsContact C-N 3.31Å; T28-N30 PolarHBondContact O-N 3.25Å
29L49.8Very low49.6Very low142 Ų142136.5 Ų136.574%0.74374%0.741SS**  trans-70.290.9176.8-148.4153.7000106.5I31L29-I31 HydrophobicContact CD2-CD1 4.12Å; L29-I31 HydrophobicContact CD2-CG1 3.47Å; L29-I31 VanDerWaalsContact CD2-CG1 3.47Å; L29-I31 PolarHBondContact O-N 3.32Å
30N53.8Low49.5Very low137 Ų137133.9 Ų133.973%0.73374%0.743SS**  trans-66.288.4172-85.66.8000108T28 L32T28-N30 VanDerWaalsContact C-N 3.31Å; T28-N30 PolarHBondContact O-N 3.25Å; N30-L32 PolarHBondContact O-N 3.19Å
31I57.5Low49.6Very low124 Ų124129.7 Ų129.764%0.63673%0.731SS**  trans-73.8101.6162.2-54.9174.8000104.4L29 L33L29-I31 HydrophobicContact CD2-CD1 4.12Å; L29-I31 HydrophobicContact CD2-CG1 3.47Å; L29-I31 VanDerWaalsContact CD2-CG1 3.47Å; L29-I31 PolarHBondContact O-N 3.32Å; I31-L33 VanDerWaalsContact C-N 3.31Å; I31-L33 HydrophobicContact CG2-CD1 3.8Å; I31-L33 PolarHBondContact O-N 3.34Å
32L49.5Very low49.4Very low148 Ų148129 Ų12978%0.77572%0.723SS**  trans-60.698166.8-168.694.5000106.6N30N30-L32 PolarHBondContact O-N 3.19Å
33L53.9Low49.3Very low115 Ų115126.9 Ų126.960%0.60271%0.713SS**  trans-78.5114.6164.2-116.267.1000105.8I31 N35I31-L33 VanDerWaalsContact C-N 3.31Å; I31-L33 HydrophobicContact CG2-CD1 3.8Å; I31-L33 PolarHBondContact O-N 3.34Å; L33-N35 PolarHBondContact O-N 3.45Å
34D47Very low49Very low130 Ų130127.8 Ų127.870%0.69571%0.714SS**  trans-60.6103.7172.3-76.5-35.1000109.1T36D34-T36 PolarHBondContact O-N 3.36Å
35N42.3Very low48.1Very low157 Ų157130.8 Ų130.884%0.8472%0.715SS**  trans-71.375.9170.3-79.42000109.1L33L33-N35 PolarHBondContact O-N 3.45Å
36T45.5Very low48.3Very low126 Ų126127.3 Ų127.377%0.77371%0.712SS**  trans-119.36.5166.4-37.80000112.3D34D34-T36 PolarHBondContact O-N 3.36Å
37I46.3Very low48.1Very low141 Ų141128.4 Ų128.472%0.72372%0.717SS**SBendtrans-112.6108.8168-55.8178000107.6S39I37-S39 PolarHBondContact O-N 3.34Å
38K41.6Very low48Very low217 Ų217125.9 Ų125.994%0.94370%0.703SS**  trans-62.781.8167.3-65.3173.3179177.80108.3
39S38.5Very low47.7Very low56 Ų56124.4 Ų124.439%0.39270%0.696SS.*  trans-120.1111.5171.754.50000109I37 A41I37-S39 PolarHBondContact O-N 3.34Å; S39-A41 PolarHBondContact O-N 3.37Å
40P43Very low48.1Very low134 Ų134121.4 Ų121.487%0.8768%0.681SS**THydrogen-bonded Turntrans-75.631179.632.7-33.9000113
41A43.9Very low48.6Very low70 Ų70120.7 Ų120.758%0.57967%0.673SS**THydrogen-bonded Turntrans-121.36.3-166.900000114.8S39S39-A41 PolarHBondContact O-N 3.37Å
42L42.3Very low48.8Very low110 Ų110122.1 Ų122.158%0.57668%0.677SS**  trans-115.224.2-178.2-62.1-177.9000114.1S44 F45L42-S44 VanDerWaalsContact C-N 3.3Å; L42-F45 HydrophobicContact CD2-CD2 4.44Å; L42-F45 HydrophobicContact CD2-CE2 4.45Å
43S42.6Very low49.1Very low90 Ų90117.7 Ų117.763%0.62965%0.654SS**SBendtrans-79.5-11.3165.750.50000113.2F45S43-F45 VanDerWaalsContact C-N 3.34Å; S43-F45 PolarHBondContact O-N 3.5Å
44S45.7Very low49.8Very low103 Ų103118.7 Ų118.772%0.7266%0.655SS**THydrogen-bonded Turntrans-85.910.2-175.2-64.10000115.9L42L42-S44 VanDerWaalsContact C-N 3.3Å
45F42.2Very low50.5Low184 Ų184117.7 Ų117.781%0.80766%0.656SS**THydrogen-bonded Turntrans-109.310.1174.6-75.4-75.1000114.2L42 S43 T47L42-F45 HydrophobicContact CD2-CD2 4.44Å; L42-F45 HydrophobicContact CD2-CE2 4.45Å; S43-F45 VanDerWaalsContact C-N 3.34Å; S43-F45 PolarHBondContact O-N 3.5Å; F45-T47 PolarHBondContact O-N 2.93Å
46L54.1Low51.4Low141 Ų141116.1 Ų116.174%0.73865%0.647SS**SBendtrans-74.5119.9159.8-74.4160.4000107.2P48L46-P48 VanDerWaalsContact O-N 3.12Å
47T53.6Low52.1Low129 Ų129113.9 Ų113.979%0.79163%0.629SS**PPolyproline II helixtrans-47.9120.616742.60000108.1F45 S49F45-T47 PolarHBondContact O-N 2.93Å; T47-S49 PolarHBondContact O-N 3.21Å
48P53.3Low53Low93 Ų93111.9 Ų111.960%0.60461%0.613SS**PPolyproline II helixtrans-60127.9-178.323.8-31000107.8L46L46-P48 VanDerWaalsContact O-N 3.12Å
49S56.1Low54.5Low65 Ų65104 Ų10446%0.45559%0.585SS.*PPolyproline II helixtrans-60.5147.1176.5-155.10000108.5T47 E51 E52T47-S49 PolarHBondContact O-N 3.21Å; S49-E51 WeakPolarHBondContact CB-OE2 3.42Å; S49-E51 PolarHBondContact O-N 3.07Å; S49-E51 PolarHBondContact OG-OE2 3.12Å; S49-E52 PolarHBondContact O-N 3.04Å
50L57.3Low56.2Low79 Ų79106.6 Ų106.641%0.41459%0.591SS.*G310 helixtrans-56.3-20.9-178.6-171.861.1000112L53 V61L50-L53 HydrophobicContact CD1-CD1 4.28Å; L50-V61 HydrophobicContact CD1-CG1 4.03Å
51E65.5Low57.6Low123 Ų123102.8 Ų102.858%0.57557%0.565SS**G310 helixtrans-77.5-5175-59.276-161.900115.3S49 R58S49-E51 WeakPolarHBondContact CB-OE2 3.42Å; S49-E51 PolarHBondContact O-N 3.07Å; S49-E51 PolarHBondContact OG-OE2 3.12Å; E51-R58 VanDerWaalsContact CA-NH2 3.34Å; E51-R58 PolarHBondContact O-NH2 3.49Å
52E61.4Low59Low153 Ų153105 Ų10572%0.71556%0.563SS**G310 helixtrans-101.1-5.5177.8-83.7177.5157.300114.2S49S49-E52 PolarHBondContact O-N 3.04Å
53L54.8Low60.7Low56 Ų56106.8 Ų106.829%0.29357%0.566SS.*SBendtrans-76.2140.9177-67.6174.5000111.5L50 R58 V61L50-L53 HydrophobicContact CD1-CD1 4.28Å; L53-R58 HydrophobicContact CB-CG 3.8Å; L53-R58 WeakPolarHBondContact O-CG 3.01Å; L53-R58 PolarHBondContact O-NE 2.97Å; L53-V61 HydrophobicContact CD1-CB 4.5Å; L53-V61 HydrophobicContact CD1-CG1 4.49Å; L53-V61 HydrophobicContact CD1-CG2 4.09Å
54Q68.6Low62.1Low135 Ų135106.9 Ų106.963%0.63156%0.559SS**  trans-53.3145.3171.8-84.8-164.9-34.100111I56 L57 R58Q54-I56 PolarHBondContact O-N 3.48Å; Q54-I56 VanDerWaalsContact O-N 3.08Å; Q54-L57 HydrophobicContact CB-CD1 4.34Å; Q54-L57 CarbonylContact O-C 3.44Å; Q54-L57 PolarHBondContact O-N 2.95Å; Q54-R58 PolarHBondContact O-N 3.38Å
55P63.1Low63.5Low109 Ų109105.8 Ų105.871%0.70855%0.545SS*.Hα-helixtrans-54.9-34.3-174.2-24.531.7000114.5R58 S59P55-R58 PolarHBondContact O-N 2.77Å; P55-S59 PolarHBondContact O-N 3.22Å
56I60.9Low65Low125 Ų125103.7 Ų103.764%0.64154%0.537SS*.Hα-helixtrans-67.1-45.6177.5-72.7164.6000110.8Q54 S59 E60Q54-I56 PolarHBondContact O-N 3.48Å; Q54-I56 VanDerWaalsContact O-N 3.08Å; I56-S59 PolarHBondContact O-N 3.16Å; I56-S59 PolarHBondContact O-OG 3.09Å; I56-E60 PolarHBondContact O-N 2.94Å
57L60.5Low65.6Low79 Ų79103.4 Ų103.441%0.41453%0.532SS..Hα-helixtrans-70.5-30.4177.2-65.4173.2000112.1Q54 E60 V61Q54-L57 HydrophobicContact CB-CD1 4.34Å; Q54-L57 CarbonylContact O-C 3.44Å; Q54-L57 PolarHBondContact O-N 2.95Å; L57-E60 PolarHBondContact O-N 3.45Å; L57-V61 VanDerWaalsContact O-CB 3.31Å; L57-V61 WeakPolarHBondContact O-CB 3.4Å; L57-V61 WeakPolarHBondContact O-CG2 3.38Å; L57-V61 PolarHBondContact O-N 3.39Å
58R64.5Low65.9Low98 Ų98102.7 Ų102.737%0.3752%0.523SS..Hα-helixtrans-61.3-43.4171.9-72.2-171.8-172.9-1697.9111.9E51 L53 Q54 P55 E60 V61 E62E51-R58 VanDerWaalsContact CA-NH2 3.34Å; E51-R58 PolarHBondContact O-NH2 3.49Å; L53-R58 HydrophobicContact CB-CG 3.8Å; L53-R58 WeakPolarHBondContact O-CG 3.01Å; L53-R58 PolarHBondContact O-NE 2.97Å; Q54-R58 PolarHBondContact O-N 3.38Å; P55-R58 PolarHBondContact O-N 2.77Å; R58-E60 VanDerWaalsContact C-N 3.29Å; R58-E60 PolarHBondContact O-N 2.91Å; R58-V61 PolarHBondContact O-N 3.19Å; R58-E62 VanDerWaalsContact O-CB 3.24Å; R58-E62 WeakPolarHBondContact O-CB 3.4Å; R58-E62 WeakPolarHBondContact O-CG 3.38Å; R58-E62 PolarHBondContact O-N 3.43Å
59S72.5Confident66.3Low51 Ų51106 Ų10636%0.35753%0.527SS..Hα-helixtrans-66-33.6179.380.40000112.6P55 I56 K63P55-S59 PolarHBondContact O-N 3.22Å; I56-S59 PolarHBondContact O-N 3.16Å; I56-S59 PolarHBondContact O-OG 3.09Å; S59-K63 WeakPolarHBondContact O-CB 3.22Å; S59-K63 WeakPolarHBondContact O-CD 3.39Å; S59-K63 WeakPolarHBondContact O-CG 3.37Å; S59-K63 PolarHBondContact O-N 2.96Å
60E73.8Confident66.5Low111 Ų111106.8 Ų106.852%0.51954%0.538SS..Hα-helixtrans-79.7-39.2179.7-162.9155.7-165.800111.3I56 L57 R58 K63 I64I56-E60 PolarHBondContact O-N 2.94Å; L57-E60 PolarHBondContact O-N 3.45Å; R58-E60 VanDerWaalsContact C-N 3.29Å; R58-E60 PolarHBondContact O-N 2.91Å; E60-K63 PolarHBondContact O-N 3.25Å; E60-I64 HydrophobicContact CG-CD1 4.32Å; E60-I64 WeakPolarHBondContact O-CB 3.4Å; E60-I64 WeakPolarHBondContact O-CD1 3.44Å; E60-I64 WeakPolarHBondContact O-CG1 3.46Å; E60-I64 PolarHBondContact O-N 3.3Å
61V72.8Confident66Low54 Ų54105.7 Ų105.733%0.32754%0.537SS..Hα-helixtrans-66.9-37.1171173.20000111.4L50 L53 L57 R58 I64 L65L50-V61 HydrophobicContact CD1-CG1 4.03Å; L53-V61 HydrophobicContact CD1-CB 4.5Å; L53-V61 HydrophobicContact CD1-CG1 4.49Å; L53-V61 HydrophobicContact CD1-CG2 4.09Å; L57-V61 VanDerWaalsContact O-CB 3.31Å; L57-V61 WeakPolarHBondContact O-CB 3.4Å; L57-V61 WeakPolarHBondContact O-CG2 3.38Å; L57-V61 PolarHBondContact O-N 3.39Å; R58-V61 PolarHBondContact O-N 3.19Å; V61-I64 PolarHBondContact O-N 3.42Å; V61-L65 WeakPolarHBondContact O-CB 3.28Å; V61-L65 PolarHBondContact O-N 2.91Å
62E74.3Confident65.3Low116 Ų116105.6 Ų105.654%0.54255%0.547SS..Hα-helixtrans-66.2-42.7171.5-84.4179.7163.600111.5R58 I64 L65 Q66R58-E62 VanDerWaalsContact O-CB 3.24Å; R58-E62 WeakPolarHBondContact O-CB 3.4Å; R58-E62 WeakPolarHBondContact O-CG 3.38Å; R58-E62 PolarHBondContact O-N 3.43Å; E62-I64 VanDerWaalsContact C-N 3.34Å; E62-I64 PolarHBondContact O-N 2.94Å; E62-L65 PolarHBondContact O-N 3.44Å; E62-Q66 WeakPolarHBondContact O-CB 3.41Å; E62-Q66 PolarHBondContact O-N 3.33Å
63K76.5Confident64.6Low148 Ų148106.8 Ų106.864%0.64355%0.553SS**Hα-helixtrans-61.4-41.9173.2-78.7169.5-175.9177.90111.8S59 E60 Q66 H67S59-K63 WeakPolarHBondContact O-CB 3.22Å; S59-K63 WeakPolarHBondContact O-CD 3.39Å; S59-K63 WeakPolarHBondContact O-CG 3.37Å; S59-K63 PolarHBondContact O-N 2.96Å; E60-K63 PolarHBondContact O-N 3.25Å; K63-Q66 PolarHBondContact O-N 2.85Å; K63-H67 WeakPolarHBondContact O-CB 3.35Å; K63-H67 PolarHBondContact O-N 3.36Å
64I73.9Confident64.1Low93 Ų93110 Ų11048%0.47758%0.575SS.*Hα-helixtrans-67.7-41.4175.9-68.8163.3000110.3E60 V61 E62 H67 L68E60-I64 HydrophobicContact CG-CD1 4.32Å; E60-I64 WeakPolarHBondContact O-CB 3.4Å; E60-I64 WeakPolarHBondContact O-CD1 3.44Å; E60-I64 WeakPolarHBondContact O-CG1 3.46Å; E60-I64 PolarHBondContact O-N 3.3Å; V61-I64 PolarHBondContact O-N 3.42Å; E62-I64 VanDerWaalsContact C-N 3.34Å; E62-I64 PolarHBondContact O-N 2.94Å; I64-H67 CarbonylContact O-C 3.57Å; I64-H67 PolarHBondContact O-N 3.35Å; I64-L68 HydrophobicContact CG2-CD1 3.72Å; I64-L68 HydrophobicContact CG2-CG 4.24Å; I64-L68 VanDerWaalsContact O-CB 3.28Å; I64-L68 WeakPolarHBondContact O-CB 3.46Å; I64-L68 WeakPolarHBondContact O-CG 3.33Å; I64-L68 PolarHBondContact O-N 3.41Å
65L74Confident62.6Low80 Ų80107.9 Ų107.942%0.41957%0.573SS.*Hα-helixtrans-68-35.6177.3-172.465.2000111.9V61 E62 K69V61-L65 WeakPolarHBondContact O-CB 3.28Å; V61-L65 PolarHBondContact O-N 2.91Å; E62-L65 PolarHBondContact O-N 3.44Å; L65-K69 VanDerWaalsContact O-CB 3.29Å; L65-K69 WeakPolarHBondContact O-CB 3.4Å; L65-K69 WeakPolarHBondContact O-CG 3.38Å; L65-K69 PolarHBondContact O-N 3.25Å
66Q73.7Confident61.9Low140 Ų140105.6 Ų105.665%0.65457%0.569SS**Hα-helixtrans-70.7-39173.7-162.8114.943.400110.7E62 K63 K69 A70E62-Q66 WeakPolarHBondContact O-CB 3.41Å; E62-Q66 PolarHBondContact O-N 3.33Å; K63-Q66 PolarHBondContact O-N 2.85Å; Q66-K69 CarbonylContact O-C 3.58Å; Q66-K69 PolarHBondContact O-N 2.87Å; Q66-A70 WeakPolarHBondContact O-CB 3.43Å; Q66-A70 PolarHBondContact O-N 2.93Å
67H66.5Low61.2Low134 Ų134103.4 Ų103.462%0.6257%0.565SS**Hα-helixtrans-69.4-35.7173.5-170.284.4000112.1K63 I64 A70 S71K63-H67 WeakPolarHBondContact O-CB 3.35Å; K63-H67 PolarHBondContact O-N 3.36Å; I64-H67 CarbonylContact O-C 3.57Å; I64-H67 PolarHBondContact O-N 3.35Å; H67-A70 CarbonylContact O-C 3.52Å; H67-A70 PolarHBondContact O-N 2.83Å; H67-S71 WeakPolarHBondContact O-CB 3.33Å; H67-S71 PolarHBondContact O-N 3.39Å
68L60.9Low60.6Low115 Ų115109 Ų10960%0.60259%0.586SS**Hα-helixtrans-73.7-30.4173.4-71.9169000112I64I64-L68 HydrophobicContact CG2-CD1 3.72Å; I64-L68 HydrophobicContact CG2-CG 4.24Å; I64-L68 VanDerWaalsContact O-CB 3.28Å; I64-L68 WeakPolarHBondContact O-CB 3.46Å; I64-L68 WeakPolarHBondContact O-CG 3.33Å; I64-L68 PolarHBondContact O-N 3.41Å
69K61.8Low59.8Low161 Ų161111.8 Ų111.870%0.761%0.608SS**Hα-helixtrans-72.4-28.7167.3-89.6178.2173.5174.80113.1L65 Q66L65-K69 VanDerWaalsContact O-CB 3.29Å; L65-K69 WeakPolarHBondContact O-CB 3.4Å; L65-K69 WeakPolarHBondContact O-CG 3.38Å; L65-K69 PolarHBondContact O-N 3.25Å; Q66-K69 CarbonylContact O-C 3.58Å; Q66-K69 PolarHBondContact O-N 2.87Å
70A59.6Low58.5Low83 Ų83116.1 Ų116.169%0.68663%0.627SS**Hα-helixtrans-92.8-11.4177.800000113.3Q66 H67Q66-A70 WeakPolarHBondContact O-CB 3.43Å; Q66-A70 PolarHBondContact O-N 2.93Å; H67-A70 CarbonylContact O-C 3.52Å; H67-A70 PolarHBondContact O-N 2.83Å
71S47Very low57.8Low56 Ų56115.4 Ų115.439%0.39263%0.632SS.*SBendtrans-69.4141168.1-138.90000108.1H67 Q73H67-S71 WeakPolarHBondContact O-CB 3.33Å; H67-S71 PolarHBondContact O-N 3.39Å; S71-Q73 PolarHBondContact O-N 3.26Å
72P50Low57.3Low121 Ų121122.2 Ų122.279%0.78666%0.657SS**  trans-51.7111.8-164.517.6-29.6000110.5T74P72-T74 PolarHBondContact O-N 2.95Å
73Q46.4Very low56.8Low177 Ų177124.2 Ų124.283%0.82767%0.666SS**  trans-42.9108.9172.4-132-177.917.400107.3S71 P75S71-Q73 PolarHBondContact O-N 3.26Å; Q73-P75 VanDerWaalsContact O-CD 3.22Å; Q73-P75 WeakPolarHBondContact O-CD 3.48Å
74T45.6Very low56.6Low124 Ų124122.1 Ų122.176%0.76167%0.665SS**  trans-49.8119.615836.60000105.3P72 G76P72-T74 PolarHBondContact O-N 2.95Å; T74-G76 PolarHBondContact O-N 3Å
75P37.3Very low56.9Low91 Ų91121.5 Ų121.559%0.59167%0.666SS**  trans-62.993178.5-1628.5000106.6Q73 S77Q73-P75 VanDerWaalsContact O-CD 3.22Å; Q73-P75 WeakPolarHBondContact O-CD 3.48Å; P75-S77 PolarHBondContact O-N 3.41Å
76G48.3Very low57.3Low61 Ų61123.5 Ų123.563%0.62967%0.673SS**  trans-67.283.9170.400000105.7T74 F78T74-G76 PolarHBondContact O-N 3Å; G76-F78 PolarHBondContact O-N 3.47Å
77S45.6Very low57.7Low78 Ų78122.7 Ų122.755%0.54567%0.669SS.*  trans-44.682.3174.6-175.50000110.7P75 L79P75-S77 PolarHBondContact O-N 3.41Å; S77-L79 PolarHBondContact O-N 3.42Å; S77-L79 VanDerWaalsContact O-N 3.13Å
