A0A087XJU2_POEFO Loading...

Syntaxin 19

AlphaFold DB , UniProt , Accession A0A087XJU2, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 300 aa.

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Site Residue pLDDT pLDDT confidence pLDDT10 pLDDT10 confidence SASA SASA [Ų] SASA10 SASA10 [Ų] RSA RSA unformatted RSA10 RSA10 unformatted Surface Surface10 (not used) Disorder (not used) Disorder Sec. str. Secondary structure Isomer Phi (φ) Psi (ψ) Omega (ω) Chi 1 (χ1) Chi 2 (χ2) Chi 3 (χ3) Chi 4 (χ4) Chi 5 (χ5) Tau (τ) Contacts (colored by PAE) Contact details
1M45.8Very low64.9Low243 Ų243143.1 Ų143.1100%1.19767%0.671SS**  0127.10-71.2-172.6-80.200106.5
2R48.2Very low64.8Low236 Ų236135.8 Ų135.889%0.89165%0.653SS**  trans-73.6130.3179.2-73-178.1-165164.35108.2R4R2-R4 PolarHBondContact O-N 2.94Å
3D58.4Low64.6Low139 Ų139136.3 Ų136.374%0.74365%0.654SS**  trans-66.9119.4172.9-167.9-11000108.2L5D3-L5 VanDerWaalsContact OD1-CB 3.25Å; D3-L5 WeakPolarHBondContact OD1-CB 3.2Å; D3-L5 PolarHBondContact OD1-N 2.8Å; D3-L5 VanDerWaalsContact OD1-N 3.12Å
4R76.6Confident63.8Low159 Ų159136.2 Ų136.260%0.665%0.652SS**  trans-109.713.2-177.8-53.4-16887.9177.14.9111.7R2 E6 E7 L8R2-R4 PolarHBondContact O-N 2.94Å; R4-E6 VanDerWaalsContact C-N 3.29Å; R4-E6 PolarHBondContact O-N 3.31Å; R4-E7 IonicContact CZ-OE2 2.6Å; R4-E7 IonicContact NE-OE2 3.86Å; R4-E7 PolarHBondContact NE-OE2 2.84Å; R4-E7 IonicContact NH2-OE1 2.81Å; R4-E7 IonicContact NH2-OE2 3.66Å; R4-E7 PolarHBondContact NH2-OE2 3.36Å; R4-E7 PolarHBondContact O-N 2.96Å; R4-L8 PolarHBondContact O-N 2.78Å
5L70.4Confident62.9Low102 Ų102136.1 Ų136.153%0.53466%0.656SS.*Hα-helixtrans-61.9-39.4-178.1-160.377.5000111.2D3 L8 H9D3-L5 VanDerWaalsContact OD1-CB 3.25Å; D3-L5 WeakPolarHBondContact OD1-CB 3.2Å; D3-L5 PolarHBondContact OD1-N 2.8Å; D3-L5 VanDerWaalsContact OD1-N 3.12Å; L5-L8 PolarHBondContact O-N 2.97Å; L5-H9 PolarHBondContact O-CD2 3.36Å; L5-H9 PolarHBondContact O-N 2.95Å
6E69.9Low61.8Low162 Ų162133.6 Ų133.676%0.75766%0.657SS**Hα-helixtrans-66.7-37176.8-80.5177.1150.300113.3R4 L8 H9 Q10R4-E6 VanDerWaalsContact C-N 3.29Å; R4-E6 PolarHBondContact O-N 3.31Å; E6-L8 VanDerWaalsContact C-N 3.31Å; E6-L8 PolarHBondContact O-N 3.16Å; E6-H9 PolarHBondContact O-N 3.33Å; E6-Q10 PolarHBondContact O-N 2.96Å
7E73.9Confident60.6Low97 Ų97129.4 Ų129.445%0.45366%0.656SS.*Hα-helixtrans-64-39.1175-76.6-177.4162.100111R4 Q10 T11R4-E7 IonicContact CZ-OE2 2.6Å; R4-E7 IonicContact NE-OE2 3.86Å; R4-E7 PolarHBondContact NE-OE2 2.84Å; R4-E7 IonicContact NH2-OE1 2.81Å; R4-E7 IonicContact NH2-OE2 3.66Å; R4-E7 PolarHBondContact NH2-OE2 3.36Å; R4-E7 PolarHBondContact O-N 2.96Å; E7-Q10 PolarHBondContact O-N 3.5Å; E7-T11 WeakPolarHBondContact O-CB 3.22Å; E7-T11 PolarHBondContact O-N 3.45Å; E7-T11 PolarHBondContact O-OG1 3.49Å
8L66.6Low59.2Low121 Ų121127.8 Ų127.863%0.63465%0.654SS**Hα-helixtrans-69.1-38177-73.8169.7000112.4R4 L5 E6 T11 A12R4-L8 PolarHBondContact O-N 2.78Å; L5-L8 PolarHBondContact O-N 2.97Å; E6-L8 VanDerWaalsContact C-N 3.31Å; E6-L8 PolarHBondContact O-N 3.16Å; L8-T11 PolarHBondContact O-N 3.42Å; L8-A12 WeakPolarHBondContact O-CB 3.29Å; L8-A12 PolarHBondContact O-N 3.44Å
9H66.8Low58.2Low122 Ų122128.7 Ų128.757%0.56567%0.666SS**Hα-helixtrans-66.3-39.6175.2-82.1-68.8000112.5L5 E6 Q13L5-H9 PolarHBondContact O-CD2 3.36Å; L5-H9 PolarHBondContact O-N 2.95Å; E6-H9 PolarHBondContact O-N 3.33Å; H9-Q13 PolarHBondContact O-N 3.38Å; H9-Q13 VanDerWaalsContact O-N 3.14Å
10Q68.6Low57Low123 Ų123125.8 Ų125.858%0.57566%0.662SS**Hα-helixtrans-66.6-43.6174.8-80.4178.3-200111.9E6 E7 A12 Q13 E14E6-Q10 PolarHBondContact O-N 2.96Å; E7-Q10 PolarHBondContact O-N 3.5Å; Q10-A12 VanDerWaalsContact C-N 3.3Å; Q10-A12 PolarHBondContact O-N 3.09Å; Q10-Q13 PolarHBondContact O-N 3.39Å; Q10-Q13 VanDerWaalsContact O-N 3.12Å; Q10-E14 WeakPolarHBondContact O-CG 3.42Å; Q10-E14 PolarHBondContact O-N 3.06Å
11T68.6Low56Low70 Ų70127.1 Ų127.143%0.42967%0.669SS.*Hα-helixtrans-64.2-37.4179.1-50.50000111.4E7 L8 E14 L15E7-T11 WeakPolarHBondContact O-CB 3.22Å; E7-T11 PolarHBondContact O-N 3.45Å; E7-T11 PolarHBondContact O-OG1 3.49Å; L8-T11 PolarHBondContact O-N 3.42Å; T11-E14 PolarHBondContact O-N 3.24Å; T11-L15 HydrophobicContact CG2-CD1 4.2Å; T11-L15 WeakPolarHBondContact O-CB 3.46Å; T11-L15 WeakPolarHBondContact O-CD1 3.45Å; T11-L15 WeakPolarHBondContact O-CG 3.41Å; T11-L15 PolarHBondContact O-N 3.37Å
12A63.9Low55.6Low56 Ų56121.1 Ų121.146%0.46365%0.649SS.*Hα-helixtrans-66.1-35.4174.700000112.9L8 Q10 S16L8-A12 WeakPolarHBondContact O-CB 3.29Å; L8-A12 PolarHBondContact O-N 3.44Å; Q10-A12 VanDerWaalsContact C-N 3.3Å; Q10-A12 PolarHBondContact O-N 3.09Å; A12-S16 PolarHBondContact O-N 2.8Å