78F47.6Very low58.4Low197 Ų197120 Ų12086%0.86466%0.657SS**SBendtrans-71.191.7151.1-95.2-96.5000105.3G76G76-F78 PolarHBondContact O-N 3.47Å
79L48.6Very low59.6Low156 Ų156119.7 Ų119.782%0.81765%0.652SS**SBendtrans72.973.9161.9-52.4159.6000115.9S77S77-L79 PolarHBondContact O-N 3.42Å; S77-L79 VanDerWaalsContact O-N 3.13Å
80N45.5Very low60.7Low143 Ų143119.7 Ų119.777%0.76565%0.648SS**  trans45.882.3157.9-95.4-5.5000115.8K82N80-K82 PolarHBondContact O-N 3.38Å; N80-K82 VanDerWaalsContact O-N 3.11Å
81P57.9Low62Low95 Ų95122.2 Ų122.262%0.61764%0.644SS**  trans-67.7113.2165.228-29.4000108.6H83P81-H83 PolarHBondContact O-N 2.98Å
82K62.5Low63.9Low197 Ų197121.9 Ų121.986%0.85765%0.645SS**SBendtrans-71.3-5.7176.1-74.1-175174.5-176.70113.5N80N80-K82 PolarHBondContact O-N 3.38Å; N80-K82 VanDerWaalsContact O-N 3.11Å
83H64.7Low65.7Low159 Ų159120.4 Ų120.474%0.73663%0.63SS**SBendtrans-129.1125.3-177.9-61.8-72.8000110P81P81-H83 PolarHBondContact O-N 2.98Å
84V71Confident67.6Low104 Ų104115.8 Ų115.863%0.6361%0.614SS**  trans-76.6126.9169.7172.60000107.4Q88 E89V84-Q88 HydrophobicContact CG1-CB 3.94Å; V84-E89 HydrophobicContact CG1-CB 4.11Å
85T80.6Confident69.6Low80 Ų80116.3 Ų116.349%0.49161%0.606SS.*  trans-68.3142175.1-51.50000109.6E87 Q88 E89T85-E87 HydrophobicContact CG2-CB 4.29Å; T85-E87 PolarHBondContact O-N 3Å; T85-E87 VanDerWaalsContact O-N 3.08Å; T85-Q88 VanDerWaalsContact N-OE1 3.17Å; T85-Q88 WeakPolarHBondContact O-CA 3.41Å; T85-Q88 WeakPolarHBondContact O-CB 3.48Å; T85-Q88 PolarHBondContact O-N 2.89Å; T85-E89 PolarHBondContact O-N 3.49Å
86E82.2Confident72.1Confident121 Ų121115.5 Ų115.557%0.56560%0.599SS**Hα-helixtrans-51.2-36.5178.3-172.1-171.6160.600112.5E89 R90E86-E89 PolarHBondContact O-N 3.41Å; E86-R90 WeakPolarHBondContact O-CG 3.32Å; E86-R90 PolarHBondContact O-N 3.36Å; E86-R90 IonicContact OE1-CZ 3.4Å; E86-R90 IonicContact OE1-NE 3.23Å; E86-R90 PolarHBondContact OE1-NE 3.28Å; E86-R90 IonicContact OE1-NH2 2.73Å; E86-R90 PolarHBondContact OE1-NH2 2.88Å
87E82.9Confident74Confident123 Ų123118 Ų11858%0.57560%0.595SS**Hα-helixtrans-63.7-41.7174.3-178.7175.2-161.200112.7T85 E89 R90 F91T85-E87 HydrophobicContact CG2-CB 4.29Å; T85-E87 PolarHBondContact O-N 3Å; T85-E87 VanDerWaalsContact O-N 3.08Å; E87-E89 VanDerWaalsContact C-N 3.33Å; E87-E89 PolarHBondContact O-N 3.37Å; E87-R90 PolarHBondContact O-N 3.3Å; E87-F91 HydrophobicContact CG-CD2 3.72Å; E87-F91 HydrophobicContact CG-CE2 3.38Å; E87-F91 HydrophobicContact CG-CZ 4.47Å; E87-F91 WeakPolarHBondContact O-CD2 3.37Å; E87-F91 PolarHBondContact O-N 3.15Å; E87-F91 WeakPolarHBondContact OE1-CE2 3.28Å
88Q81Confident75.8Confident77 Ų77119.4 Ų119.436%0.3659%0.591SS.*Hα-helixtrans-65.5-37.5175.4-66.5173.9-23.200111.5V84 T85 F91 A92V84-Q88 HydrophobicContact CG1-CB 3.94Å; T85-Q88 VanDerWaalsContact N-OE1 3.17Å; T85-Q88 WeakPolarHBondContact O-CA 3.41Å; T85-Q88 WeakPolarHBondContact O-CB 3.48Å; T85-Q88 PolarHBondContact O-N 2.89Å; Q88-F91 PolarHBondContact O-N 3.44Å; Q88-A92 WeakPolarHBondContact O-CB 3.42Å; Q88-A92 PolarHBondContact O-N 2.92Å
89E84.7Confident77.5Confident109 Ų109114.3 Ų114.351%0.50957%0.572SS.*Hα-helixtrans-64.8-44.8173.6-172.9177.7-176.600111.1V84 T85 E86 E87 F91 A92 N93V84-E89 HydrophobicContact CG1-CB 4.11Å; T85-E89 PolarHBondContact O-N 3.49Å; E86-E89 PolarHBondContact O-N 3.41Å; E87-E89 VanDerWaalsContact C-N 3.33Å; E87-E89 PolarHBondContact O-N 3.37Å; E89-F91 PolarHBondContact O-N 2.94Å; E89-A92 PolarHBondContact O-N 3.3Å; E89-N93 VanDerWaalsContact O-CB 3.3Å; E89-N93 WeakPolarHBondContact O-CB 3.42Å; E89-N93 PolarHBondContact O-N 3.1Å; E89-N93 PolarHBondContact O-ND2 2.86Å
90R85.4Confident79.2Confident161 Ų161110.4 Ų110.461%0.60855%0.552SS**Hα-helixtrans-59.3-44.9174.4-73.1178.5-174.3-134.35.7111.9E86 E87 N93 V94E86-R90 WeakPolarHBondContact O-CG 3.32Å; E86-R90 PolarHBondContact O-N 3.36Å; E86-R90 IonicContact OE1-CZ 3.4Å; E86-R90 IonicContact OE1-NE 3.23Å; E86-R90 PolarHBondContact OE1-NE 3.28Å; E86-R90 IonicContact OE1-NH2 2.73Å; E86-R90 PolarHBondContact OE1-NH2 2.88Å; E87-R90 PolarHBondContact O-N 3.3Å; R90-N93 PolarHBondContact O-N 2.91Å; R90-V94 WeakPolarHBondContact O-CG2 3.32Å; R90-V94 PolarHBondContact O-N 3.33Å
91F88Confident80.9Confident137 Ų137107.5 Ų107.560%0.60153%0.534SS*.Hα-helixtrans-64.4-42.3176.2-77.3-61.5000112.8E87 Q88 E89 N93 V94 F95E87-F91 HydrophobicContact CG-CD2 3.72Å; E87-F91 HydrophobicContact CG-CE2 3.38Å; E87-F91 HydrophobicContact CG-CZ 4.47Å; E87-F91 WeakPolarHBondContact O-CD2 3.37Å; E87-F91 PolarHBondContact O-N 3.15Å; E87-F91 WeakPolarHBondContact OE1-CE2 3.28Å; Q88-F91 PolarHBondContact O-N 3.44Å; E89-F91 PolarHBondContact O-N 2.94Å; F91-N93 VanDerWaalsContact C-N 3.32Å; F91-N93 PolarHBondContact O-N 3.36Å; F91-V94 PolarHBondContact O-N 3.45Å; F91-F95 PolarHBondContact O-N 3.28Å; F91-F95 VanDerWaalsContact O-N 3.12Å
92A86.8Confident81.8Confident49 Ų49108.3 Ų108.341%0.40553%0.532SS..Hα-helixtrans-64.6-36.7175.800000112.2Q88 E89 F95 T96Q88-A92 WeakPolarHBondContact O-CB 3.42Å; Q88-A92 PolarHBondContact O-N 2.92Å; E89-A92 PolarHBondContact O-N 3.3Å; A92-F95 PolarHBondContact O-N 3.03Å; A92-T96 WeakPolarHBondContact O-CB 3.48Å; A92-T96 PolarHBondContact O-N 2.87Å; A92-T96 PolarHBondContact O-OG1 3.41Å
93N87.5Confident82.4Confident89 Ų89106.7 Ų106.748%0.47652%0.521SS..Hα-helixtrans-67-42.1176.7-73.9-22.3000111.8E89 R90 F91 F95 T96 Q97E89-N93 VanDerWaalsContact O-CB 3.3Å; E89-N93 WeakPolarHBondContact O-CB 3.42Å; E89-N93 PolarHBondContact O-N 3.1Å; E89-N93 PolarHBondContact O-ND2 2.86Å; R90-N93 PolarHBondContact O-N 2.91Å; F91-N93 VanDerWaalsContact C-N 3.32Å; F91-N93 PolarHBondContact O-N 3.36Å; N93-F95 VanDerWaalsContact C-N 3.33Å; N93-F95 PolarHBondContact O-N 2.93Å; N93-T96 PolarHBondContact O-N 3.45Å; N93-Q97 VanDerWaalsContact O-CB 3.27Å; N93-Q97 WeakPolarHBondContact O-CB 3.43Å; N93-Q97 PolarHBondContact O-N 3.27Å
94V86Confident82.7Confident80 Ų80104.6 Ų104.649%0.48552%0.515SS..Hα-helixtrans-61.6-42.5174.3173.30000111R90 F91 Q97 K98R90-V94 WeakPolarHBondContact O-CG2 3.32Å; R90-V94 PolarHBondContact O-N 3.33Å; F91-V94 PolarHBondContact O-N 3.45Å; V94-Q97 PolarHBondContact O-N 3.04Å; V94-K98 WeakPolarHBondContact O-CG 3.42Å; V94-K98 PolarHBondContact O-N 2.82Å
95F88.2Confident82.5Confident136 Ų136103.8 Ų103.860%0.59652%0.519SS*.Hα-helixtrans-63.8-44.8176.3-177.1-101.9000112.2F91 A92 N93 K98 L99F91-F95 PolarHBondContact O-N 3.28Å; F91-F95 VanDerWaalsContact O-N 3.12Å; A92-F95 PolarHBondContact O-N 3.03Å; N93-F95 VanDerWaalsContact C-N 3.33Å; N93-F95 PolarHBondContact O-N 2.93Å; F95-K98 PolarHBondContact O-N 3.46Å; F95-L99 HydrophobicContact CD1-CD1 4.04Å; F95-L99 HydrophobicContact CE1-CD1 3.49Å; F95-L99 VanDerWaalsContact CE1-CD1 3.49Å; F95-L99 HydrophobicContact CE1-CG 4.16Å; F95-L99 HydrophobicContact CZ-CD1 4Å; F95-L99 HydrophobicContact CZ-CG 4.34Å; F95-L99 PolarHBondContact O-N 3.19Å
96T88.9Confident80.9Confident73 Ų73101.6 Ų101.645%0.44851%0.507SS..Hα-helixtrans-65.8-39178.7-53.30000111.6A92 N93 L99 N100A92-T96 WeakPolarHBondContact O-CB 3.48Å; A92-T96 PolarHBondContact O-N 2.87Å; A92-T96 PolarHBondContact O-OG1 3.41Å; N93-T96 PolarHBondContact O-N 3.45Å; T96-L99 PolarHBondContact O-N 3.39Å; T96-N100 PolarHBondContact O-N 2.91Å
97Q87.6Confident79.4Confident115 Ų11599.4 Ų99.454%0.53751%0.505SS..Hα-helixtrans-60.6-45.4173.7-175.2177.827.100111.1N93 V94 L99 N100 E101N93-Q97 VanDerWaalsContact O-CB 3.27Å; N93-Q97 WeakPolarHBondContact O-CB 3.43Å; N93-Q97 PolarHBondContact O-N 3.27Å; V94-Q97 PolarHBondContact O-N 3.04Å; Q97-L99 VanDerWaalsContact C-N 3.33Å; Q97-L99 PolarHBondContact O-N 2.87Å; Q97-N100 PolarHBondContact O-N 3.1Å; Q97-E101 WeakPolarHBondContact O-CG 3.38Å; Q97-E101 PolarHBondContact O-N 3.31Å
98K85.2Confident77.7Confident107 Ų107100 Ų10047%0.46551%0.506SS..Hα-helixtrans-63.9-35.8176.8-70.8-72.3163.7-153.20112.9V94 F95 E101 L102V94-K98 WeakPolarHBondContact O-CG 3.42Å; V94-K98 PolarHBondContact O-N 2.82Å; F95-K98 PolarHBondContact O-N 3.46Å; K98-E101 WeakPolarHBondContact CD-OE2 3.34Å; K98-E101 IonicContact NZ-OE1 3.43Å; K98-E101 PolarHBondContact NZ-OE1 3.35Å; K98-E101 IonicContact NZ-OE2 2.71Å; K98-E101 PolarHBondContact NZ-OE2 2.93Å; K98-L102 WeakPolarHBondContact O-CB 3.49Å; K98-L102 PolarHBondContact O-N 3.14Å
99L83.4Confident76.2Confident90 Ų9099.7 Ų99.747%0.47152%0.517SS..Hα-helixtrans-67.9-37.5173.4-74.1-179.2000112.6F95 T96 Q97 L102 R103F95-L99 HydrophobicContact CD1-CD1 4.04Å; F95-L99 HydrophobicContact CE1-CD1 3.49Å; F95-L99 VanDerWaalsContact CE1-CD1 3.49Å; F95-L99 HydrophobicContact CE1-CG 4.16Å; F95-L99 HydrophobicContact CZ-CD1 4Å; F95-L99 HydrophobicContact CZ-CG 4.34Å; F95-L99 PolarHBondContact O-N 3.19Å; T96-L99 PolarHBondContact O-N 3.39Å; Q97-L99 VanDerWaalsContact C-N 3.33Å; Q97-L99 PolarHBondContact O-N 2.87Å; L99-L102 PolarHBondContact O-N 3.29Å; L99-R103 WeakPolarHBondContact O-CB 3.5Å; L99-R103 PolarHBondContact O-N 3.42Å
100N82.8Confident74.5Confident73 Ų7398.4 Ų98.439%0.3952%0.52SS..Hα-helixtrans-69-42.4173.2-91.13000111.7T96 Q97 L102 R103 D104T96-N100 PolarHBondContact O-N 2.91Å; Q97-N100 PolarHBondContact O-N 3.1Å; N100-L102 VanDerWaalsContact C-N 3.27Å; N100-L102 PolarHBondContact O-N 2.83Å; N100-R103 PolarHBondContact O-N 3.2Å; N100-R103 VanDerWaalsContact O-N 3.1Å; N100-D104 WeakPolarHBondContact O-CB 3.36Å; N100-D104 PolarHBondContact O-N 2.89Å
101E81.9Confident72.5Confident83 Ų8396.2 Ų96.239%0.38852%0.519SS..Hα-helixtrans-56.8-42.9172-73.8173.7-158.300111.1Q97 K98 D104 A105Q97-E101 WeakPolarHBondContact O-CG 3.38Å; Q97-E101 PolarHBondContact O-N 3.31Å; K98-E101 WeakPolarHBondContact CD-OE2 3.34Å; K98-E101 IonicContact NZ-OE1 3.43Å; K98-E101 PolarHBondContact NZ-OE1 3.35Å; K98-E101 IonicContact NZ-OE2 2.71Å; K98-E101 PolarHBondContact NZ-OE2 2.93Å; E101-D104 PolarHBondContact O-N 3.24Å; E101-A105 WeakPolarHBondContact O-CB 3.39Å; E101-A105 PolarHBondContact O-N 2.93Å
102L77.1Confident70.5Confident111 Ų11194 Ų9458%0.58152%0.517SS*.Hα-helixtrans-65.8-42.6174.2-106.3137.5000111.5K98 L99 N100 D104 A105 S106K98-L102 WeakPolarHBondContact O-CB 3.49Å; K98-L102 PolarHBondContact O-N 3.14Å; L99-L102 PolarHBondContact O-N 3.29Å; N100-L102 VanDerWaalsContact C-N 3.27Å; N100-L102 PolarHBondContact O-N 2.83Å; L102-D104 VanDerWaalsContact C-N 3.31Å; L102-D104 PolarHBondContact O-N 2.99Å; L102-A105 PolarHBondContact O-N 2.98Å; L102-S106 VanDerWaalsContact O-CA 3.28Å; L102-S106 WeakPolarHBondContact O-CA 3.44Å; L102-S106 WeakPolarHBondContact O-CB 3.26Å; L102-S106 PolarHBondContact O-N 3.49Å; L102-S106 PolarHBondContact O-OG 2.85Å
103R74.7Confident68.7Low163 Ų16395.1 Ų95.162%0.61553%0.526SS*.Hα-helixtrans-64.2-37177.8-169-17369.3165.60.7112.2L99 N100 S106L99-R103 WeakPolarHBondContact O-CB 3.5Å; L99-R103 PolarHBondContact O-N 3.42Å; N100-R103 PolarHBondContact O-N 3.2Å; N100-R103 VanDerWaalsContact O-N 3.1Å; R103-S106 CarbonylContact O-C 3.6Å
104D71.6Confident66.7Low116 Ų11694.8 Ų94.862%0.6254%0.536SS*.Hα-helixtrans-80.4-33.4-179.5-61.1-17.6000111.2N100 E101 L102N100-D104 WeakPolarHBondContact O-CB 3.36Å; N100-D104 PolarHBondContact O-N 2.89Å; E101-D104 PolarHBondContact O-N 3.24Å; L102-D104 VanDerWaalsContact C-N 3.31Å; L102-D104 PolarHBondContact O-N 2.99Å
105A65.2Low64.6Low86 Ų8698.3 Ų98.371%0.71155%0.551SS**Hα-helixtrans-79.1-27.3172.200000112.9E101 L102 S107E101-A105 WeakPolarHBondContact O-CB 3.39Å; E101-A105 PolarHBondContact O-N 2.93Å; L102-A105 PolarHBondContact O-N 2.98Å; A105-S107 PolarHBondContact O-N 2.97Å
106S48.6Very low62.2Low34 Ų3495.6 Ų95.624%0.23855%0.549CS..  trans-100.679.2176.283.60000108.7L102 R103 F108L102-S106 VanDerWaalsContact O-CA 3.28Å; L102-S106 WeakPolarHBondContact O-CA 3.44Å; L102-S106 WeakPolarHBondContact O-CB 3.26Å; L102-S106 PolarHBondContact O-N 3.49Å; L102-S106 PolarHBondContact O-OG 2.85Å; R103-S106 CarbonylContact O-C 3.6Å; S106-F108 PolarHBondContact O-N 3.26Å; S106-F108 WeakPolarHBondContact OG-CD2 3.25Å
107S50.4Low60Low75 Ų7597.9 Ų97.952%0.52457%0.565SS.*  trans-49.390.5137.545.80000108A105 A109 S110A105-S107 PolarHBondContact O-N 2.97Å; S107-A109 PolarHBondContact O-N 2.91Å; S107-S110 PolarHBondContact O-N 2.97Å
108F47.5Very low57.8Low137 Ų13799.2 Ų99.260%0.60158%0.581SS**THydrogen-bonded Turntrans-57.9-4.8174.7-116.2-87.8000112.6S106 S110 T112S106-F108 PolarHBondContact O-N 3.26Å; S106-F108 WeakPolarHBondContact OG-CD2 3.25Å; F108-S110 PolarHBondContact O-N 3.45Å; F108-T112 WeakPolarHBondContact O-CB 3.39Å; F108-T112 PolarHBondContact O-N 3.2Å; F108-T112 PolarHBondContact O-OG1 3.41Å
109A48.4Very low55.5Low70 Ų7099.7 Ų99.758%0.57959%0.593SS**Hα-helixtrans-54.4-33.7162.600000112.8S107 A113S107-A109 PolarHBondContact O-N 2.91Å; A109-A113 WeakPolarHBondContact O-CB 3.35Å; A109-A113 PolarHBondContact O-N 3.3Å
110S49.6Very low53.1Low82 Ų82101 Ų10157%0.57361%0.609SS**Hα-helixtrans-81.2-26.1-173.9-56.80000114.7S107 F108S107-S110 PolarHBondContact O-N 2.97Å; F108-S110 PolarHBondContact O-N 3.45Å
111L44.2Very low51.1Low114 Ų114101.8 Ų101.860%0.59763%0.626SS**Hα-helixtrans-87.9-28173.2-71.1172.4000112.3L115L111-L115 WeakPolarHBondContact O-CD1 3.18Å; L111-L115 WeakPolarHBondContact O-CG 3.41Å
112T46.1Very low48.9Very low92 Ų92104.3 Ų104.356%0.56465%0.647SS**Hα-helixtrans-80.1-32.3176.9-48.80000111.8F108 L115 S116F108-T112 WeakPolarHBondContact O-CB 3.39Å; F108-T112 PolarHBondContact O-N 3.2Å; F108-T112 PolarHBondContact O-OG1 3.41Å; T112-L115 PolarHBondContact O-N 3.03Å; T112-S116 PolarHBondContact O-N 3.49Å
113A47.9Very low47Very low72 Ų72106.4 Ų106.460%0.59566%0.659SS**Hα-helixtrans-70.9-28.4171.700000113A109 L115A109-A113 WeakPolarHBondContact O-CB 3.35Å; A109-A113 PolarHBondContact O-N 3.3Å; A113-L115 PolarHBondContact O-N 2.96Å
114A46.3Very low44.9Very low81 Ų81105 Ų10567%0.66966%0.663SS**THydrogen-bonded Turntrans-73.8-10.1174.600000113.8