13Q62.2Low54.6Low142 Ų142117.9 Ų117.966%0.66464%0.641SS**Hα-helixtrans-70.8-39.8174.5-83.3-178.7-18.400112.3H9 Q10 L15 S16 G17H9-Q13 PolarHBondContact O-N 3.38Å; H9-Q13 VanDerWaalsContact O-N 3.14Å; Q10-Q13 PolarHBondContact O-N 3.39Å; Q10-Q13 VanDerWaalsContact O-N 3.12Å; Q13-L15 PolarHBondContact O-N 3.47Å; Q13-S16 PolarHBondContact O-N 2.94Å; Q13-S16 VanDerWaalsContact O-N 3.13Å; Q13-S16 PolarHBondContact O-OG 2.98Å; Q13-G17 PolarHBondContact O-N 3.4Å; Q13-G17 VanDerWaalsContact O-N 3.15Å
14E53Low53.6Low135 Ų135117 Ų11763%0.63165%0.647SS**Hα-helixtrans-65.4-36.6176.9-72.8178.917200112.6Q10 T11 S16 G17 T18Q10-E14 WeakPolarHBondContact O-CG 3.42Å; Q10-E14 PolarHBondContact O-N 3.06Å; T11-E14 PolarHBondContact O-N 3.24Å; E14-S16 VanDerWaalsContact C-N 3.3Å; E14-S16 PolarHBondContact O-N 3.02Å; E14-G17 PolarHBondContact O-N 3.17Å; E14-T18 PolarHBondContact O-N 2.98Å; E14-T18 PolarHBondContact O-OG1 3.09Å
15L51.1Low51.6Low135 Ų135117.5 Ų117.571%0.70766%0.655SS**Hα-helixtrans-67.3-29.1172.1-76.1161.3000112.7T11 Q13T11-L15 HydrophobicContact CG2-CD1 4.2Å; T11-L15 WeakPolarHBondContact O-CB 3.46Å; T11-L15 WeakPolarHBondContact O-CD1 3.45Å; T11-L15 WeakPolarHBondContact O-CG 3.41Å; T11-L15 PolarHBondContact O-N 3.37Å; Q13-L15 PolarHBondContact O-N 3.47Å
16S44.9Very low50Low96 Ų96122.3 Ų122.367%0.67168%0.675SS**Hα-helixtrans-77.6-24.2175.983.70000113.5A12 Q13 E14A12-S16 PolarHBondContact O-N 2.8Å; Q13-S16 PolarHBondContact O-N 2.94Å; Q13-S16 VanDerWaalsContact O-N 3.13Å; Q13-S16 PolarHBondContact O-OG 2.98Å; E14-S16 VanDerWaalsContact C-N 3.3Å; E14-S16 PolarHBondContact O-N 3.02Å
17G40.6Very low48.2Very low62 Ų62118.3 Ų118.364%0.63968%0.677SS**Hα-helixtrans-88-13.4-178.900000114.8Q13 E14Q13-G17 PolarHBondContact O-N 3.4Å; Q13-G17 VanDerWaalsContact O-N 3.15Å; E14-G17 PolarHBondContact O-N 3.17Å
18T35.6Very low46.3Very low100 Ų100121 Ų12161%0.61370%0.695SS**  trans-107.575.1-173.6-42.50000111E14 A20E14-T18 PolarHBondContact O-N 2.98Å; E14-T18 PolarHBondContact O-OG1 3.09Å; T18-A20 HydrophobicContact CG2-CB 4.1Å; T18-A20 PolarHBondContact O-N 3.42Å
19T40.5Very low45Very low146 Ų146121.9 Ų121.990%0.89670%0.7SS**  trans-72.878.315645.70000108.8
20A34.8Very low43.5Very low70 Ų70124 Ų12458%0.57972%0.716SS**  trans-136.2104.4163.100000107.7T18 P22T18-A20 HydrophobicContact CG2-CB 4.1Å; T18-A20 PolarHBondContact O-N 3.42Å; A20-P22 WeakPolarHBondContact O-CD 3.33Å