115L40.6Very low43.2Very low155 Ų155104.7 Ų104.781%0.81267%0.67SS**THydrogen-bonded Turntrans-117.39.1-177-67.9170.2000113.1L111 T112 A113L111-L115 WeakPolarHBondContact O-CD1 3.18Å; L111-L115 WeakPolarHBondContact O-CG 3.41Å; T112-L115 PolarHBondContact O-N 3.03Å; A113-L115 PolarHBondContact O-N 2.96Å
116S39.3Very low41.9Very low79 Ų79103.4 Ų103.455%0.55267%0.665SS**SBendtrans-111.9130.4176.9-164.40000110.4T112 V118T112-S116 PolarHBondContact O-N 3.49Å; S116-V118 PolarHBondContact O-N 2.94Å
117P40.9Very low41.3Very low121 Ų121110 Ų11079%0.78670%0.697SS**  trans-76.388.4-176.230.9-32.3000109.9T119P117-T119 PolarHBondContact O-N 2.91Å
118V43.3Very low40.5Very low142 Ų142115.5 Ų115.586%0.86171%0.708SS**  trans-82.8104.1171.489.50000109.2S116S116-V118 PolarHBondContact O-N 2.94Å
119T35.5Very low40Very low118 Ų118115.8 Ų115.872%0.72472%0.715SS**  trans-77.2141.1169.71.50000108.5P117P117-T119 PolarHBondContact O-N 2.91Å
120S33.9Very low39.8Very low116 Ų116120 Ų12081%0.81173%0.727SS**  trans84.8105.5160.9-28.30000117.3
121A39.9Very low39.2Very low90 Ų90123.2 Ų123.274%0.74474%0.737SS**  172.6106.1127.800000112.4
122V35.8Very low39Very low137 Ų137124.3 Ų124.383%0.8374%0.743SS**  trans37.1113.6132.1-123.80000118.4
123N37.3Very low38.9Very low155 Ų155123.9 Ų123.983%0.82975%0.748SS**  168.4133.888.9-157.33.2000110.3
124N31.3Very low38.2Very low133 Ų133127.5 Ų127.571%0.71176%0.758SS**  trans-84.5131.2-177-148.37.4000108.1
125S35Very low38Very low110 Ų110129.9 Ų129.977%0.76975%0.753SS**  trans150.5106.9155.3-70.60000109.8
126G38.2Very low38Very low58 Ų58129.4 Ų129.460%0.59875%0.752SS**SBendtrans169.8-25.716200000119.9
127L34.9Very low38.1Very low173 Ų173130.5 Ų130.591%0.90676%0.759SS**  trans-134.173-164.3-61.2175.2000113.2
128Y35.3Very low38.4Very low191 Ų191134.6 Ų134.675%0.74977%0.768SS**  trans-114.589.3161.1-12.6-91000108
129N35.4Very low38.5Very low143 Ų143134.6 Ų134.677%0.76576%0.763SS**  trans-172.288148.1-148.65000111
130I44.4Very low39.3Very low159 Ų159135.2 Ų135.282%0.81576%0.762SS**  trans-127.9114.2152.5-63.1-162.7000107.5L132I130-L132 PolarHBondContact O-N 3.47Å
131N38.1Very low40.6Very low149 Ų149132.7 Ų132.780%0.79774%0.742SS**  trans-60.7117.1175-114.7-39.2000109.5A133N131-A133 PolarHBondContact O-N 2.93Å
132L39.3Very low41.8Very low137 Ų137133.9 Ų133.972%0.71774%0.736SS**  trans-91.777.1-179.7-145.476000108.7I130 F135I130-L132 PolarHBondContact O-N 3.47Å; L132-F135 HydrophobicContact CD1-CE2 3.98Å; L132-F135 HydrophobicContact CG-CD2 4.22Å; L132-F135 HydrophobicContact CG-CE2 3.99Å
133A44.2Very low43.4Very low82 Ų82133.4 Ų133.468%0.67872%0.723SS**  trans-80125.1173.600000110.7N131N131-A133 PolarHBondContact O-N 2.93Å
134D33.2Very low45Very low149 Ų149128.8 Ų128.880%0.79771%0.706SS**  trans44.580.7159.1-74.3-33000119.6N136D134-N136 PolarHBondContact O-N 3.48Å
135F42.8Very low46.8Very low130 Ų130126 Ų12657%0.5769%0.689SS**  trans-86.947.6159.3-78.9-81.3000112.4L132L132-F135 HydrophobicContact CD1-CE2 3.98Å; L132-F135 HydrophobicContact CG-CD2 4.22Å; L132-F135 HydrophobicContact CG-CE2 3.99Å
136N39.3Very low48.5Very low145 Ų145125.1 Ų125.178%0.77568%0.675SS**  trans-120.361.3177.3-152.224.4000110.6D134D134-N136 PolarHBondContact O-N 3.48Å
137S41.9Very low49.9Very low102 Ų102125.3 Ų125.371%0.71367%0.667SS**SBendtrans-159.6132.9166.4-800000109.7N139S137-N139 PolarHBondContact O-N 3.28Å
138Q47.5Very low51.8Low207 Ų207123.5 Ų123.597%0.96765%0.648SS**SBendtrans-68.337.2-176.5-66.2-178.6-20.600114.2
139N46.2Very low53.5Low143 Ų143119.8 Ų119.877%0.76564%0.637SS**  trans-141.169.3-175-126.5-49000109.9S137 P141S137-N139 PolarHBondContact O-N 3.28Å; N139-P141 WeakPolarHBondContact O-CD 3.44Å
140L51.1Low54.6Low131 Ų131116.4 Ų116.469%0.68663%0.629SS**PPolyproline II helixtrans-71.4122.8161.2-98.879.7000106.9N142L140-N142 PolarHBondContact O-N 3.08Å; L140-N142 VanDerWaalsContact O-N 3.12Å
141P60.7Low55.5Low63 Ų63113.2 Ų113.241%0.40962%0.621SS.*PPolyproline II helixtrans-57.2125.1172.622.7-30.1000108N139 F143 E145 L146N139-P141 WeakPolarHBondContact O-CD 3.44Å; P141-F143 PolarHBondContact O-N 3.26Å; P141-E145 HydrophobicContact CB-CB 4.21Å; P141-L146 HydrophobicContact CB-CD1 4.4Å; P141-L146 HydrophobicContact CB-CG 4.35Å; P141-L146 HydrophobicContact CG-CD1 3.93Å; P141-L146 HydrophobicContact CG-CG 4.14Å
142N65.3Low56.5Low115 Ų115112.4 Ų112.462%0.61561%0.613SS**PPolyproline II helixtrans-48.2140167.2177.1-8.1000107.7L140 A144 E145 L146L140-N142 PolarHBondContact O-N 3.08Å; L140-N142 VanDerWaalsContact O-N 3.12Å; N142-A144 PolarHBondContact O-N 2.88Å; N142-A144 PolarHBondContact OD1-N 3.35Å; N142-E145 WeakPolarHBondContact O-CA 3.35Å; N142-E145 WeakPolarHBondContact O-CB 3.33Å; N142-E145 PolarHBondContact O-N 3.47Å; N142-L146 PolarHBondContact O-N 3.42Å
143F70.2Confident56.9Low127 Ų127109 Ų10956%0.55760%0.6SS**Hα-helixtrans-47-34.8173.7179.6-103.3000112.2P141 E145 L146 C147P141-F143 PolarHBondContact O-N 3.26Å; F143-E145 VanDerWaalsContact C-N 3.34Å; F143-E145 PolarHBondContact O-N 2.86Å; F143-L146 PolarHBondContact O-N 3.08Å; F143-C147 PolarHBondContact O-N 3.31Å; F143-C147 PolarHBondContact O-SG 3.16Å; F143-C147 VanDerWaalsContact O-SG 3.42Å
144A70.1Confident56.6Low57 Ų57109 Ų10947%0.47161%0.609SS.*Hα-helixtrans-59.2-38.6172.500000113.8N142 R148N142-A144 PolarHBondContact O-N 2.88Å; N142-A144 PolarHBondContact OD1-N 3.35Å; A144-R148 WeakPolarHBondContact O-CB 3.48Å; A144-R148 PolarHBondContact O-N 3.45Å
145E69.3Low57Low74 Ų74107.9 Ų107.935%0.34660%0.601SS.*Hα-helixtrans-73.8-37.6178.6-161.760.2-141.800111.7P141 N142 F143 R148 Q149P141-E145 HydrophobicContact CB-CB 4.21Å; N142-E145 WeakPolarHBondContact O-CA 3.35Å; N142-E145 WeakPolarHBondContact O-CB 3.33Å; N142-E145 PolarHBondContact O-N 3.47Å; F143-E145 VanDerWaalsContact C-N 3.34Å; F143-E145 PolarHBondContact O-N 2.86Å; E145-R148 PolarHBondContact O-N 3.3Å; E145-R148 IonicContact OE1-NE 3.55Å; E145-R148 IonicContact OE1-NH2 3.98Å; E145-Q149 WeakPolarHBondContact O-CG 3.47Å; E145-Q149 PolarHBondContact O-N 2.9Å
146L71.4Confident56.7Low92 Ų92109.8 Ų109.848%0.48262%0.617SS.*Hα-helixtrans-61.5-44.4172.1-93.8152.1000111.8P141 N142 F143 R148 Q149 A150P141-L146 HydrophobicContact CB-CD1 4.4Å; P141-L146 HydrophobicContact CB-CG 4.35Å; P141-L146 HydrophobicContact CG-CD1 3.93Å; P141-L146 HydrophobicContact CG-CG 4.14Å; N142-L146 PolarHBondContact O-N 3.42Å; F143-L146 PolarHBondContact O-N 3.08Å; L146-R148 VanDerWaalsContact C-N 3.31Å; L146-R148 PolarHBondContact O-N 3.1Å; L146-Q149 PolarHBondContact O-N 3.19Å; L146-A150 WeakPolarHBondContact O-CB 3.43Å; L146-A150 PolarHBondContact O-N 3.5Å
147C67.7Low56.7Low62 Ų62108.3 Ų108.342%0.41961%0.614SS.*Hα-helixtrans-64.4-34.6174-70.40000112.5F143 S151F143-C147 PolarHBondContact O-N 3.31Å; F143-C147 PolarHBondContact O-SG 3.16Å; F143-C147 VanDerWaalsContact O-SG 3.42Å; C147-S151 PolarHBondContact O-N 2.79Å; C147-S151 PolarHBondContact O-OG 3.41Å
148R74.5Confident56.7Low136 Ų136109.6 Ų109.651%0.51362%0.617SS.*Hα-helixtrans-70.3-38.1176.7-141.9-175.777.9137.58.8112.2A144 E145 L146 S151 Q152A144-R148 WeakPolarHBondContact O-CB 3.48Å; A144-R148 PolarHBondContact O-N 3.45Å; E145-R148 PolarHBondContact O-N 3.3Å; E145-R148 IonicContact OE1-NE 3.55Å; E145-R148 IonicContact OE1-NH2 3.98Å; L146-R148 VanDerWaalsContact C-N 3.31Å; L146-R148 PolarHBondContact O-N 3.1Å; R148-S151 WeakPolarHBondContact CA-OG 3.37Å; R148-S151 PolarHBondContact O-N 3.47Å; R148-S151 PolarHBondContact O-OG 3.18Å; R148-Q152 WeakPolarHBondContact O-CG 3.3Å; R148-Q152 PolarHBondContact O-N 2.96Å
149Q70.6Confident56.3Low113 Ų113105.7 Ų105.753%0.52861%0.61SS.*Hα-helixtrans-68.3-42.2176-74.6177.14.700111.5E145 L146 S151 Q152 S153E145-Q149 WeakPolarHBondContact O-CG 3.47Å; E145-Q149 PolarHBondContact O-N 2.9Å; L146-Q149 PolarHBondContact O-N 3.19Å; Q149-S151 PolarHBondContact O-N 3.12Å; Q149-Q152 PolarHBondContact O-N 3.39Å; Q149-S153 PolarHBondContact O-N 2.93Å
150A59.9Low55.8Low72 Ų72103.2 Ų103.260%0.59561%0.609SS**Hα-helixtrans-64-25.4176.500000113.7L146L146-A150 WeakPolarHBondContact O-CB 3.43Å; L146-A150 PolarHBondContact O-N 3.5Å
151S62.3Low55Low92 Ų92102.4 Ų102.464%0.64362%0.615SS**Hα-helixtrans-88.3-13.3178.5410000114.3C147 R148 Q149C147-S151 PolarHBondContact O-N 2.79Å; C147-S151 PolarHBondContact O-OG 3.41Å; R148-S151 WeakPolarHBondContact CA-OG 3.37Å; R148-S151 PolarHBondContact O-N 3.47Å; R148-S151 PolarHBondContact O-OG 3.18Å; Q149-S151 PolarHBondContact O-N 3.12Å
152Q59.4Low53.8Low132 Ų132105.1 Ų105.162%0.61763%0.625SS**Hα-helixtrans-98.7-18.8-179.6-69.9179.127.700113.8R148 Q149 G154R148-Q152 WeakPolarHBondContact O-CG 3.3Å; R148-Q152 PolarHBondContact O-N 2.96Å; Q149-Q152 PolarHBondContact O-N 3.39Å; Q152-G154 PolarHBondContact O-N 3.35Å
153S48.1Very low52.4Low65 Ų65107.8 Ų107.846%0.45564%0.638SS.*  trans-85.394.6171.5570000110.5Q149 I155Q149-S153 PolarHBondContact O-N 2.93Å; S153-I155 PolarHBondContact O-N 3.42Å
154G37.3Very low50.7Low83 Ų83109.8 Ų109.886%0.85665%0.647SS**  trans-68.166.6171.600000112.9Q152Q152-G154 PolarHBondContact O-N 3.35Å
155I42.4Very low48.8Very low124 Ų124118.1 Ų118.164%0.63667%0.667SS**  trans-120.8113177.2-45.5178.3000108.3S153 T157S153-I155 PolarHBondContact O-N 3.42Å; I155-T157 VanDerWaalsContact C-N 3.29Å; I155-T157 HydrophobicContact CG2-CG2 4.28Å; I155-T157 PolarHBondContact O-N 2.93Å
156N36.4Very low46.9Very low170 Ų170119.5 Ų119.591%0.90969%0.685SS**  trans-57.484.7172.8-64.3-40.5000110.8
157T39.4Very low45.4Very low115 Ų115119.7 Ų119.771%0.70669%0.692SS**  trans-145.1138.6168.956.70000110.1I155I155-T157 VanDerWaalsContact C-N 3.29Å; I155-T157 HydrophobicContact CG2-CG2 4.28Å; I155-T157 PolarHBondContact O-N 2.93Å
158T40.5Very low43.7Very low129 Ų129120.8 Ų120.879%0.79171%0.706SS**  trans-41.2146.8-177.2460000115.3A160T158-A160 PolarHBondContact O-N 3.18Å
159P39.5Very low41.7Very low124 Ų124119.8 Ų119.881%0.80572%0.718SS**  trans-66.4119.4-173.928.7-33000110.8S161P159-S161 PolarHBondContact O-N 3.39Å
160A35.4Very low39.9Very low91 Ų91124.7 Ų124.775%0.75274%0.738SS**  trans-63.6119.5171.200000109.6T158 I162T158-A160 PolarHBondContact O-N 3.18Å; A160-I162 PolarHBondContact O-N 3.42Å
161S34Very low38.5Very low115 Ų115129.1 Ų129.180%0.80475%0.752SS**  trans-72.5113.5175.6-64.10000109.6P159 L163P159-S161 PolarHBondContact O-N 3.39Å; S161-L163 PolarHBondContact O-N 3.03Å
162I36.2Very low37.3Very low120 Ų120129.5 Ų129.562%0.61576%0.76SS**  trans-86.2104.9170.7-57.7174.7000107.3A160 F164A160-I162 PolarHBondContact O-N 3.42Å; I162-F164 HydrophobicContact CB-CE2 4.38Å; I162-F164 HydrophobicContact CG2-CD2 3.93Å; I162-F164 HydrophobicContact CG2-CE2 3.47Å; I162-F164 VanDerWaalsContact CG2-CE2 3.47Å; I162-F164 HydrophobicContact CG2-CZ 3.9Å
163L36.7Very low36.1Very low170 Ų170131.6 Ų131.689%0.8977%0.77SS**  trans-80.3115.3172.3-78.6168.6000109.8S161S161-L163 PolarHBondContact O-N 3.03Å
164F32.9Very low35.3Very low170 Ų170133.4 Ų133.475%0.74678%0.783SS**  trans-95.7119.9166.3-75.2-81.6000109.4I162I162-F164 HydrophobicContact CB-CE2 4.38Å; I162-F164 HydrophobicContact CG2-CD2 3.93Å; I162-F164 HydrophobicContact CG2-CE2 3.47Å; I162-F164 VanDerWaalsContact CG2-CE2 3.47Å; I162-F164 HydrophobicContact CG2-CZ 3.9Å
165Y31.9Very low35.1Very low231 Ų231139.3 Ų139.391%0.90679%0.785SS**  trans-97.4126173.5-143.5-92000108.8
166S28.6Very low34.6Very low104 Ų104139 Ų13973%0.72779%0.791SS**  trans-123127171.81780000109.1
167P38.9Very low34.2Very low96 Ų96136.3 Ų136.362%0.62379%0.786SS**  trans-96.6120.2172.733.2-23.6000110
168A33.4Very low33.9Very low85 Ų85137 Ų13770%0.70279%0.79SS**  trans-128.3142.1165.400000111.3
169C31.5Very low33.5Very low115 Ų115138.7 Ų138.778%0.77779%0.789SS**  trans86.8103.3160.1-55.10000118.2
170F33.2Very low33Very low215 Ų215138.2 Ų138.294%0.94378%0.784SS**  trans-140.6105.8133.3-91.2-74.8000109.7
171D30.6Very low32.9Very low165 Ų165140.5 Ų140.588%0.88279%0.788SS**  trans-74.4124.9160.8-127.8-20.1000107.2
172A36.7Very low32.9Very low100 Ų100141.2 Ų141.283%0.82679%0.788SS**  trans-104.7103179.200000109.8
173Q35Very low32.8Very low177 Ų177141.7 Ų141.783%0.82780%0.798SS**  trans-78.2133163.2-75-155.3-1400111.3
174S30.3Very low32.5Very low103 Ų103136.6 Ų136.672%0.7279%0.787SS**  trans-4134.4157.659.50000120.6
175F32.7Very low32.3Very low206 Ų206136.7 Ų136.790%0.90479%0.794SS**  trans-126.9142147-78.9-78.1000110.3
176P33.1Very low32.3Very low117 Ų117132.3 Ų132.376%0.7679%0.791SS**  trans-95.7144.6-176.735.6-31.3000114.7
177S27.5Very low32.2Very low114 Ų114131.3 Ų131.380%0.79779%0.79SS**  trans37.4122137.8-157.90000121.7
178V32.7Very low31.7Very low129 Ų129137 Ų13778%0.78281%0.805SS**  trans-155.5111.4137.7175.90000111.3
179Q32.9Very low31.4Very low165 Ų165141.2 Ų141.277%0.77181%0.81SS**  trans53.9114.3135.3-62.9-177.914.200122.2
180T29.1Very low31.6Very low115 Ų115141.1 Ų141.171%0.70681%0.808SS**  92.7126.996.5-48.40000110.5
181V33.2Very low31.6Very low138 Ų138138.4 Ų138.484%0.83680%0.798SS**  -167.4143.763.9-145.40000111.2
182T33Very low31.5Very low130 Ų130138.2 Ų138.280%0.79879%0.792SS**  trans-75.8167.5169.7-2.90000112.7
183P35.9Very low31.2Very low130 Ų130139.1 Ų139.184%0.84479%0.787SS**  -143.7172.865.133.9-11.8000113.4
184G30.1Very low31Very low63 Ų63137.8 Ų137.865%0.64979%0.786SS**  cis136.3112.213.200000109.4
185L27.5Very low31Very low172 Ų172138.2 Ų138.290%0.90179%0.789SS**  trans51.5140.7156.3-68.6153.5000118.2
186V32.7Very low31.1Very low139 Ų139134 Ų13484%0.84278%0.78SS**  -167.3154.360.3-152.40000109.7
187A25.4Very low31Very low84 Ų84135.6 Ų135.669%0.69478%0.782SS**  trans-74.8149.8-179.400000115.4
188F29.2Very low31.1Very low216 Ų216135.6 Ų135.695%0.94778%0.782SS**  trans-155.5127.6152.2-104.4-82.1000110.7
189Q26.8Very low31Very low173 Ų173136.3 Ų136.381%0.80879%0.787SS**  trans-89148.9162.3-146.7-175.8-3000107
190P35.1Very low30.9Very low112 Ų112132.5 Ų132.573%0.72778%0.779SS**  -156.1155.983.135.6-12.6000117.4
191Q33.6Very low30.9Very low158 Ų158136.4 Ų136.474%0.73879%0.789SS**  trans44.6125.1132.9-125.8170-7.400123.5
192Q28.1Very low30.8Very low161 Ų161138.1 Ų138.175%0.75279%0.788SS**  trans44.9116.3140.9-72175.9-6.500120
193T32Very low30.6Very low119 Ų119136.9 Ų136.973%0.7379%0.785SS**  173.1135.795.342.40000110.8
194D30.6Very low30.4Very low149 Ų149137.7 Ų137.780%0.79778%0.78SS**  trans60.7112.7145-55.3-27000122.9
195S29.5Very low30.5Very low112 Ų112140.7 Ų140.778%0.78379%0.786SS**  trans73.1118.5132.1-151.60000119.4
196V35.9Very low30.7Very low117 Ų117139.7 Ų139.771%0.70978%0.781SS**  trans132.5120.2131.9-172.40000112.1
197N31.2Very low30.9Very low151 Ų151137.8 Ų137.881%0.80777%0.769SS**  trans82.697.1162.9-72.2-4.5000120.3
198S27.9Very low31.2Very low115 Ų115141.6 Ų141.680%0.80478%0.778SS**  trans-55.8130163-36.50000113.6
199T31Very low31.5Very low144 Ų144137 Ų13788%0.88376%0.763SS**  trans-14884.1148.3-42.10000107.1
200S31.6Very low32.1Very low85 Ų85137.9 Ų137.959%0.59477%0.767SS**  trans-100112.8175.257.50000109.6Q202S200-Q202 PolarHBondContact O-N 2.89Å
201E29Very low32.3Very low196 Ų196139.7 Ų139.792%0.91677%0.771SS**  trans-55.2121.8160.4-63.9-179.113500109
202Q30.9Very low32.3Very low174 Ų174135.3 Ų135.381%0.81376%0.757SS**  trans-112.8109173.1-73.1-173.76.400109.6S200S200-Q202 PolarHBondContact O-N 2.89Å
203S28.4Very low32.6Very low105 Ų105132.2 Ų132.273%0.73475%0.745SS**  trans-68.3132.6177.2-175.20000111.3T205S203-T205 PolarHBondContact O-N 3.12Å
204I30.9Very low32.8Very low147 Ų147130.5 Ų130.575%0.75474%0.738SS**  trans-65116.1168.3-58.6169.4000107.6L206I204-L206 HydrophobicContact CG2-CD1 3.83Å; I204-L206 HydrophobicContact CG2-CG 4.47Å
205T32.7Very low33.3Very low125 Ų125127.6 Ų127.677%0.76772%0.722SS**  trans-98109.5171.829.50000108.8S203S203-T205 PolarHBondContact O-N 3.12Å
206L33.1Very low33.8Very low151 Ų151126.6 Ų126.679%0.79172%0.715SS**  trans-89.1115.1169.8-77.7106000109.4I204I204-L206 HydrophobicContact CG2-CD1 3.83Å; I204-L206 HydrophobicContact CG2-CG 4.47Å
207T36.5Very low34.1Very low99 Ų99126.3 Ų126.361%0.60771%0.709SS**  trans-95.6125168.952.60000110.1L209T207-L209 PolarHBondContact O-N 3.43Å
208N31.5Very low34.3Very low165 Ų165125.1 Ų125.188%0.88271%0.709SS**  trans-85.399.6-177.1-142.8-48.1000109.9
209L35.3Very low34.7Very low120 Ų120126.5 Ų126.563%0.62871%0.708SS**  trans-114.3125.1162.8-85.9141.6000106.7T207 N211 S212T207-L209 PolarHBondContact O-N 3.43Å; L209-N211 PolarHBondContact O-N 3.3Å; L209-S212 PolarHBondContact O-N 3.36Å
210Q38.5Very low34.9Very low191 Ų191125.3 Ų125.389%0.89370%0.7SS**THydrogen-bonded Turntrans-46.6116.1-177.9-80.3169.5-55.300110.7
211N40.4Very low34.9Very low150 Ų150127.5 Ų127.580%0.80271%0.71SS**THydrogen-bonded Turntrans79.421.3173-54.6-2.8000118.6L209L209-N211 PolarHBondContact O-N 3.3Å
212S33.7Very low35.3Very low65 Ų65125.9 Ų125.946%0.45570%0.702SS.*EExtended strand (participates in β ladder)trans-126.2135.2167.762.20000113.3L209L209-S212 PolarHBondContact O-N 3.36Å
213L34.2Very low35.4Very low96 Ų96123.9 Ų123.950%0.50370%0.704SS.*EExtended strand (participates in β ladder)trans-106.5124.6166-169.987.1000106.8I215 L240L213-I215 HydrophobicContact CD2-CD1 3.9Å; L213-I215 HydrophobicContact CD2-CG1 4.08Å; L213-I215 HydrophobicContact CG-CG1 4.41Å; L213-L240 HydrophobicContact CB-CD1 4.47Å; L213-L240 HydrophobicContact CD2-CD1 4.28Å; L213-L240 WeakPolarHBondContact O-CD1 3.49Å
214S36.9Very low35.7Very low83 Ų83124.4 Ų124.458%0.5870%0.703SS**EExtended strand (participates in β ladder)trans-113.6127.9172.936.10000109.1
215I39.7Very low36Very low88 Ų88123.4 Ų123.445%0.45170%0.704SS.*EExtended strand (participates in β ladder)trans-119.1116176.5-57.1174.3000106.7L213 L217L213-I215 HydrophobicContact CD2-CD1 3.9Å; L213-I215 HydrophobicContact CD2-CG1 4.08Å; L213-I215 HydrophobicContact CG-CG1 4.41Å; I215-L217 HydrophobicContact CG2-CD1 4.21Å
216S40.6Very low36.4Very low91 Ų91126.3 Ų126.364%0.63671%0.709SS**PPolyproline II helixtrans-94.3122.5168.9-168.70000108.1
217L42.7Very low37.1Very low111 Ų111122.9 Ų122.958%0.58170%0.698SS**PPolyproline II helixtrans-84.7129.9176.5-82.883.4000109.7I215 N219I215-L217 HydrophobicContact CG2-CD1 4.21Å; L217-N219 PolarHBondContact O-N 2.85Å
218P34.2Very low37.6Very low126 Ų126124.8 Ų124.882%0.81870%0.699SS**PPolyproline II helixtrans-77.311717229.6-29.8000109.4
219N37.1Very low38.5Very low145 Ų145121.2 Ų121.278%0.77568%0.684SS**  trans-142.4114.5157.3-140.25.1000112.7L217L217-N219 PolarHBondContact O-N 2.85Å
220T34.7Very low39.4Very low118 Ų118116 Ų11672%0.72466%0.657SS**  trans22.4104.1146.1-34.20000118.7
221V32.4Very low40.1Very low132 Ų132109.5 Ų109.580%0.863%0.63SS**  trans60.590.1143.9-170.40000117.2
222Q36.5Very low40.5Very low162 Ų162102.9 Ų102.976%0.75760%0.595SS**  179.9137.7127.8-102.7-172.83.100110.2V224Q222-V224 PolarHBondContact O-N 3.49Å
223P33.5Very low41.3Very low131 Ų131105.2 Ų105.285%0.85160%0.599SS**  trans-83.7101173.532.5-26.6000108.5
224V35Very low42.3Very low116 Ų116103.2 Ų103.270%0.70359%0.588SS**  trans-119.7124.2166.9-176.70000108.3Q222 E226Q222-V224 PolarHBondContact O-N 3.49Å; V224-E226 PolarHBondContact O-N 2.95Å
225T37.3Very low42.8Very low127 Ų127105.3 Ų105.378%0.77960%0.6SS**SBendtrans-68.9113.6177.147.20000109.5
226E40.9Very low43.6Very low186 Ų186107.6 Ų107.687%0.86961%0.613SS**  trans139.996.3161.3-79.9174.3-170.200109V224V224-E226 PolarHBondContact O-N 2.95Å
227S47.2Very low44.2Very low79 Ų79105.9 Ų105.955%0.55261%0.609SS**  trans-92.7103.6177.4-152.50000108.5
228E47Very low44.6Very low138 Ų138105.2 Ų105.265%0.64561%0.606SS**EExtended strand (participates in β ladder)trans-82.6117.7176.2-162175.7177.800109.3T230 T244E228-T230 PolarHBondContact O-N 3.36Å; E228-T244 PolarHBondContact O-N 3.49Å
229V51.2Low45.4Very low91 Ų91105.3 Ų105.355%0.55259%0.59SS**EExtended strand (participates in β ladder)trans-84.6105.4176.4179.20000108.2T243V229-T243 HydrophobicContact CG2-CG2 4.3Å
230T54Low45.9Very low11 Ų1199.7 Ų99.77%0.06756%0.56CS.*EExtended strand (participates in β ladder)trans-87.1112.5171.2-65.50000109E228 V232 I242 T244 Q249E228-T230 PolarHBondContact O-N 3.36Å; T230-V232 HydrophobicContact CG2-CG2 4.44Å; T230-I242 PolarHBondContact N-O 2.93Å; T230-I242 PolarHBondContact O-N 3.49Å; T230-T244 PolarHBondContact OG1-OG1 3.36Å; T230-Q249 HydrophobicContact CG2-CB 4.41Å; T230-Q249 HydrophobicContact CG2-CG 3.64Å
231T52.4Low46.8Very low53 Ų5394.9 Ų94.933%0.32553%0.533SS..EExtended strand (participates in β ladder)trans-89.3120.4171.35.30000110.7R239 L240T231-R239 HydrophobicContact CG2-CB 4.5Å; T231-L240 WeakPolarHBondContact CA-O 3.31Å
232V50Low47.9Very low11 Ų1189.2 Ų89.27%0.06750%0.499CS..EExtended strand (participates in β ladder)trans-96.2120.5171.1-179.30000108.5T230 L240 L253T230-V232 HydrophobicContact CG2-CG2 4.44Å; V232-L240 PolarHBondContact N-O 2.96Å; V232-L240 PolarHBondContact O-N 3.33Å; V232-L253 HydrophobicContact CG1-CD2 3.66Å
233Q49.8Very low48.8Very low115 Ų11584 Ų8454%0.53748%0.477SS..EExtended strand (participates in β ladder)trans-90112.6176.3-170.398.418.600108.7
234L55.9Low50Low53 Ų5378.3 Ų78.328%0.27744%0.441SS..  trans-81154.9174.8-69.3155.2000110.4N236 G237 L238 I258L234-N236 PolarHBondContact O-N 3.36Å; L234-G237 PolarHBondContact O-N 3.31Å; L234-G237 VanDerWaalsContact O-N 3.1Å; L234-L238 HydrophobicContact CB-CB 4.13Å; L234-L238 WeakPolarHBondContact CB-O 3.33Å; L234-L238 HydrophobicContact CD1-CB 3.91Å; L234-L238 PolarHBondContact N-O 2.67Å; L234-I258 HydrophobicContact CD2-CD1 3.92Å
235P45.7Very low50.9Low127 Ų12779.6 Ų79.683%0.82544%0.443SS*.THydrogen-bonded Turntrans-55.6-18.7-176.7-2532.9000115.1
236N58Low51.8Low137 Ų13777 Ų7773%0.73344%0.442SS*.THydrogen-bonded Turntrans-98.113.1-173.7-50.4-2.9000112.6L234 L238L234-N236 PolarHBondContact O-N 3.36Å; N236-L238 PolarHBondContact O-N 3.33Å
237G53.3Low52.6Low54 Ų5469.8 Ų69.856%0.55741%0.414SS*.SBendtrans754.9-175.600000114.6L234 R239L234-G237 PolarHBondContact O-N 3.31Å; L234-G237 VanDerWaalsContact O-N 3.1Å; G237-R239 PolarHBondContact O-N 2.88Å
238L49.8Very low53.4Low97 Ų9769.7 Ų69.751%0.50841%0.414SS..  trans-72.7121.2170.2-89.4160.3000109.5L234 N236L234-L238 HydrophobicContact CB-CB 4.13Å; L234-L238 WeakPolarHBondContact CB-O 3.33Å; L234-L238 HydrophobicContact CD1-CB 3.91Å; L234-L238 PolarHBondContact N-O 2.67Å; N236-L238 PolarHBondContact O-N 3.33Å
239R52.1Low54.1Low129 Ų12968.5 Ų68.549%0.48741%0.408SS..EExtended strand (participates in β ladder)trans-96.2116.9170.8-76.7-174.9129.5-124.6-3.5109.3T231 G237T231-R239 HydrophobicContact CG2-CB 4.5Å; G237-R239 PolarHBondContact O-N 2.88Å
240L46.3Very low54.6Low27 Ų2766.8 Ų66.814%0.14140%0.404CS..EExtended strand (participates in β ladder)trans-101.6111.1171.7-172.768.9000108L213 T231 V232 I242 L256L213-L240 HydrophobicContact CB-CD1 4.47Å; L213-L240 HydrophobicContact CD2-CD1 4.28Å; L213-L240 WeakPolarHBondContact O-CD1 3.49Å; T231-L240 WeakPolarHBondContact CA-O 3.31Å; V232-L240 PolarHBondContact N-O 2.96Å; V232-L240 PolarHBondContact O-N 3.33Å; L240-I242 HydrophobicContact CD2-CD1 3.75Å; L240-I242 HydrophobicContact CD2-CG1 4.13Å; L240-I242 HydrophobicContact CG-CD1 4.13Å; L240-I242 HydrophobicContact CG-CG1 3.97Å; L240-L256 HydrophobicContact CD2-CD1 4.14Å
241G53.7Low55.2Low16 Ų1668.7 Ų68.717%0.16542%0.417CS..EExtended strand (participates in β ladder)trans-87.7117.9172.600000109.6
242I57.1Low55.7Low14 Ų1466.5 Ų66.57%0.07240%0.403CS..EExtended strand (participates in β ladder)trans-115.6119.9176.3-55.5171.7000107.3T230 L240 T244 V252 L256T230-I242 PolarHBondContact N-O 2.93Å; T230-I242 PolarHBondContact O-N 3.49Å; L240-I242 HydrophobicContact CD2-CD1 3.75Å; L240-I242 HydrophobicContact CD2-CG1 4.13Å; L240-I242 HydrophobicContact CG-CD1 4.13Å; L240-I242 HydrophobicContact CG-CG1 3.97Å; I242-T244 HydrophobicContact CB-CG2 4.38Å; I242-T244 HydrophobicContact CG2-CG2 3.71Å; I242-T244 PolarHBondContact O-N 3.34Å; I242-V252 HydrophobicContact CB-CG1 4.44Å; I242-V252 HydrophobicContact CD1-CG1 3.28Å; I242-V252 HydrophobicContact CG1-CG1 4.42Å; I242-V252 HydrophobicContact CG2-CG1 4.37Å; I242-L256 HydrophobicContact CD1-CD1 3.75Å
243T54.5Low56.4Low51 Ų5167.6 Ų67.631%0.31341%0.409SS..EExtended strand (participates in β ladder)trans-73.7110.3168.652.80000107.4V229V229-T243 HydrophobicContact CG2-CG2 4.3Å
244T58.3Low57.4Low13 Ų1369.2 Ų69.28%0.0842%0.417CS..EExtended strand (participates in β ladder)trans-111.6126.8176.459.80000109.3E228 T230 I242 G246 A247 V252E228-T244 PolarHBondContact O-N 3.49Å; T230-T244 PolarHBondContact OG1-OG1 3.36Å; I242-T244 HydrophobicContact CB-CG2 4.38Å; I242-T244 HydrophobicContact CG2-CG2 3.71Å; I242-T244 PolarHBondContact O-N 3.34Å; T244-G246 PolarHBondContact O-N 2.88Å; T244-A247 HydrophobicContact CG2-CB 4.31Å; T244-A247 PolarHBondContact OG1-O 2.98Å; T244-V252 HydrophobicContact CG2-CG2 3.49Å; T244-V252 VanDerWaalsContact CG2-CG2 3.49Å
245N53.8Low57.6Low142 Ų14273 Ų7376%0.75944%0.435SS*.SBendtrans-79.868.7172.8-64.8-14.5000108.6
246G56.5Low58.4Low72 Ų7271.1 Ų71.174%0.74242%0.417SS*.SBendtrans85.712.2175.300000116.9T244T244-G246 PolarHBondContact O-N 2.88Å
247A57.2Low58Low36 Ų3667.9 Ų67.930%0.29842%0.416SS..  trans-85.2129.1174.900000111.2T244 V252T244-A247 HydrophobicContact CG2-CB 4.31Å; T244-A247 PolarHBondContact OG1-O 2.98Å; A247-V252 HydrophobicContact CB-CG2 4.39Å
248S65.8Low58.2Low77 Ų7768.7 Ų68.754%0.53841%0.407SS..  trans-63.5150.4177.768.40000112A250 S251 V252S248-A250 PolarHBondContact O-N 3.35Å; S248-A250 VanDerWaalsContact O-N 3.1Å; S248-S251 WeakPolarHBondContact O-CB 3.42Å; S248-S251 PolarHBondContact O-N 3.33Å; S248-V252 PolarHBondContact O-N 3.35Å
249Q60.6Low58.2Low113 Ų11370.3 Ų70.353%0.52841%0.412SS..Hα-helixtrans-51.7-37.9179.6-54.9-159.4-9.400112.7T230 S251 V252 L253T230-Q249 HydrophobicContact CG2-CB 4.41Å; T230-Q249 HydrophobicContact CG2-CG 3.64Å; Q249-S251 VanDerWaalsContact C-N 3.35Å; Q249-S251 PolarHBondContact O-N 3.44Å; Q249-V252 PolarHBondContact O-N 3.19Å; Q249-L253 WeakPolarHBondContact O-CB 3.47Å; Q249-L253 WeakPolarHBondContact O-CG 3.36Å; Q249-L253 PolarHBondContact O-N 3.42Å
250A62.9Low57.9Low55 Ų5567.8 Ų67.846%0.45541%0.412SS..Hα-helixtrans-62.4-40177.600000112.5S248 V252 L253 Q254S248-A250 PolarHBondContact O-N 3.35Å; S248-A250 VanDerWaalsContact O-N 3.1Å; A250-V252 VanDerWaalsContact C-N 3.34Å; A250-L253 PolarHBondContact O-N 2.99Å; A250-Q254 VanDerWaalsContact O-CB 3.3Å; A250-Q254 WeakPolarHBondContact O-CB 3.21Å; A250-Q254 PolarHBondContact O-N 2.96Å
251S65.6Low57.6Low50 Ų5073.5 Ų73.535%0.3544%0.438SS..Hα-helixtrans-67.7-37.4177.6-165.10000111.5S248 Q249 Q254 M255S248-S251 WeakPolarHBondContact O-CB 3.42Å; S248-S251 PolarHBondContact O-N 3.33Å; Q249-S251 VanDerWaalsContact C-N 3.35Å; Q249-S251 PolarHBondContact O-N 3.44Å; S251-Q254 PolarHBondContact O-N 3.04Å; S251-M255 WeakPolarHBondContact O-CB 3.41Å; S251-M255 PolarHBondContact O-N 2.73Å
252V63Low57.2Low7 Ų777.8 Ų77.84%0.04246%0.463CS..Hα-helixtrans-66.7-45.6175.9-176.50000111.5I242 T244 A247 S248 Q249 A250 Q254 M255 L256I242-V252 HydrophobicContact CB-CG1 4.44Å; I242-V252 HydrophobicContact CD1-CG1 3.28Å; I242-V252 HydrophobicContact CG1-CG1 4.42Å; I242-V252 HydrophobicContact CG2-CG1 4.37Å; T244-V252 HydrophobicContact CG2-CG2 3.49Å; T244-V252 VanDerWaalsContact CG2-CG2 3.49Å; A247-V252 HydrophobicContact CB-CG2 4.39Å; S248-V252 PolarHBondContact O-N 3.35Å; Q249-V252 PolarHBondContact O-N 3.19Å; A250-V252 VanDerWaalsContact C-N 3.34Å; V252-Q254 VanDerWaalsContact C-N 3.34Å; V252-M255 PolarHBondContact O-N 3.01Å; V252-L256 HydrophobicContact CG1-CD1 4.07Å; V252-L256 WeakPolarHBondContact O-CG 3.42Å; V252-L256 PolarHBondContact O-N 2.88Å
253L64.8Low56.2Low34 Ų3485.7 Ų85.718%0.17850%0.5CS..Hα-helixtrans-62.8-41.3176.9-73.9169.4000111.6V232 Q249 A250 L256 G257 I258V232-L253 HydrophobicContact CG1-CD2 3.66Å; Q249-L253 WeakPolarHBondContact O-CB 3.47Å; Q249-L253 WeakPolarHBondContact O-CG 3.36Å; Q249-L253 PolarHBondContact O-N 3.42Å; A250-L253 PolarHBondContact O-N 2.99Å; L253-L256 CarbonylContact O-C 3.46Å; L253-L256 PolarHBondContact O-N 2.9Å; L253-G257 PolarHBondContact O-N 2.94Å; L253-I258 CarbonylContact C-O 3.4Å; L253-I258 HydrophobicContact CB-CB 4.46Å; L253-I258 HydrophobicContact CD2-CB 4.04Å; L253-I258 HydrophobicContact CD2-CD1 4.03Å; L253-I258 HydrophobicContact CD2-CG2 4.05Å; L253-I258 PolarHBondContact O-N 3.42Å
254Q69.8Low55.3Low150 Ų15091.3 Ų91.370%0.70153%0.526SS*.Hα-helixtrans-64.4-40.3176-169.7169.637.200112A250 S251 V252 L256 G257A250-Q254 VanDerWaalsContact O-CB 3.3Å; A250-Q254 WeakPolarHBondContact O-CB 3.21Å; A250-Q254 PolarHBondContact O-N 2.96Å; S251-Q254 PolarHBondContact O-N 3.04Å; V252-Q254 VanDerWaalsContact C-N 3.34Å; Q254-L256 VanDerWaalsContact C-N 3.26Å; Q254-L256 PolarHBondContact O-N 3.27Å; Q254-G257 PolarHBondContact O-N 3.27Å; Q254-G257 VanDerWaalsContact O-N 3.12Å
255M60.3Low53.9Low133 Ų13395.2 Ų95.266%0.65555%0.55SS*.Hα-helixtrans-67.2-28.3176.3-150.3-175.4-39.800112.4S251 V252 G257S251-M255 WeakPolarHBondContact O-CB 3.41Å; S251-M255 PolarHBondContact O-N 2.73Å; V252-M255 PolarHBondContact O-N 3.01Å; M255-G257 VanDerWaalsContact C-N 3.32Å
256L62.3Low53Low86 Ų8696.1 Ų96.145%0.4555%0.549SS..THydrogen-bonded Turntrans-85.11.7173.9-70.2168.1000113.8L240 I242 V252 L253 Q254 I258L240-L256 HydrophobicContact CD2-CD1 4.14Å; I242-L256 HydrophobicContact CD1-CD1 3.75Å; V252-L256 HydrophobicContact CG1-CD1 4.07Å; V252-L256 WeakPolarHBondContact O-CG 3.42Å; V252-L256 PolarHBondContact O-N 2.88Å; L253-L256 CarbonylContact O-C 3.46Å; L253-L256 PolarHBondContact O-N 2.9Å; Q254-L256 VanDerWaalsContact C-N 3.26Å; Q254-L256 PolarHBondContact O-N 3.27Å; L256-I258 VanDerWaalsContact C-N 3.26Å; L256-I258 HydrophobicContact CB-CD1 4.26Å; L256-I258 HydrophobicContact CB-CG1 4.25Å; L256-I258 PolarHBondContact O-N 3.4Å
257G50.6Low51.8Low70 Ų70100.7 Ų100.772%0.72255%0.551SS**THydrogen-bonded Turntrans69.220.8-178.600000114.2L253 Q254 M255L253-G257 PolarHBondContact O-N 2.94Å; Q254-G257 PolarHBondContact O-N 3.27Å; Q254-G257 VanDerWaalsContact O-N 3.12Å; M255-G257 VanDerWaalsContact C-N 3.32Å
258I57.3Low50.5Low70 Ų70103.8 Ų103.836%0.35958%0.576SS.*  trans-97.4108.4175.8-55.3175000107.6L234 L253 L256 P260L234-I258 HydrophobicContact CD2-CD1 3.92Å; L253-I258 CarbonylContact C-O 3.4Å; L253-I258 HydrophobicContact CB-CB 4.46Å; L253-I258 HydrophobicContact CD2-CB 4.04Å; L253-I258 HydrophobicContact CD2-CD1 4.03Å; L253-I258 HydrophobicContact CD2-CG2 4.05Å; L253-I258 PolarHBondContact O-N 3.42Å; L256-I258 VanDerWaalsContact C-N 3.26Å; L256-I258 HydrophobicContact CB-CD1 4.26Å; L256-I258 HydrophobicContact CB-CG1 4.25Å; L256-I258 PolarHBondContact O-N 3.4Å; I258-P260 WeakPolarHBondContact O-CD 3.47Å
259E49.2Very low48.7Very low131 Ų131107.8 Ų107.861%0.61259%0.586SS**  trans-73.6123.3-178.4-161-96.3145.900110.8Q261E259-Q261 PolarHBondContact O-N 3.18Å; E259-Q261 PolarHBondContact OE2-NE2 2.96Å
260P45.8Very low47.3Very low76 Ų76109.4 Ų109.449%0.49460%0.597SS.*  trans-82.2105.1179.630.3-30.2000111.1I258I258-P260 WeakPolarHBondContact O-CD 3.47Å
261Q40.1Very low46Very low148 Ų148114.7 Ų114.769%0.69261%0.612SS**PPolyproline II helixtrans-72.3139.3173.2-78-76.6-37.500111.9E259E259-Q261 PolarHBondContact O-N 3.18Å; E259-Q261 PolarHBondContact OE2-NE2 2.96Å
262P45Very low44.3Very low105 Ų105119.5 Ų119.568%0.68263%0.634SS**PPolyproline II helixtrans-76.2131.2-177.729.4-32.7000112.9I264P262-I264 PolarHBondContact O-N 3.46Å
263E36.4Very low43.2Very low181 Ų181124.6 Ų124.685%0.84667%0.667SS**PPolyproline II helixtrans-65.7126.4176.4-71.4-160.4153.800112.7
264I35.6Very low42Very low168 Ų168128.7 Ų128.786%0.86270%0.698SS**  trans-91.7101.2162.7-59.7173.1000107.6P262P262-I264 PolarHBondContact O-N 3.46Å
265V30.5Very low40.4Very low96 Ų96129.8 Ų129.858%0.58271%0.708SS**  trans-75.3132.9164.3176.40000107.8
266H34.4Very low39.1Very low161 Ų161130.3 Ų130.375%0.74571%0.714SS**  trans-174.3104138.9-90.7-69.7000112.1
267H31.3Very low37.9Very low168 Ų168131.9 Ų131.978%0.77873%0.729SS**  trans61.6107.2144.2-62.1-14.5000122.5
268A29.2Very low37.5Very low100 Ų100133 Ų13383%0.82673%0.726SS**  trans-82.5133158.800000111.6
269H28Very low36.7Very low161 Ų161137.7 Ų137.775%0.74575%0.751SS**  trans-112.1121.7161.6-175.169000108.5
270I31.7Very low36.5Very low147 Ų147143.2 Ų143.275%0.75477%0.766SS**  trans-94.6123.6-179.6-66173.3000109
271Q35.9Very low36Very low166 Ų166145.5 Ų145.578%0.77678%0.781SS**  trans-141.9113.9152.9-75.5-172.6-10.300109.6
272N30.2Very low35.7Very low151 Ų151146 Ų14681%0.80779%0.787SS**  trans-65.9164.3155.7-86.7-21.5000109
273P39.6Very low35.1Very low115 Ų115146.8 Ų146.875%0.74779%0.786SS**  cis-150.3174.732.338.2-15.7000117.4
274S38.1Very low35.2Very low119 Ų119144.7 Ų144.783%0.83278%0.779SS**  145.4131.3127.363.70000113.1
275L37.3Very low35.1Very low174 Ų174143.2 Ų143.291%0.91177%0.768SS**  trans-78.1143.5-173.1-64.9102000112
276D32.4Very low35.3Very low144 Ų144144.6 Ų144.677%0.7778%0.777SS**  trans-129.8120155-161.69.7000109.3S278D276-S278 PolarHBondContact O-N 2.9Å
277P37.9Very low35.4Very low118 Ų118143.5 Ų143.577%0.76678%0.777SS**  trans-94.297.2-172.133.6-28.4000111.6
278S41.4Very low35.6Very low93 Ų93143.5 Ų143.565%0.6578%0.782SS**  trans-154.244.8171.457.40000114.6D276D276-S278 PolarHBondContact O-N 2.9Å
279L41.2Very low36.1Very low169 Ų169143.7 Ų143.789%0.88577%0.774SS**  trans-136.298.6169.1-87.6160.6000110.2
280W44.1Very low36.6Very low248 Ų248142 Ų14294%0.93978%0.781SS**  trans-73.1125.2170-75.367000109.6
281P36.4Very low36.9Very low124 Ų124141.9 Ų141.981%0.80578%0.782SS**  trans-91.8109.517232-24.7000109.5N283P281-N283 PolarHBondContact O-N 3.46Å
282L32.4Very low37.3Very low157 Ų157141.2 Ų141.282%0.82278%0.784SS**  trans-85.597170.7-120.1149.8000109I284L282-I284 HydrophobicContact CD2-CD1 4.48Å; L282-I284 HydrophobicContact CD2-CG1 4.21Å
283N33.5Very low37.7Very low122 Ų122139.5 Ų139.565%0.65278%0.779SS**  trans-71.5117.6167.8-178.113.4000109.2P281 Q285P281-N283 PolarHBondContact O-N 3.46Å; N283-Q285 PolarHBondContact OD1-N 3.39Å
284I37.3Very low38Very low137 Ų137139.9 Ų139.970%0.70378%0.784SS**  trans-117.886.6165.9-55.7178.3000107.4L282 T286L282-I284 HydrophobicContact CD2-CD1 4.48Å; L282-I284 HydrophobicContact CD2-CG1 4.21Å; I284-T286 PolarHBondContact O-N 3.37Å
285Q34.6Very low38.1Very low137 Ų137141.6 Ų141.664%0.6478%0.784SS**  trans-69.6115.2167.3-162.8102.634.300108.2N283N283-Q285 PolarHBondContact OD1-N 3.39Å
286T34.9Very low38.3Very low125 Ų125139.4 Ų139.477%0.76778%0.783SS**  trans-87.4107.8165.849.70000107.8I284I284-T286 PolarHBondContact O-N 3.37Å
287N36.7Very low38.6Very low139 Ų139144 Ų14474%0.74379%0.79SS**  trans-135.3121.4164.1-85.7-28.3000107.7
288L34.8Very low38.8Very low168 Ų168150.4 Ų150.488%0.8880%0.799SS**  trans-110.6166174.5-150.780.5000106.7
289P39Very low38.6Very low103 Ų103152.9 Ų152.967%0.66981%0.81SS**  -120170.6-62.433.2-18.9000111.4
290S39.3Very low38.6Very low125 Ų125149.8 Ų149.887%0.87481%0.809SS**  trans-151.5125.1152.7-78.10000112
291N38.5Very low38.2Very low145 Ų145143.9 Ų143.978%0.77581%0.805SS**  trans-36.9131.8168.3-162.435.3000114.7
292D43.5Very low38.4Very low153 Ų153142.1 Ų142.182%0.81880%0.801SS**  trans-157.6149.6139.2-115.4-21.2000113
293T39Very low38.8Very low115 Ų115140 Ų14071%0.70680%0.799SS**  trans-94.9139.5-152.2-4.60000111.9
294S46Very low38.8Very low122 Ų122140 Ų14085%0.85381%0.809SS**  trans-175.1132.8140.730.90000112.2
295D40Very low39.4Very low155 Ų155139.4 Ų139.483%0.82981%0.814SS**  trans-59.9140.7-171.6-70-74.3000116.6
296S41Very low39.6Very low129 Ų129141.7 Ų141.790%0.90283%0.825SS**  trans-158.9106.5135.5-87.90000112.1
297R39.3Very low39.8Very low240 Ų240143.3 Ų143.391%0.90683%0.829SS**  trans-29.9130.3168.4-70.3168.8169.5-138-2.9115.4
298R41.1Very low40.2Very low252 Ų252141.3 Ų141.395%0.95182%0.824SS**  -169.4117.7118-101.1167.3-167.7-118.44.2110.5
299T38Very low40.8Very low145 Ų145140.5 Ų140.589%0.8982%0.82SS**  trans-74.4130.6176.546.80000111.8
300A40.3Very low41Very low104 Ų104142.9 Ų142.986%0.8683%0.827SS**  trans-163.9106.8146.600000110.1
301S35.8Very low41.3Very low124 Ų124141 Ų14187%0.86782%0.819SS**  trans-75.5133168.5400000111.9
302A40.4Very low41.4Very low87 Ų87144.5 Ų144.572%0.71982%0.822SS**  trans-166.895.2153.300000108.2
303S41.6Very low41.5Very low112 Ų112142.9 Ų142.978%0.78382%0.819SS**  56.3108.194.159.70000115.2
304S34.6Very low41.7Very low123 Ų123141.1 Ų141.186%0.8681%0.811SS**  trans-68.8137.3169.6-168.70000111.8
305P48.8Very low41.4Very low125 Ų125140.1 Ų140.181%0.81281%0.805SS**  trans-105.9131.3159.8-4.124.9000112
306Q38.8Very low41.8Very low185 Ų185139.1 Ų139.186%0.86480%0.804SS**  trans-90.9125.7171.5175.8173.7-28.400107.1
307D40.2Very low41.8Very low159 Ų159140.7 Ų140.785%0.8580%0.802SS**  trans-104.2120.3173.3-110.6-29.9000110.8
308P44.7Very low42.3Very low97 Ų97136.4 Ų136.463%0.6380%0.796SS**  trans-98.7119.2166.434.2-22.2000109.9
309D46.7Very low42.1Very low150 Ų150132.5 Ų132.580%0.80279%0.794SS**  trans-171.696.3158.3-87.5-37.9000106.3
310D43.1Very low42.7Very low153 Ų153132.7 Ų132.782%0.81879%0.789SS**  73.5130.187-95.1-38.3000116.8
311A45.9Very low42.7Very low85 Ų85135.8 Ų135.870%0.70279%0.785SS**  trans62.797.4141.900000121
312R40.2Very low43Very low220 Ų220139 Ų13983%0.8379%0.787SS**  trans-27.4145.1141.1170.4-176.6151.6-170.1-5.9115.6
313P45.6Very low43Very low119 Ų119141.6 Ų141.677%0.77379%0.788SS**  -133.9119.9125.233.5-20.3000110.7
314S44.2Very low43.2Very low77 Ų77144.1 Ų144.154%0.53879%0.793SS.*  36.9117.394.4-1590000117.2
315S39.3Very low43.5Very low102 Ų102143.7 Ų143.771%0.71379%0.787SS**  trans64.5104.8149.4430000119.7
316V48.5Very low43.3Very low134 Ų134145.1 Ų145.181%0.81279%0.785SS**  trans-141.3112.8146.7-153.60000108.3
317D41.5Very low43.5Very low162 Ų162147 Ų14787%0.86678%0.784SS**  trans-63.8139.2162.4-74.1-62.4000109.7
318I48.9Very low43.4Very low150 Ų150146.5 Ų146.577%0.76978%0.782SS**  trans-13193.3174.6-25.3174.9000107.8
319N37.9Very low43.4Very low169 Ų169147.5 Ų147.590%0.90479%0.786SS**  trans-78.7126.6156.4-108.7-46.2000107.2
320L49.6Very low43.1Very low150 Ų150150.9 Ų150.979%0.78579%0.787SS**  trans-133.7112.5169.8-163.865.4000109.6
321E40.6Very low43.2Very low169 Ų169149 Ų14979%0.7979%0.786SS**  trans-19.1142.7174-62.717898.900120.8
322Q42.9Very low43.1Very low192 Ų192150 Ų15090%0.89779%0.787SS**  trans-153.9106.2136.5-114.7170-12.400111.6
323N40.2Very low43.2Very low141 Ų141145.1 Ų145.175%0.75479%0.787SS**  trans26.7118.2149-67.5-11.5000121.2
324D45.6Very low43.3Very low165 Ų165146 Ų14688%0.88279%0.79SS**  trans-159.5136.7130.8-100.9-36.2000110.2
325P41.1Very low43.4Very low114 Ų114147 Ų14774%0.7480%0.797SS**  trans-96.3165.6-171.737.4-32.8000113.9
326M43.3Very low43.5Very low154 Ų154147.1 Ų147.176%0.75980%0.798SS**  trans8795.6167-68.7-175.666.900118.2
327R43.5Very low43.3Very low225 Ų225148.2 Ų148.285%0.84980%0.804SS**  173.613899-93171.8-170.4-176.23.8111.5
328D39Very low43.2Very low149 Ų149146 Ų14680%0.79780%0.802SS**  trans-52.5154.9-178.2-62.6-75.8000116
329V43.1Very low42.9Very low118 Ų118144.1 Ų144.172%0.71580%0.802SS**  160.9111.1107.9166.50000111.2
330R42Very low43.1Very low221 Ų221141.3 Ų141.383%0.83480%0.796SS**  trans67.2111.6141.5-64.6175.9-179.8175.5-5.7120.2
331S45Very low43.1Very low113 Ų113139.3 Ų139.379%0.7979%0.794SS**  90.2134.196.1-61.10000111
332S44.2Very low43.3Very low105 Ų105140.7 Ų140.773%0.73480%0.801SS**  cis-175.9123.322.733.30000106
333S42.3Very low43.2Very low119 Ų119134.9 Ų134.983%0.83279%0.792SS**  58.6111.193.9-51.90000117.3
334V47.9Very low43.5Very low137 Ų137136.4 Ų136.483%0.8380%0.801SS**  trans-154.799.9139.8-79.40000108.4
335S46.2Very low43.5Very low99 Ų99133.4 Ų133.469%0.69279%0.792SS**  57.6102.993.458.80000113.7
336S41.1Very low43.8Very low104 Ų104133.5 Ų133.573%0.72780%0.796SS**  93.1123.667.764.10000113.6
337V44.1Very low44.1Very low156 Ų156136.7 Ų136.795%0.94580%0.799SS**  trans-159.5130.2139.8-96.90000110.3
338S39.8Very low44.4Very low116 Ų116133 Ų13381%0.81180%0.797SS**  trans-118.3146.2-174.3-45.70000109.5
339S42.1Very low44.8Very low111 Ų111133.1 Ų133.178%0.77680%0.796SS**  trans-173.892.8154.939.40000108.8
340S42Very low44.9Very low110 Ų110132.4 Ų132.477%0.76980%0.803SS**  57.4109.982.8730000115.1
341S48.6Very low45.1Very low108 Ų108128.2 Ų128.276%0.75580%0.802SS**  164.6121.2108.654.30000113.2
342Q46.3Very low45.5Very low197 Ų197127.3 Ų127.392%0.92180%0.795SS**  trans49.7121.6132.7-62.7178.57.300121.7
343G41Very low45.8Very low70 Ų70129.7 Ų129.772%0.72280%0.8SS**  11494.9117.500000117
344N44.5Very low46.3Very low174 Ų174131.7 Ų131.793%0.9380%0.801SS**  -169.7114.7117.8-99.7-5000111.9
345S46Very low46.7Very low101 Ų101134.1 Ų134.171%0.70680%0.8SS**  trans-85.2131.2165.8-63.50000110.4
346S47.6Very low47Very low117 Ų117135.4 Ų135.482%0.81880%0.799SS**  trans-160.887.6149.7-77.80000106.6
347R50.1Low48Very low220 Ų220136.8 Ų136.883%0.8380%0.803SS**  47.992.990.9-68.8-168.6-101.1176.7-6.1112.8
348N49Very low48.6Very low148 Ų148140.6 Ų140.679%0.79180%0.8SS**  trans-175.599137.2-87.6-31.9000108.5
349L47.8Very low50Low151 Ų151137.4 Ų137.479%0.79177%0.774SS**  68.182.392-85.8130.2000113.8
350A44.8Very low51.8Low104 Ų104136.5 Ų136.586%0.8676%0.761SS**  trans-14083.8148.400000108.7S352A350-S352 PolarHBondContact O-N 2.83Å
351V46.8Very low53.8Low132 Ų132135.7 Ų135.780%0.875%0.753SS**  trans-64.5113.2171165.50000109.2
352S53.1Low55.8Low94 Ų94135.5 Ų135.566%0.65775%0.747SS**  trans-172.8131.213653.40000110.9A350A350-S352 PolarHBondContact O-N 2.83Å
353N50.1Low57.8Low155 Ų155130.6 Ų130.683%0.82972%0.724SS**  trans84.329.4168-53.9-62.4000120K355N353-K355 VanDerWaalsContact C-N 3.29Å; N353-K355 PolarHBondContact O-N 3.38Å
354L53.5Low60.1Low162 Ų162131.3 Ų131.385%0.84871%0.709SS**  trans-92.164.8157.5-161.774.1000110.4
355K55.9Low62.3Low188 Ų188126.3 Ų126.382%0.81769%0.687SS**  trans-144.261.6174.6-162.6159.9-172.5174.90109N353N353-K355 VanDerWaalsContact C-N 3.29Å; N353-K355 PolarHBondContact O-N 3.38Å
356D52.5Low64.6Low125 Ų125130.9 Ų130.967%0.66869%0.689SS**  trans179.350.3162-93.6-23.6000113.3R358 L359D356-R358 PolarHBondContact O-N 2.91Å; D356-L359 HydrophobicContact CB-CD2 4.11Å
357T62.4Low66.6Low134 Ų134128.9 Ų128.982%0.82267%0.668SS**THydrogen-bonded Turntrans-78.518.2169.214.50000113.5
358R56.9Low68.8Low235 Ų235125 Ų12589%0.88765%0.653SS**THydrogen-bonded Turntrans-141.553.4176.5-149.4-176.6-175-166.51.1111.7D356 D360D356-R358 PolarHBondContact O-N 2.91Å; R358-D360 PolarHBondContact O-N 3.28Å
359L68.4Low71Confident50 Ų50121.9 Ų121.926%0.26264%0.636SS.*  trans-54132.4170.3-60.8175.9000109.7D356 M367D356-L359 HydrophobicContact CB-CD2 4.11Å; L359-M367 HydrophobicContact CD1-CE 3.86Å
360D80.2Confident73.3Confident91 Ų91118.5 Ų118.549%0.48762%0.616SS.*  trans-52138.9173.8178.858.2000110.1R358 T362 E363 Q364R358-D360 PolarHBondContact O-N 3.28Å; D360-T362 PolarHBondContact O-N 2.98Å; D360-T362 WeakPolarHBondContact OD2-CB 3.33Å; D360-T362 PolarHBondContact OD2-N 3.23Å; D360-T362 PolarHBondContact OD2-OG1 2.98Å; D360-E363 HydrophobicContact CB-CB 4.3Å; D360-E363 WeakPolarHBondContact O-CA 3.49Å; D360-E363 WeakPolarHBondContact O-CB 3.09Å; D360-E363 PolarHBondContact O-N 3.04Å; D360-Q364 PolarHBondContact O-N 3.45Å
361P84.7Confident75.7Confident94 Ų94120.7 Ų120.761%0.6160%0.602SS**Hα-helixtrans-51.3-31.3-179.6-31.237.4000114.4S365P361-S365 WeakPolarHBondContact O-CB 3.46Å; P361-S365 PolarHBondContact O-N 2.79Å; P361-S365 VanDerWaalsContact O-N 3.13Å; P361-S365 PolarHBondContact O-OG 3.25Å
362T89.4Confident78.1Confident103 Ų103120.9 Ų120.963%0.63259%0.592SS**Hα-helixtrans-69.3-43.5175.8-420000111.6D360 S365 R366D360-T362 PolarHBondContact O-N 2.98Å; D360-T362 WeakPolarHBondContact OD2-CB 3.33Å; D360-T362 PolarHBondContact OD2-N 3.23Å; D360-T362 PolarHBondContact OD2-OG1 2.98Å; T362-S365 WeakPolarHBondContact O-CB 3.37Å; T362-S365 PolarHBondContact O-N 3.24Å; T362-R366 PolarHBondContact O-N 3.27Å
363E88.9Confident80.3Confident95 Ų95122 Ų12244%0.44458%0.582SS.*Hα-helixtrans-68.2-43179-172.1176.1-168.200111.8D360 S365 R366 M367D360-E363 HydrophobicContact CB-CB 4.3Å; D360-E363 WeakPolarHBondContact O-CA 3.49Å; D360-E363 WeakPolarHBondContact O-CB 3.09Å; D360-E363 PolarHBondContact O-N 3.04Å; E363-S365 VanDerWaalsContact C-N 3.26Å; E363-S365 PolarHBondContact O-N 3.03Å; E363-R366 WeakPolarHBondContact O-CB 3.46Å; E363-R366 PolarHBondContact O-N 3.21Å; E363-M367 PolarHBondContact O-N 3.44Å
364Q89.8Confident82.5Confident84 Ų84116.5 Ų116.539%0.39356%0.558SS.*Hα-helixtrans-59.5-39.7174.3-168.4-178.364.700111.3D360 M367 R368D360-Q364 PolarHBondContact O-N 3.45Å; Q364-M367 PolarHBondContact O-N 3.37Å; Q364-R368 VanDerWaalsContact O-CG 3.31Å; Q364-R368 WeakPolarHBondContact O-CG 3.32Å; Q364-R368 PolarHBondContact O-N 2.91Å
365S90.8Very high84.6Confident69 Ų69116.2 Ų116.248%0.48355%0.546SS..Hα-helixtrans-66-43.8176.1-64.10000112.2P361 T362 E363 M367 R368 L369P361-S365 WeakPolarHBondContact O-CB 3.46Å; P361-S365 PolarHBondContact O-N 2.79Å; P361-S365 VanDerWaalsContact O-N 3.13Å; P361-S365 PolarHBondContact O-OG 3.25Å; T362-S365 WeakPolarHBondContact O-CB 3.37Å; T362-S365 PolarHBondContact O-N 3.24Å; E363-S365 VanDerWaalsContact C-N 3.26Å; E363-S365 PolarHBondContact O-N 3.03Å; S365-M367 VanDerWaalsContact C-N 3.34Å; S365-M367 PolarHBondContact O-N 2.88Å; S365-R368 PolarHBondContact O-N 2.75Å; S365-L369 PolarHBondContact O-N 3.49Å
366R93.6Very high86.7Confident198 Ų198112.6 Ų112.675%0.74754%0.536SS*.Hα-helixtrans-59-45.2174.5-176.7-174.6171.295.4-0.7111.3T362 E363 L369 E370T362-R366 PolarHBondContact O-N 3.27Å; E363-R366 WeakPolarHBondContact O-CB 3.46Å; E363-R366 PolarHBondContact O-N 3.21Å; R366-L369 PolarHBondContact O-N 2.81Å; R366-E370 PolarHBondContact O-N 3.43Å
367M91Very high88.8Confident75 Ų75113.6 Ų113.637%0.36953%0.53SS..Hα-helixtrans-64.5-43.2178.9-171.9-176.5-65.600112.1L359 E363 Q364 S365 L369 E370 R371L359-M367 HydrophobicContact CD1-CE 3.86Å; E363-M367 PolarHBondContact O-N 3.44Å; Q364-M367 PolarHBondContact O-N 3.37Å; S365-M367 VanDerWaalsContact C-N 3.34Å; S365-M367 PolarHBondContact O-N 2.88Å; M367-L369 VanDerWaalsContact C-N 3.31Å; M367-L369 PolarHBondContact O-N 2.94Å; M367-E370 PolarHBondContact O-N 2.89Å; M367-R371 WeakPolarHBondContact O-CG 3.36Å; M367-R371 PolarHBondContact O-N 2.82Å; M367-R371 PolarHBondContact SD-NH2 3.45Å; M367-R371 VanDerWaalsContact SD-NH2 3.42Å
368R94.6Very high90.5Very high138 Ų138110.7 Ų110.752%0.52151%0.509SS..Hα-helixtrans-61-40.5175.1-74.4173.3179170.62.5111.7Q364 S365 K372Q364-R368 VanDerWaalsContact O-CG 3.31Å; Q364-R368 WeakPolarHBondContact O-CG 3.32Å; Q364-R368 PolarHBondContact O-N 2.91Å; S365-R368 PolarHBondContact O-N 2.75Å; R368-K372 WeakPolarHBondContact O-CG 3.45Å; R368-K372 PolarHBondContact O-N 2.98Å
369L94.9Very high92.5Very high82 Ų82102.1 Ų102.143%0.42949%0.489SS..Hα-helixtrans-65.4-44.1176.9-179.661.2000111.8S365 R366 M367 R371 K372 R373S365-L369 PolarHBondContact O-N 3.49Å; R366-L369 PolarHBondContact O-N 2.81Å; M367-L369 VanDerWaalsContact C-N 3.31Å; M367-L369 PolarHBondContact O-N 2.94Å; L369-R371 PolarHBondContact O-N 3.36Å; L369-K372 WeakPolarHBondContact O-CB 3.41Å; L369-K372 PolarHBondContact O-N 3.42Å; L369-K372 VanDerWaalsContact O-N 3.16Å; L369-R373 HydrophobicContact CD1-CG 4.46Å; L369-R373 WeakPolarHBondContact O-CG 3.38Å; L369-R373 PolarHBondContact O-N 2.86Å
370E96.3Very high94Very high81 Ų81101.6 Ų101.638%0.37949%0.492SS..Hα-helixtrans-66.2-38.3179.2-16557-148.300111.7R366 M367 K372 R373 A374 R377R366-E370 PolarHBondContact O-N 3.43Å; M367-E370 PolarHBondContact O-N 2.89Å; E370-K372 PolarHBondContact O-N 3.19Å; E370-R373 PolarHBondContact O-N 2.81Å; E370-R373 IonicContact OE2-NH1 3.92Å; E370-A374 WeakPolarHBondContact O-CB 3.49Å; E370-A374 PolarHBondContact O-N 3.35Å; E370-R377 IonicContact OE1-CZ 3.93Å; E370-R377 IonicContact OE1-NH1 3.31Å; E370-R377 PolarHBondContact OE1-NH1 3.3Å; E370-R377 IonicContact OE1-NH2 3.73Å
371R96.8Very high94.8Very high150 Ų150105 Ų10557%0.56650%0.498SS*.Hα-helixtrans-60.6-41.9170.4-70.5178.5-174.9179.82.8112.3M367 L369 R375M367-R371 WeakPolarHBondContact O-CG 3.36Å; M367-R371 PolarHBondContact O-N 2.82Å; M367-R371 PolarHBondContact SD-NH2 3.45Å; M367-R371 VanDerWaalsContact SD-NH2 3.42Å; L369-R371 PolarHBondContact O-N 3.36Å; R371-R375 WeakPolarHBondContact O-CG 3.36Å; R371-R375 PolarHBondContact O-N 3.03Å
372K97.3Very high95.5Very high135 Ų135107.2 Ų107.259%0.58750%0.498SS*.Hα-helixtrans-62.5-42.5174.4-76.5179.7178.1-175.50111.4R368 L369 E370 N376R368-K372 WeakPolarHBondContact O-CG 3.45Å; R368-K372 PolarHBondContact O-N 2.98Å; L369-K372 WeakPolarHBondContact O-CB 3.41Å; L369-K372 PolarHBondContact O-N 3.42Å; L369-K372 VanDerWaalsContact O-N 3.16Å; E370-K372 PolarHBondContact O-N 3.19Å; K372-N376 WeakPolarHBondContact O-CB 3.49Å; K372-N376 PolarHBondContact O-N 3.18Å
373R97.4Very high95.9Very high117 Ų117106.3 Ų106.344%0.44250%0.495SS..Hα-helixtrans-64.8-45.8177-72.8175.1175.7179.9-0.3112.2L369 E370 R375 N376 R377L369-R373 HydrophobicContact CD1-CG 4.46Å; L369-R373 WeakPolarHBondContact O-CG 3.38Å; L369-R373 PolarHBondContact O-N 2.86Å; E370-R373 PolarHBondContact O-N 2.81Å; E370-R373 IonicContact OE2-NH1 3.92Å; R373-R375 PolarHBondContact O-N 3.37Å; R373-N376 PolarHBondContact O-N 2.92Å; R373-R377 WeakPolarHBondContact O-CG 3.46Å; R373-R377 PolarHBondContact O-N 3.36Å
374A97.7Very high96.4Very high40 Ų40110.1 Ų110.133%0.33151%0.505SS..Hα-helixtrans-58-48.8175.800000111.5E370 N376 R377 D378E370-A374 WeakPolarHBondContact O-CB 3.49Å; E370-A374 PolarHBondContact O-N 3.35Å; A374-N376 VanDerWaalsContact C-N 3.32Å; A374-N376 PolarHBondContact O-N 2.82Å; A374-R377 WeakPolarHBondContact O-CB 3.49Å; A374-R377 PolarHBondContact O-N 3.03Å; A374-D378 PolarHBondContact O-N 2.66Å
375R98Very high96.8Very high156 Ų156110.4 Ų110.459%0.58951%0.507SS*.Hα-helixtrans-60-38.9175.3-72.5-173.1-64.5-1363.1113.1R371 R373 D378 A379R371-R375 WeakPolarHBondContact O-CG 3.36Å; R371-R375 PolarHBondContact O-N 3.03Å; R373-R375 PolarHBondContact O-N 3.37Å; R375-D378 PolarHBondContact O-N 3.42Å; R375-A379 VanDerWaalsContact O-CB 3.29Å; R375-A379 WeakPolarHBondContact O-CB 3.35Å; R375-A379 PolarHBondContact O-N 3.29Å
376N98.5Very high97.2Very high113 Ų113115.9 Ų115.960%0.60452%0.517SS*.Hα-helixtrans-68.1-39.5176.8-175.6-92.3000112.2K372 R373 A374 D378 A379 A380K372-N376 WeakPolarHBondContact O-CB 3.49Å; K372-N376 PolarHBondContact O-N 3.18Å; R373-N376 PolarHBondContact O-N 2.92Å; A374-N376 VanDerWaalsContact C-N 3.32Å; A374-N376 PolarHBondContact O-N 2.82Å; N376-D378 VanDerWaalsContact C-N 3.32Å; N376-D378 PolarHBondContact O-N 3.45Å; N376-A379 PolarHBondContact O-N 3.45Å; N376-A380 WeakPolarHBondContact O-CB 3.38Å; N376-A380 PolarHBondContact O-N 3.48Å
377R98.3Very high97.4Very high146 Ų146113.2 Ų113.255%0.55151%0.511SS*.Hα-helixtrans-57-47.3172.2-70.3174.7-175.2145.54.6110.8E370 R373 A374 A380 R381E370-R377 IonicContact OE1-CZ 3.93Å; E370-R377 IonicContact OE1-NH1 3.31Å; E370-R377 PolarHBondContact OE1-NH1 3.3Å; E370-R377 IonicContact OE1-NH2 3.73Å; R373-R377 WeakPolarHBondContact O-CG 3.46Å; R373-R377 PolarHBondContact O-N 3.36Å; A374-R377 WeakPolarHBondContact O-CB 3.49Å; A374-R377 PolarHBondContact O-N 3.03Å; R377-A380 PolarHBondContact O-N 3.49Å; R377-R381 PolarHBondContact O-N 2.72Å
378D98.2Very high97.8Very high72 Ų72114 Ų11439%0.38552%0.515SS..Hα-helixtrans-67.6-39.9178.4-69.7-31.1000112.4A374 R375 N376 R381 K382A374-D378 PolarHBondContact O-N 2.66Å; R375-D378 PolarHBondContact O-N 3.42Å; N376-D378 VanDerWaalsContact C-N 3.32Å; N376-D378 PolarHBondContact O-N 3.45Å; D378-R381 PolarHBondContact O-N 2.8Å; D378-R381 IonicContact OD1-CZ 3.89Å; D378-R381 IonicContact OD1-NH1 2.96Å; D378-R381 PolarHBondContact OD1-NH1 3.1Å; D378-K382 WeakPolarHBondContact O-CB 2.97Å; D378-K382 WeakPolarHBondContact O-CG 3.28Å; D378-K382 PolarHBondContact O-N 2.82Å
379A98.4Very high98Very high56 Ų56114 Ų11446%0.46352%0.515SS..Hα-helixtrans-63.3-42.4175.200000111.9R375 N376 K382 C383R375-A379 VanDerWaalsContact O-CB 3.29Å; R375-A379 WeakPolarHBondContact O-CB 3.35Å; R375-A379 PolarHBondContact O-N 3.29Å; N376-A379 PolarHBondContact O-N 3.45Å; A379-K382 PolarHBondContact O-N 3.4Å; A379-C383 VanDerWaalsContact O-CB 3.27Å; A379-C383 WeakPolarHBondContact O-CB 3.45Å; A379-C383 PolarHBondContact O-N 3.05Å
380A98.5Very high98.1Very high39 Ų39115 Ų11532%0.32252%0.52SS..Hα-helixtrans-64.2-42175.700000111.6N376 R377 C383 R384N376-A380 WeakPolarHBondContact O-CB 3.38Å; N376-A380 PolarHBondContact O-N 3.48Å; R377-A380 PolarHBondContact O-N 3.49Å; A380-C383 PolarHBondContact O-N 3.5Å; A380-R384 WeakPolarHBondContact O-CG 3.47Å; A380-R384 PolarHBondContact O-N 3.31Å
381R98.5Very high98.2Very high162 Ų162114.7 Ų114.761%0.61152%0.52SS*.Hα-helixtrans-58.8-51.5172.9-173.6-168.5-69.3133.4-1.4110.9R377 D378 C383 R384 E385R377-R381 PolarHBondContact O-N 2.72Å; D378-R381 PolarHBondContact O-N 2.8Å; D378-R381 IonicContact OD1-CZ 3.89Å; D378-R381 IonicContact OD1-NH1 2.96Å; D378-R381 PolarHBondContact OD1-NH1 3.1Å; R381-C383 VanDerWaalsContact C-N 3.31Å; R381-C383 PolarHBondContact O-N 2.84Å; R381-R384 PolarHBondContact O-N 2.79Å; R381-E385 WeakPolarHBondContact O-CB 3.29Å; R381-E385 PolarHBondContact O-N 3.22Å
382K98.7Very high98.3Very high140 Ų140114.1 Ų114.161%0.60952%0.522SS*.Hα-helixtrans-61.1-37.6178.1-73.1-179.9-179.1-1760112.6D378 A379 E385 R386D378-K382 WeakPolarHBondContact O-CB 2.97Å; D378-K382 WeakPolarHBondContact O-CG 3.28Å; D378-K382 PolarHBondContact O-N 2.82Å; A379-K382 PolarHBondContact O-N 3.4Å; K382-E385 PolarHBondContact O-N 2.9Å; K382-R386 WeakPolarHBondContact O-CB 3.43Å; K382-R386 PolarHBondContact O-N 2.92Å
383C98.6Very high98.4Very high85 Ų85110.4 Ų110.457%0.57451%0.513SS*.Hα-helixtrans-63.4-49175.9-175.30000111.4A379 A380 R381 E385 R386 K387A379-C383 VanDerWaalsContact O-CB 3.27Å; A379-C383 WeakPolarHBondContact O-CB 3.45Å; A379-C383 PolarHBondContact O-N 3.05Å; A380-C383 PolarHBondContact O-N 3.5Å; R381-C383 VanDerWaalsContact C-N 3.31Å; R381-C383 PolarHBondContact O-N 2.84Å; C383-E385 VanDerWaalsContact C-N 3.34Å; C383-E385 PolarHBondContact O-N 3.21Å; C383-R386 PolarHBondContact O-N 2.84Å; C383-K387 PolarHBondContact O-N 3.45Å
384R98.6Very high98.4Very high175 Ų175109.2 Ų109.266%0.6652%0.515SS*.Hα-helixtrans-59.3-45.1174.7-70.3172.9-177.5178.5-0.2111.6A380 R381 R386 K387 I388A380-R384 WeakPolarHBondContact O-CG 3.47Å; A380-R384 PolarHBondContact O-N 3.31Å; R381-R384 PolarHBondContact O-N 2.79Å; R384-R386 PolarHBondContact O-N 3.45Å; R384-K387 WeakPolarHBondContact O-CB 3.32Å; R384-K387 PolarHBondContact O-N 3.37Å; R384-I388 WeakPolarHBondContact O-CG1 3.4Å; R384-I388 PolarHBondContact O-N 2.91Å
385E98.6Very high98.5Very high89 Ų89112.6 Ų112.642%0.41652%0.524SS..Hα-helixtrans-63.4-42179.6-161-165.5-166.600112R381 K382 C383 I388 R389R381-E385 WeakPolarHBondContact O-CB 3.29Å; R381-E385 PolarHBondContact O-N 3.22Å; K382-E385 PolarHBondContact O-N 2.9Å; C383-E385 VanDerWaalsContact C-N 3.34Å; C383-E385 PolarHBondContact O-N 3.21Å; E385-I388 PolarHBondContact O-N 2.99Å; E385-R389 WeakPolarHBondContact O-CG 3.4Å; E385-R389 PolarHBondContact O-N 3.02Å; E385-R389 IonicContact OE1-CZ 3.37Å; E385-R389 IonicContact OE1-NH1 3.5Å; E385-R389 IonicContact OE1-NH2 2.67Å; E385-R389 PolarHBondContact OE1-NH2 3.44Å; E385-R389 IonicContact OE2-CZ 3.54Å; E385-R389 IonicContact OE2-NH1 2.88Å; E385-R389 PolarHBondContact OE2-NH1 3.42Å; E385-R389 IonicContact OE2-NH2 3.33Å; E385-R389 PolarHBondContact OE2-NH2 3.34Å
386R98.5Very high98.5Very high184 Ų184112.5 Ų112.569%0.69453%0.528SS*.Hα-helixtrans-62.4-42.4173.6-172.8-178.2-67.1162-3.2111.6K382 C383 R384 I388 R389 L390K382-R386 WeakPolarHBondContact O-CB 3.43Å; K382-R386 PolarHBondContact O-N 2.92Å; C383-R386 PolarHBondContact O-N 2.84Å; R384-R386 PolarHBondContact O-N 3.45Å; R386-I388 PolarHBondContact O-N 2.98Å; R386-R389 PolarHBondContact O-N 2.71Å; R386-L390 WeakPolarHBondContact O-CB 3.34Å; R386-L390 PolarHBondContact O-N 3.2Å
387K98.6Very high98.5Very high143 Ų143110.5 Ų110.562%0.62252%0.517SS*.Hα-helixtrans-60.8-44176.2-173.1176.7-179.6179.30111.5C383 R384 L390 I391C383-K387 PolarHBondContact O-N 3.45Å; R384-K387 WeakPolarHBondContact O-CB 3.32Å; R384-K387 PolarHBondContact O-N 3.37Å; K387-L390 PolarHBondContact O-N 3.02Å; K387-I391 HydrophobicContact CG-CD1 4.14Å; K387-I391 WeakPolarHBondContact O-CG1 3.27Å; K387-I391 PolarHBondContact O-N 3.48Å
388I98.5Very high98.5Very high91 Ų91108.2 Ų108.247%0.46752%0.519SS..Hα-helixtrans-63.9-44.2177-66.6163.8000111.1R384 E385 R386 L390 I391 K392R384-I388 WeakPolarHBondContact O-CG1 3.4Å; R384-I388 PolarHBondContact O-N 2.91Å; E385-I388 PolarHBondContact O-N 2.99Å; R386-I388 PolarHBondContact O-N 2.98Å; I388-L390 VanDerWaalsContact C-N 3.31Å; I388-L390 PolarHBondContact O-N 3.01Å; I388-I391 PolarHBondContact O-N 2.98Å; I388-K392 HydrophobicContact CG2-CD 4.36Å; I388-K392 WeakPolarHBondContact O-CG 3.42Å; I388-K392 PolarHBondContact O-N 2.84Å
389R98.4Very high98.5Very high139 Ų139109.6 Ų109.653%0.52553%0.526SS..Hα-helixtrans-59.3-43.2175.3-73.6-176.4-174.6102-1.1112E385 R386 K392 S393E385-R389 WeakPolarHBondContact O-CG 3.4Å; E385-R389 PolarHBondContact O-N 3.02Å; E385-R389 IonicContact OE1-CZ 3.37Å; E385-R389 IonicContact OE1-NH1 3.5Å; E385-R389 IonicContact OE1-NH2 2.67Å; E385-R389 PolarHBondContact OE1-NH2 3.44Å; E385-R389 IonicContact OE2-CZ 3.54Å; E385-R389 IonicContact OE2-NH1 2.88Å; E385-R389 PolarHBondContact OE2-NH1 3.42Å; E385-R389 IonicContact OE2-NH2 3.33Å; E385-R389 PolarHBondContact OE2-NH2 3.34Å; R386-R389 PolarHBondContact O-N 2.71Å; R389-K392 PolarHBondContact O-N 3.34Å; R389-S393 PolarHBondContact O-N 3.26Å
390L98.4Very high98.5Very high101 Ų101112.4 Ų112.453%0.52953%0.529SS..Hα-helixtrans-62.1-47.3177.917960.5000111.3R386 K387 I388 K392 S393 L394R386-L390 WeakPolarHBondContact O-CB 3.34Å; R386-L390 PolarHBondContact O-N 3.2Å; K387-L390 PolarHBondContact O-N 3.02Å; I388-L390 VanDerWaalsContact C-N 3.31Å; I388-L390 PolarHBondContact O-N 3.01Å; L390-K392 VanDerWaalsContact C-N 3.34Å; L390-K392 PolarHBondContact O-N 3.16Å; L390-S393 WeakPolarHBondContact O-CB 3.39Å; L390-S393 PolarHBondContact O-N 3.21Å; L390-L394 HydrophobicContact CD1-CD1 4.16Å; L390-L394 HydrophobicContact CD1-CG 4.16Å; L390-L394 HydrophobicContact CG-CD1 4.04Å; L390-L394 HydrophobicContact CG-CG 4.46Å; L390-L394 WeakPolarHBondContact O-CG 3.33Å; L390-L394 PolarHBondContact O-N 3.45Å
391I98.4Very high98.5Very high75 Ų75114.9 Ų114.939%0.38554%0.537SS..Hα-helixtrans-55.9-49.5176.4-69.7165.5000110.5K387 I388 S393 L394 E395K387-I391 HydrophobicContact CG-CD1 4.14Å; K387-I391 WeakPolarHBondContact O-CG1 3.27Å; K387-I391 PolarHBondContact O-N 3.48Å; I388-I391 PolarHBondContact O-N 2.98Å; I391-S393 VanDerWaalsContact C-N 3.32Å; I391-S393 PolarHBondContact O-N 3.29Å; I391-L394 PolarHBondContact O-N 3.43Å; I391-E395 HydrophobicContact CG2-CG 4.35Å; I391-E395 WeakPolarHBondContact CG2-OE1 3.39Å; I391-E395 WeakPolarHBondContact O-CG 3.08Å; I391-E395 PolarHBondContact O-N 2.87Å
392K98.5Very high98.5Very high138 Ų138110.8 Ų110.860%0.653%0.532SS*.Hα-helixtrans-60.4-38.6178.1-71.3-178.9175.9-171.60113.3I388 R389 L390 K396I388-K392 HydrophobicContact CG2-CD 4.36Å; I388-K392 WeakPolarHBondContact O-CG 3.42Å; I388-K392 PolarHBondContact O-N 2.84Å; R389-K392 PolarHBondContact O-N 3.34Å; L390-K392 VanDerWaalsContact C-N 3.34Å; L390-K392 PolarHBondContact O-N 3.16Å; K392-K396 WeakPolarHBondContact O-CB 3.34Å; K392-K396 PolarHBondContact O-N 3.38Å; K392-K396 VanDerWaalsContact O-N 3.08Å
393S98.4Very high98.5Very high57 Ų57108.7 Ų108.740%0.39953%0.525SS..Hα-helixtrans-63.9-48.8175.4-166.30000110.6R389 L390 I391 E395 K396 D397R389-S393 PolarHBondContact O-N 3.26Å; L390-S393 WeakPolarHBondContact O-CB 3.39Å; L390-S393 PolarHBondContact O-N 3.21Å; I391-S393 VanDerWaalsContact C-N 3.32Å; I391-S393 PolarHBondContact O-N 3.29Å; S393-E395 VanDerWaalsContact C-N 3.33Å; S393-E395 PolarHBondContact O-N 3.43Å; S393-K396 WeakPolarHBondContact O-CB 3.41Å; S393-K396 PolarHBondContact O-N 3.47Å; S393-K396 VanDerWaalsContact O-N 3.16Å; S393-D397 PolarHBondContact O-N 3.32Å
394L98.6Very high98.5Very high93 Ų93107.8 Ų107.849%0.48751%0.512SS..Hα-helixtrans-62.8-39.5179.8-68.5173.1000112L390 I391 D397 V398L390-L394 HydrophobicContact CD1-CD1 4.16Å; L390-L394 HydrophobicContact CD1-CG 4.16Å; L390-L394 HydrophobicContact CG-CD1 4.04Å; L390-L394 HydrophobicContact CG-CG 4.46Å; L390-L394 WeakPolarHBondContact O-CG 3.33Å; L390-L394 PolarHBondContact O-N 3.45Å; I391-L394 PolarHBondContact O-N 3.43Å; L394-D397 PolarHBondContact O-N 2.89Å; L394-V398 WeakPolarHBondContact O-CB 3.44Å; L394-V398 WeakPolarHBondContact O-CG2 3.47Å; L394-V398 PolarHBondContact O-N 3.46Å
395E98.5Very high98.4Very high111 Ų111103 Ų10352%0.51950%0.499SS..Hα-helixtrans-61.1-44.8173.8-72.4169.5165.700111.6I391 S393 V398 I399I391-E395 HydrophobicContact CG2-CG 4.35Å; I391-E395 WeakPolarHBondContact CG2-OE1 3.39Å; I391-E395 WeakPolarHBondContact O-CG 3.08Å; I391-E395 PolarHBondContact O-N 2.87Å; S393-E395 VanDerWaalsContact C-N 3.33Å; S393-E395 PolarHBondContact O-N 3.43Å; E395-V398 PolarHBondContact O-N 3.39Å; E395-I399 VanDerWaalsContact O-CG1 3.31Å; E395-I399 WeakPolarHBondContact O-CG1 3.44Å; E395-I399 PolarHBondContact O-N 2.82Å; E395-I399 VanDerWaalsContact O-N 3.08Å
396K98.6Very high98.4Very high153 Ų153105.3 Ų105.367%0.66550%0.504SS*.Hα-helixtrans-61.5-45.2175.2-177.3-176.2176.2-177.70111.6K392 S393 I399 H400K392-K396 WeakPolarHBondContact O-CB 3.34Å; K392-K396 PolarHBondContact O-N 3.38Å; K392-K396 VanDerWaalsContact O-N 3.08Å; S393-K396 WeakPolarHBondContact O-CB 3.41Å; S393-K396 PolarHBondContact O-N 3.47Å; S393-K396 VanDerWaalsContact O-N 3.16Å; K396-I399 PolarHBondContact O-N 2.76Å; K396-H400 PolarHBondContact O-N 3.12Å
397D98.5Very high98.4Very high71 Ų7198.9 Ų98.938%0.3849%0.491SS..Hα-helixtrans-65.3-42.5-179-63.7-22.7000110.7S393 L394 I399 H400 L401S393-D397 PolarHBondContact O-N 3.32Å; L394-D397 PolarHBondContact O-N 2.89Å; D397-I399 VanDerWaalsContact C-N 3.33Å; D397-I399 PolarHBondContact O-N 3.28Å; D397-H400 PolarHBondContact O-N 3.03Å; D397-L401 HydrophobicContact CB-CD1 4.45Å; D397-L401 WeakPolarHBondContact O-CB 3.39Å; D397-L401 WeakPolarHBondContact O-CD1 3.46Å; D397-L401 PolarHBondContact O-N 3.35Å
398V98.7Very high98.4Very high98 Ų9896 Ų9659%0.59448%0.482SS*.Hα-helixtrans-59.5-42.9175.1167.20000111.5L394 E395 S402L394-V398 WeakPolarHBondContact O-CB 3.44Å; L394-V398 WeakPolarHBondContact O-CG2 3.47Å; L394-V398 PolarHBondContact O-N 3.46Å; E395-V398 PolarHBondContact O-N 3.39Å; V398-S402 WeakPolarHBondContact O-CB 3.39Å; V398-S402 PolarHBondContact O-N 3.46Å
399I98.3Very high98.4Very high102 Ų102100 Ų10052%0.52349%0.491SS..Hα-helixtrans-60.7-52.9175.1-67.6164.5000109.6E395 K396 D397 L401 S402 E403E395-I399 VanDerWaalsContact O-CG1 3.31Å; E395-I399 WeakPolarHBondContact O-CG1 3.44Å; E395-I399 PolarHBondContact O-N 2.82Å; E395-I399 VanDerWaalsContact O-N 3.08Å; K396-I399 PolarHBondContact O-N 2.76Å; D397-I399 VanDerWaalsContact C-N 3.33Å; D397-I399 PolarHBondContact O-N 3.28Å; I399-L401 PolarHBondContact O-N 3.45Å; I399-S402 WeakPolarHBondContact O-CB 3.27Å; I399-S402 PolarHBondContact O-N 3.33Å; I399-S402 VanDerWaalsContact O-N 3.14Å; I399-E403 HydrophobicContact CG2-CG 4.46Å; I399-E403 WeakPolarHBondContact O-CG 3.33Å; I399-E403 PolarHBondContact O-N 3.34Å
400H98.3Very high98.4Very high114 Ų11497.8 Ų97.853%0.52849%0.49SS..Hα-helixtrans-56.2-51179.7178.1-83.8000112.5K396 D397 S402 E403 E404K396-H400 PolarHBondContact O-N 3.12Å; D397-H400 PolarHBondContact O-N 3.03Å; H400-S402 VanDerWaalsContact C-N 3.28Å; H400-S402 PolarHBondContact O-N 3.13Å; H400-E403 PolarHBondContact O-N 3.17Å; H400-E404 IonicContact CE1-OE2 3.53Å; H400-E404 IonicContact ND1-OE2 3.87Å; H400-E404 WeakPolarHBondContact O-CB 3.4Å; H400-E404 PolarHBondContact O-N 3Å
401L98.4Very high98.4Very high92 Ų92101.6 Ų101.648%0.48250%0.497SS..Hα-helixtrans-61.1-35.5178.2-83.6147.3000112.2D397 I399 N405D397-L401 HydrophobicContact CB-CD1 4.45Å; D397-L401 WeakPolarHBondContact O-CB 3.39Å; D397-L401 WeakPolarHBondContact O-CD1 3.46Å; D397-L401 PolarHBondContact O-N 3.35Å; I399-L401 PolarHBondContact O-N 3.45Å; L401-N405 VanDerWaalsContact O-CB 3.26Å; L401-N405 WeakPolarHBondContact O-CB 3.31Å; L401-N405 PolarHBondContact O-N 3.29Å; L401-N405 PolarHBondContact O-ND2 2.9Å
402S98.2Very high98.4Very high75 Ų75102.4 Ų102.452%0.52450%0.502SS..Hα-helixtrans-67.5-43.7175.8-174.60000111.6V398 I399 H400 N405 R406V398-S402 WeakPolarHBondContact O-CB 3.39Å; V398-S402 PolarHBondContact O-N 3.46Å; I399-S402 WeakPolarHBondContact O-CB 3.27Å; I399-S402 PolarHBondContact O-N 3.33Å; I399-S402 VanDerWaalsContact O-N 3.14Å; H400-S402 VanDerWaalsContact C-N 3.28Å; H400-S402 PolarHBondContact O-N 3.13Å; S402-N405 PolarHBondContact O-N 2.94Å; S402-R406 WeakPolarHBondContact O-CB 3.48Å; S402-R406 PolarHBondContact O-N 2.84Å
403E98.3Very high98.3Very high96 Ų9698.7 Ų98.745%0.44949%0.493SS..Hα-helixtrans-66.5-42.3177.5-65.1-168.1139.200112.6I399 H400 R406 A407I399-E403 HydrophobicContact CG2-CG 4.46Å; I399-E403 WeakPolarHBondContact O-CG 3.33Å; I399-E403 PolarHBondContact O-N 3.34Å; H400-E403 PolarHBondContact O-N 3.17Å; E403-R406 WeakPolarHBondContact O-CB 3.4Å; E403-R406 PolarHBondContact O-N 2.95Å; E403-R406 IonicContact OE1-NH2 3.41Å; E403-R406 PolarHBondContact OE1-NH2 3.34Å; E403-A407 PolarHBondContact O-N 2.86Å
404E98.2Very high98.3Very high67 Ų67104.5 Ų104.531%0.31351%0.506SS..Hα-helixtrans-62.8-47.8175.1-172.4-176.8170.900111.1H400 R406 A407 L408H400-E404 IonicContact CE1-OE2 3.53Å; H400-E404 IonicContact ND1-OE2 3.87Å; H400-E404 WeakPolarHBondContact O-CB 3.4Å; H400-E404 PolarHBondContact O-N 3Å; E404-R406 VanDerWaalsContact C-N 3.29Å; E404-R406 PolarHBondContact O-N 3.2Å; E404-A407 WeakPolarHBondContact O-CB 3.17Å; E404-A407 PolarHBondContact O-N 3.47Å; E404-A407 VanDerWaalsContact O-N 3.1Å; E404-L408 HydrophobicContact CG-CD1 4.27Å; E404-L408 WeakPolarHBondContact O-CG 3.18Å; E404-L408 PolarHBondContact O-N 2.98Å
405N98Very high98.3Very high73 Ų73103 Ų10339%0.3950%0.503SS..Hα-helixtrans-59.3-41.1175.4-87.3-59000112L401 S402 L408 R409L401-N405 VanDerWaalsContact O-CB 3.26Å; L401-N405 WeakPolarHBondContact O-CB 3.31Å; L401-N405 PolarHBondContact O-N 3.29Å; L401-N405 PolarHBondContact O-ND2 2.9Å; S402-N405 PolarHBondContact O-N 2.94Å; N405-L408 PolarHBondContact O-N 3.36Å; N405-R409 WeakPolarHBondContact O-CB 3.49Å; N405-R409 VanDerWaalsContact O-CG 3.25Å; N405-R409 WeakPolarHBondContact O-CG 3.5Å; N405-R409 PolarHBondContact O-N 3.41Å
406R98.3Very high98.3Very high138 Ų138104.3 Ų104.352%0.52150%0.504SS..Hα-helixtrans-59.9-45.6173.9178.5-17864.6-159.5-2.5110.9S402 E403 E404 R409 N410S402-R406 WeakPolarHBondContact O-CB 3.48Å; S402-R406 PolarHBondContact O-N 2.84Å; E403-R406 WeakPolarHBondContact O-CB 3.4Å; E403-R406 PolarHBondContact O-N 2.95Å; E403-R406 IonicContact OE1-NH2 3.41Å; E403-R406 PolarHBondContact OE1-NH2 3.34Å; E404-R406 VanDerWaalsContact C-N 3.29Å; E404-R406 PolarHBondContact O-N 3.2Å; R406-R409 PolarHBondContact O-N 2.83Å; R406-N410 VanDerWaalsContact O-CG 3.23Å; R406-N410 PolarHBondContact O-N 3.33Å; R406-N410 PolarHBondContact O-ND2 2.89Å
407A98.4Very high98.2Very high49 Ų49102.2 Ų102.241%0.40550%0.498SS..Hα-helixtrans-64.3-43.5178.200000112.5E403 E404 N410 R411E403-A407 PolarHBondContact O-N 2.86Å; E404-A407 WeakPolarHBondContact O-CB 3.17Å; E404-A407 PolarHBondContact O-N 3.47Å; E404-A407 VanDerWaalsContact O-N 3.1Å; A407-N410 PolarHBondContact O-N 2.54Å; A407-R411 WeakPolarHBondContact O-CG 3.21Å; A407-R411 PolarHBondContact O-N 3.47Å
408L98.3Very high98.2Very high82 Ų82105 Ų10543%0.42951%0.509SS..Hα-helixtrans-63.6-42.9176.8-70.8174000111.9E404 N405 N410 R411 L412E404-L408 HydrophobicContact CG-CD1 4.27Å; E404-L408 WeakPolarHBondContact O-CG 3.18Å; E404-L408 PolarHBondContact O-N 2.98Å; N405-L408 PolarHBondContact O-N 3.36Å; L408-N410 VanDerWaalsContact C-N 3.33Å; L408-N410 PolarHBondContact O-N 2.93Å; L408-R411 PolarHBondContact O-N 2.96Å; L408-L412 WeakPolarHBondContact O-CB 3.43Å; L408-L412 PolarHBondContact O-N 3.36Å
409R98.1Very high98.1Very high176 Ų176103.7 Ų103.766%0.66450%0.501SS*.Hα-helixtrans-60.3-42.1174-74.7174.6-178.5158.61.7111.9N405 R406 L412 S413N405-R409 WeakPolarHBondContact O-CB 3.49Å; N405-R409 VanDerWaalsContact O-CG 3.25Å; N405-R409 WeakPolarHBondContact O-CG 3.5Å; N405-R409 PolarHBondContact O-N 3.41Å; R406-R409 PolarHBondContact O-N 2.83Å; R409-L412 PolarHBondContact O-N 3.08Å; R409-S413 WeakPolarHBondContact O-CB 3.4Å; R409-S413 PolarHBondContact O-N 3.03Å
410N98.4Very high98.1Very high93 Ų93103.7 Ų103.750%0.49750%0.499SS..Hα-helixtrans-63.5-42.5175.8-70.9-16.2000112R406 A407 L408 S413 R414R406-N410 VanDerWaalsContact O-CG 3.23Å; R406-N410 PolarHBondContact O-N 3.33Å; R406-N410 PolarHBondContact O-ND2 2.89Å; A407-N410 PolarHBondContact O-N 2.54Å; L408-N410 VanDerWaalsContact C-N 3.33Å; L408-N410 PolarHBondContact O-N 2.93Å; N410-S413 PolarHBondContact O-N 2.88Å; N410-R414 WeakPolarHBondContact O-CG 3.3Å; N410-R414 PolarHBondContact O-N 2.96Å
411R98.2Very high98Very high181 Ų181108 Ų10868%0.68351%0.51SS*.Hα-helixtrans-63.4-44.7175.6-72.4174.866.61781.2111.8A407 L408 S413 R414 S415A407-R411 WeakPolarHBondContact O-CG 3.21Å; A407-R411 PolarHBondContact O-N 3.47Å; L408-R411 PolarHBondContact O-N 2.96Å; R411-S413 VanDerWaalsContact C-N 3.35Å; R411-R414 PolarHBondContact O-N 2.83Å; R411-S415 WeakPolarHBondContact O-CB 3.38Å; R411-S415 PolarHBondContact O-N 2.9Å
412L98.4Very high98Very high92 Ų92108.8 Ų108.848%0.48252%0.515SS..Hα-helixtrans-61.8-43.5176.6-179.362.2000111.3L408 R409 S415 R416L408-L412 WeakPolarHBondContact O-CB 3.43Å; L408-L412 PolarHBondContact O-N 3.36Å; R409-L412 PolarHBondContact O-N 3.08Å; L412-S415 PolarHBondContact O-N 2.92Å; L412-R416 HydrophobicContact CD1-CG 4.37Å; L412-R416 WeakPolarHBondContact O-CB 3.31Å; L412-R416 VanDerWaalsContact O-CG 3.28Å; L412-R416 WeakPolarHBondContact O-CG 3.33Å; L412-R416 PolarHBondContact O-N 2.59Å
413S98.1Very high97.8Very high60 Ų60110.8 Ų110.842%0.4251%0.514SS..Hα-helixtrans-60.5-47.8176.4175.90000111.8R409 N410 R411 S415 R416 I417R409-S413 WeakPolarHBondContact O-CB 3.4Å; R409-S413 PolarHBondContact O-N 3.03Å; N410-S413 PolarHBondContact O-N 2.88Å; R411-S413 VanDerWaalsContact C-N 3.35Å; S413-S415 PolarHBondContact O-N 3.28Å; S413-R416 PolarHBondContact O-N 3.41Å; S413-I417 WeakPolarHBondContact O-CG1 3.38Å; S413-I417 PolarHBondContact O-N 3.35Å
414R98.1Very high97.7Very high179 Ų179111 Ų11168%0.67552%0.516SS*.Hα-helixtrans-57.8-49.1175.8-72.6174-177.9-114.91.4112.1N410 R411 R416 I417 E418N410-R414 WeakPolarHBondContact O-CG 3.3Å; N410-R414 PolarHBondContact O-N 2.96Å; R411-R414 PolarHBondContact O-N 2.83Å; R414-R416 VanDerWaalsContact C-N 3.34Å; R414-R416 PolarHBondContact O-N 3.48Å; R414-I417 PolarHBondContact O-N 3.37Å; R414-E418 WeakPolarHBondContact O-CG 3.32Å; R414-E418 PolarHBondContact O-N 2.91Å
415S97.8Very high97.4Very high61 Ų61113.5 Ų113.543%0.42753%0.526SS..Hα-helixtrans-63.2-39.2179.1-179.20000112.3R411 L412 S413 I417 E418 V419R411-S415 WeakPolarHBondContact O-CB 3.38Å; R411-S415 PolarHBondContact O-N 2.9Å; L412-S415 PolarHBondContact O-N 2.92Å; S413-S415 PolarHBondContact O-N 3.28Å; S415-I417 PolarHBondContact O-N 3.02Å; S415-E418 PolarHBondContact O-N 2.67Å; S415-V419 WeakPolarHBondContact O-CG2 3.49Å; S415-V419 PolarHBondContact O-N 3.31Å
416R98Very high97.1Very high139 Ų139113.5 Ų113.553%0.52553%0.529SS..Hα-helixtrans-61.3-43.2173.8-76.4178.7179.5-153.80.5112L412 S413 R414 V419 E420L412-R416 HydrophobicContact CD1-CG 4.37Å; L412-R416 WeakPolarHBondContact O-CB 3.31Å; L412-R416 VanDerWaalsContact O-CG 3.28Å; L412-R416 WeakPolarHBondContact O-CG 3.33Å; L412-R416 PolarHBondContact O-N 2.59Å; S413-R416 PolarHBondContact O-N 3.41Å; R414-R416 VanDerWaalsContact C-N 3.34Å; R414-R416 PolarHBondContact O-N 3.48Å; R416-V419 PolarHBondContact O-N 2.85Å; R416-E420 WeakPolarHBondContact O-CB 3.22Å; R416-E420 PolarHBondContact O-N 3.4Å
417I97.6Very high96.8Very high108 Ų108110.3 Ų110.355%0.55453%0.525SS*.Hα-helixtrans-63.9-42.1177-66.9163.9000110.9S413 R414 S415 E420 R421S413-I417 WeakPolarHBondContact O-CG1 3.38Å; S413-I417 PolarHBondContact O-N 3.35Å; R414-I417 PolarHBondContact O-N 3.37Å; S415-I417 PolarHBondContact O-N 3.02Å; I417-E420 PolarHBondContact O-N 2.81Å; I417-R421 VanDerWaalsContact O-CB 3.28Å; I417-R421 WeakPolarHBondContact O-CB 3.28Å; I417-R421 PolarHBondContact O-N 2.76Å
418E97.1Very high96.4Very high130 Ų130111 Ų11161%0.60752%0.522SS*.Hα-helixtrans-63-44.1176.6-73.4170.7-165.500112.1R414 S415 R421 L422R414-E418 WeakPolarHBondContact O-CG 3.32Å; R414-E418 PolarHBondContact O-N 2.91Å; S415-E418 PolarHBondContact O-N 2.67Å; E418-R421 PolarHBondContact O-N 2.95Å; E418-L422 WeakPolarHBondContact O-CB 3.49Å; E418-L422 PolarHBondContact O-N 2.72Å
419V98.1Very high96Very high71 Ų71110.2 Ų110.243%0.4352%0.515SS..Hα-helixtrans-62-44.6175.3169.70000110.8S415 R416 L422 K423S415-V419 WeakPolarHBondContact O-CG2 3.49Å; S415-V419 PolarHBondContact O-N 3.31Å; R416-V419 PolarHBondContact O-N 2.85Å; V419-L422 PolarHBondContact O-N 2.81Å; V419-K423 HydrophobicContact CG1-CD 4.17Å; V419-K423 HydrophobicContact CG1-CG 4.38Å; V419-K423 WeakPolarHBondContact O-CB 3.09Å; V419-K423 WeakPolarHBondContact O-CG 3.38Å; V419-K423 PolarHBondContact O-N 3.48Å
420E97.5Very high95.5Very high102 Ų102106.7 Ų106.748%0.47751%0.509SS..Hα-helixtrans-67.4-40.6179.9-164.355.9-143.100111.9R416 I417 L422 K423 M424R416-E420 WeakPolarHBondContact O-CB 3.22Å; R416-E420 PolarHBondContact O-N 3.4Å; I417-E420 PolarHBondContact O-N 2.81Å; E420-L422 VanDerWaalsContact C-N 3.3Å; E420-L422 PolarHBondContact O-N 3.49Å; E420-K423 PolarHBondContact O-N 3.43Å; E420-M424 WeakPolarHBondContact O-CB 3.34Å; E420-M424 PolarHBondContact O-N 2.74Å
421R96.9Very high95Very high203 Ų203108.3 Ų108.377%0.76652%0.518SS*.Hα-helixtrans-58.1-43.7171.4179.8-177.1175175.9-0111.4I417 E418 F425I417-R421 VanDerWaalsContact O-CB 3.28Å; I417-R421 WeakPolarHBondContact O-CB 3.28Å; I417-R421 PolarHBondContact O-N 2.76Å; E418-R421 PolarHBondContact O-N 2.95Å; R421-F425 WeakPolarHBondContact O-CB 3.16Å; R421-F425 PolarHBondContact O-N 3.31Å
422L96.7Very high94.3Very high109 Ų109107.2 Ų107.257%0.57152%0.518SS*.Hα-helixtrans-69.7-41.4179.5-175.261.5000111.8E418 V419 E420 M424 F425 V426E418-L422 WeakPolarHBondContact O-CB 3.49Å; E418-L422 PolarHBondContact O-N 2.72Å; V419-L422 PolarHBondContact O-N 2.81Å; E420-L422 VanDerWaalsContact C-N 3.3Å; E420-L422 PolarHBondContact O-N 3.49Å; L422-M424 VanDerWaalsContact C-N 3.35Å; L422-M424 PolarHBondContact O-N 2.74Å; L422-F425 HydrophobicContact CD1-CD1 4.46Å; L422-F425 WeakPolarHBondContact O-CB 3.29Å; L422-F425 PolarHBondContact O-N 3.29Å; L422-V426 WeakPolarHBondContact O-CG2 3.16Å; L422-V426 PolarHBondContact O-N 2.76Å
423K96.1Very high92.9Very high117 Ų117109.6 Ų109.651%0.50953%0.531SS..Hα-helixtrans-58-48.4172.7-76.4176.5177.4-179.10111.1V419 E420 F425 V426 V427V419-K423 HydrophobicContact CG1-CD 4.17Å; V419-K423 HydrophobicContact CG1-CG 4.38Å; V419-K423 WeakPolarHBondContact O-CB 3.09Å; V419-K423 WeakPolarHBondContact O-CG 3.38Å; V419-K423 PolarHBondContact O-N 3.48Å; E420-K423 PolarHBondContact O-N 3.43Å; K423-F425 VanDerWaalsContact C-N 3.28Å; K423-F425 PolarHBondContact O-N 3.24Å; K423-V426 PolarHBondContact O-N 3.3Å; K423-V426 VanDerWaalsContact O-N 3.16Å; K423-V427 WeakPolarHBondContact O-CG2 3.2Å; K423-V427 PolarHBondContact O-N 3.28Å
424M94.2Very high91.6Very high100 Ų100107.9 Ų107.949%0.49352%0.519SS..Hα-helixtrans-59.1-41.3176.4-171.258.963.600111.4E420 L422 V427 N428E420-M424 WeakPolarHBondContact O-CB 3.34Å; E420-M424 PolarHBondContact O-N 2.74Å; L422-M424 VanDerWaalsContact C-N 3.35Å; L422-M424 PolarHBondContact O-N 2.74Å; M424-V427 PolarHBondContact O-N 2.94Å; M424-N428 WeakPolarHBondContact O-CB 3.49Å; M424-N428 PolarHBondContact O-N 3.07Å; M424-N428 PolarHBondContact O-ND2 2.77Å
425F92.7Very high90.3Very high120 Ų120104.5 Ų104.553%0.52652%0.521SS..Hα-helixtrans-61.3-45.2174.9-178.8-97000112.3R421 L422 K423 N428 H429R421-F425 WeakPolarHBondContact O-CB 3.16Å; R421-F425 PolarHBondContact O-N 3.31Å; L422-F425 HydrophobicContact CD1-CD1 4.46Å; L422-F425 WeakPolarHBondContact O-CB 3.29Å; L422-F425 PolarHBondContact O-N 3.29Å; K423-F425 VanDerWaalsContact C-N 3.28Å; K423-F425 PolarHBondContact O-N 3.24Å; F425-N428 PolarHBondContact O-N 3.25Å; F425-H429 AromaticContact CD1-CD2 3.78Å; F425-H429 AromaticContact CE1-CD2 3.4Å; F425-H429 WeakPolarHBondContact CE1-CD2 3.17Å; F425-H429 AromaticContact CE1-NE2 3.52Å; F425-H429 AromaticContact CE2-CD2 3.73Å; F425-H429 AromaticContact CE2-NE2 3.4Å; F425-H429 WeakPolarHBondContact CE2-NE2 3.38Å; F425-H429 AromaticContact CZ-CD2 3.38Å; F425-H429 WeakPolarHBondContact CZ-CD2 3.36Å; F425-H429 AromaticContact CZ-NE2 3.01Å; F425-H429 WeakPolarHBondContact CZ-NE2 3.24Å; F425-H429 PolarHBondContact O-CD2 2.93Å; F425-H429 VanDerWaalsContact O-CD2 3.32Å; F425-H429 PolarHBondContact O-N 2.9Å; F425-H429 VanDerWaalsContact O-N 3.09Å
426V92.3Very high88.9Confident73 Ų73105 Ų10544%0.44253%0.528SS..Hα-helixtrans-63.8-45.8177.4172.80000111.5L422 K423 N428 H429 L430L422-V426 WeakPolarHBondContact O-CG2 3.16Å; L422-V426 PolarHBondContact O-N 2.76Å; K423-V426 PolarHBondContact O-N 3.3Å; K423-V426 VanDerWaalsContact O-N 3.16Å; V426-N428 PolarHBondContact O-N 3.45Å; V426-H429 PolarHBondContact O-N 3.29Å; V426-H429 VanDerWaalsContact O-N 3.12Å; V426-L430 HydrophobicContact CG1-CD1 4.19Å; V426-L430 WeakPolarHBondContact O-CG 3.37Å; V426-L430 PolarHBondContact O-N 2.83Å
427V91.2Very high87.2Confident72 Ų72103.1 Ų103.144%0.43653%0.528SS..Hα-helixtrans-59.8-47.1177.3172.50000110.8K423 M424 H429 L430 D431K423-V427 WeakPolarHBondContact O-CG2 3.2Å; K423-V427 PolarHBondContact O-N 3.28Å; M424-V427 PolarHBondContact O-N 2.94Å; V427-H429 PolarHBondContact O-N 3.5Å; V427-L430 PolarHBondContact O-N 3.13Å; V427-L430 VanDerWaalsContact O-N 3.07Å; V427-D431 PolarHBondContact O-N 3.04Å
428N90Very high85.5Confident64 Ų64102.6 Ų102.634%0.34253%0.534SS..Hα-helixtrans-60.1-30.6175.9-82.3-70.2000113.5M424 F425 V426 K432M424-N428 WeakPolarHBondContact O-CB 3.49Å; M424-N428 PolarHBondContact O-N 3.07Å; M424-N428 PolarHBondContact O-ND2 2.77Å; F425-N428 PolarHBondContact O-N 3.25Å; V426-N428 PolarHBondContact O-N 3.45Å; N428-K432 WeakPolarHBondContact O-CB 3.33Å; N428-K432 WeakPolarHBondContact O-CG 3.41Å; N428-K432 PolarHBondContact O-N 3.35Å
429H89.4Confident83.8Confident64 Ų64100.8 Ų100.830%0.29654%0.536SS..Hα-helixtrans-76.5-31.2175.9-93.4-76.6000113.1F425 V426 V427 C434 L437F425-H429 AromaticContact CD1-CD2 3.78Å; F425-H429 AromaticContact CE1-CD2 3.4Å; F425-H429 WeakPolarHBondContact CE1-CD2 3.17Å; F425-H429 AromaticContact CE1-NE2 3.52Å; F425-H429 AromaticContact CE2-CD2 3.73Å; F425-H429 AromaticContact CE2-NE2 3.4Å; F425-H429 WeakPolarHBondContact CE2-NE2 3.38Å; F425-H429 AromaticContact CZ-CD2 3.38Å; F425-H429 WeakPolarHBondContact CZ-CD2 3.36Å; F425-H429 AromaticContact CZ-NE2 3.01Å; F425-H429 WeakPolarHBondContact CZ-NE2 3.24Å; F425-H429 PolarHBondContact O-CD2 2.93Å; F425-H429 VanDerWaalsContact O-CD2 3.32Å; F425-H429 PolarHBondContact O-N 2.9Å; F425-H429 VanDerWaalsContact O-N 3.09Å; V426-H429 PolarHBondContact O-N 3.29Å; V426-H429 VanDerWaalsContact O-N 3.12Å; V427-H429 PolarHBondContact O-N 3.5Å; H429-C434 HydrophobicContact CB-CB 4.27Å; H429-C434 WeakPolarHBondContact ND1-CB 3.48Å; H429-C434 PolarHBondContact ND1-SG 3.03Å; H429-C434 WeakPolarHBondContact O-CB 3.07Å; H429-C434 PolarHBondContact O-N 3.46Å; H429-L437 HydrophobicContact CB-CD1 4.43Å
430L88.1Confident82Confident103 Ų103106.6 Ų106.654%0.53956%0.555SS.*Hα-helixtrans-72.1-42.5173.6-68.2170000111.1V426 V427 K432 D433 L437V426-L430 HydrophobicContact CG1-CD1 4.19Å; V426-L430 WeakPolarHBondContact O-CG 3.37Å; V426-L430 PolarHBondContact O-N 2.83Å; V427-L430 PolarHBondContact O-N 3.13Å; V427-L430 VanDerWaalsContact O-N 3.07Å; L430-K432 VanDerWaalsContact C-N 3.27Å; L430-K432 PolarHBondContact O-N 2.73Å; L430-D433 PolarHBondContact O-N 2.9Å; L430-L437 HydrophobicContact CD2-CD1 3.76Å; L430-L437 HydrophobicContact CG-CD1 4.41Å
431D88.1Confident79.9Confident126 Ų126108.2 Ų108.267%0.67457%0.572SS**Hα-helixtrans-68.9-23179.7-68.5-18.4000113.5V427V427-D431 PolarHBondContact O-N 3.04Å
432K82.9Confident77.2Confident158 Ų158106.9 Ų106.969%0.68760%0.604SS**THydrogen-bonded Turntrans-99.211.2-177.9-67.9-180-176.4-175.50114.1N428 L430 C434N428-K432 WeakPolarHBondContact O-CB 3.33Å; N428-K432 WeakPolarHBondContact O-CG 3.41Å; N428-K432 PolarHBondContact O-N 3.35Å; L430-K432 VanDerWaalsContact C-N 3.27Å; L430-K432 PolarHBondContact O-N 2.73Å; K432-C434 PolarHBondContact O-N 2.81Å
433D69.5Low76.2Confident142 Ų142106.8 Ų106.876%0.75961%0.606SS**THydrogen-bonded Turntrans44.558.6-175.4-71.2-40.7000112.2L430 P435L430-D433 PolarHBondContact O-N 2.9Å; D433-P435 WeakPolarHBondContact O-CD 3.14Å; D433-P435 VanDerWaalsContact O-N 3.16Å
434C70.9Confident75.2Confident25 Ų25106.2 Ų106.217%0.16961%0.611CS.*  trans-58.9123-179-173.20000110.4H429 K432 A436 L437H429-C434 HydrophobicContact CB-CB 4.27Å; H429-C434 WeakPolarHBondContact ND1-CB 3.48Å; H429-C434 PolarHBondContact ND1-SG 3.03Å; H429-C434 WeakPolarHBondContact O-CB 3.07Å; H429-C434 PolarHBondContact O-N 3.46Å; K432-C434 PolarHBondContact O-N 2.81Å; C434-A436 PolarHBondContact O-N 3.26Å; C434-L437 HydrophobicContact CB-CD1 4.47Å; C434-L437 PolarHBondContact O-N 2.73Å
435P71Confident74.1Confident108 Ų108106.6 Ų106.670%0.70162%0.617SS**Hα-helixtrans-60.9-20.9-175.721-31.8000113D433 L437 S439D433-P435 WeakPolarHBondContact O-CD 3.14Å; D433-P435 VanDerWaalsContact O-N 3.16Å; P435-L437 VanDerWaalsContact C-N 3.34Å; P435-L437 PolarHBondContact O-N 3.04Å; P435-S439 PolarHBondContact O-N 3.32Å
436A68.2Low73Confident71 Ų71105.8 Ų105.859%0.58762%0.623SS**Hα-helixtrans-66-32.1174.600000113.5C434 S439C434-A436 PolarHBondContact O-N 3.26Å; A436-S439 PolarHBondContact O-OG 3.11Å
437L62.7Low71.8Confident99 Ų99107.8 Ų107.852%0.51863%0.634SS.*Hα-helixtrans-85.5-30.6-179.8-64.8174.7000112.3H429 L430 C434 P435 S439H429-L437 HydrophobicContact CB-CD1 4.43Å; L430-L437 HydrophobicContact CD2-CD1 3.76Å; L430-L437 HydrophobicContact CG-CD1 4.41Å; C434-L437 HydrophobicContact CB-CD1 4.47Å; C434-L437 PolarHBondContact O-N 2.73Å; P435-L437 VanDerWaalsContact C-N 3.34Å; P435-L437 PolarHBondContact O-N 3.04Å; L437-S439 VanDerWaalsContact C-N 3.3Å; L437-S439 PolarHBondContact O-N 3.23Å
438S61.4Low70.5Confident98 Ų98110.2 Ų110.269%0.68565%0.647SS**Hα-helixtrans-71.3-22.1178.7-169.50000113.2K440S438-K440 VanDerWaalsContact C-N 3.34Å; S438-K440 PolarHBondContact O-N 3.08Å
439S61.3Low69.1Low92 Ų92113.5 Ų113.564%0.64367%0.669SS**THydrogen-bonded Turntrans-78.62.7-173.4710000117.2P435 A436 L437P435-S439 PolarHBondContact O-N 3.32Å; A436-S439 PolarHBondContact O-OG 3.11Å; L437-S439 VanDerWaalsContact C-N 3.3Å; L437-S439 PolarHBondContact O-N 3.23Å
440K59.9Low67.6Low192 Ų192117.3 Ų117.384%0.83570%0.697SS**THydrogen-bonded Turntrans-113.79.9-177.4-95.4-170.1177.9-173.20115.8S438S438-K440 VanDerWaalsContact C-N 3.34Å; S438-K440 PolarHBondContact O-N 3.08Å
441V53.5Low65.8Low137 Ų137118.5 Ų118.583%0.8371%0.711SS**  trans-124.272.3173.7-169.20000109
442A40.7Very low63.8Low174 Ų174117.8 Ų117.8100%1.43871%0.714SS**  trans-1500164.700000109.5

Retrieved 442 of 442 residues in 51.8 ms (Link to these results)