21N36.7Very low42.2Very low153 Ų153125.5 Ų125.582%0.81873%0.728SS**  trans-56.8122.7171.6-118.61.8000109.4F23N21-F23 PolarHBondContact O-N 3.23Å
22P37.1Very low40.5Very low117 Ų117130.6 Ų130.676%0.7675%0.747SS**  trans-100.169.4167.634.7-22.9000108.5A20A20-P22 WeakPolarHBondContact O-CD 3.33Å
23F27.1Very low39.1Very low168 Ų168133.5 Ų133.574%0.73776%0.764SS**  trans-15890.6161.5-128.9-88.3000108.6N21N21-F23 PolarHBondContact O-N 3.23Å
24S36.4Very low37.7Very low122 Ų122133 Ų13385%0.85377%0.77SS**  trans-112.9103163.7-58.60000105.9
25E34.9Very low36.8Very low168 Ų168135.4 Ų135.479%0.78578%0.781SS**  trans-121127.1155.7-79.2-169.7156.400106.9
26E37.7Very low36.1Very low203 Ų203133.6 Ų133.695%0.94979%0.786SS**  trans-69.2141.8-177.8-64.6176.1148.300111.3
27G31.3Very low35.5Very low78 Ų78132.1 Ų132.180%0.80479%0.785SS**  trans-170.711916900000110.5
28D33.6Very low35.1Very low153 Ų153135.3 Ų135.382%0.81879%0.793SS**  trans-50.4147.6-168.9-99.5-22.2000118.5
29D40Very low35.3Very low140 Ų140137.7 Ų137.775%0.74980%0.8SS**  trans38.2109.1144.7-72.3-20.7000120.7
30D35.6Very low35.2Very low168 Ų168135.9 Ų135.990%0.89879%0.789SS**  -176.2144.9106.8-98.5-30.4000112
31D40.8Very low35.4Very low154 Ų154141.5 Ų141.582%0.82480%0.803SS**  trans-60116.6-171.3-175.832.7000115.9
32E33.5Very low35.2Very low176 Ų176141.9 Ų141.982%0.82280%0.8SS**  trans-162.8111.1141.8-129.3-174.918000110.4V34E32-V34 PolarHBondContact O-N 3.38Å
33S34.5Very low35.2Very low117 Ų117140.4 Ų140.482%0.81880%0.798SS**  trans-64.397.9-179.857.40000112.2E35S33-E35 PolarHBondContact O-N 3.3Å
34V32.8Very low35.8Very low131 Ų131137.8 Ų137.879%0.79480%0.796SS**  trans-81.8100.6170.7-161.80000108.3E32 A36E32-V34 PolarHBondContact O-N 3.38Å; V34-A36 PolarHBondContact O-N 3.35Å
35E34.1Very low35.9Very low187 Ų187138 Ų13887%0.87479%0.791SS**  trans-52.3111.6166.7-83.8-174.7153.900109S33 G37S33-E35 PolarHBondContact O-N 3.3Å; E35-G37 PolarHBondContact O-N 3.46Å
36A34.8Very low36.6Very low97 Ų97138.6 Ų138.680%0.80279%0.791SS**  trans-64.686.9172.400000108.6V34 T38V34-A36 PolarHBondContact O-N 3.35Å; A36-T38 PolarHBondContact O-N 2.94Å
37G32.6Very low37.1Very low64 Ų64137.6 Ų137.666%0.6679%0.787SS**  trans-58.4110.8169.700000108.5E35 I39E35-G37 PolarHBondContact O-N 3.46Å; G37-I39 PolarHBondContact O-N 3.36Å
38T33.3Very low38Very low129 Ų129141 Ų14179%0.79178%0.782SS**  trans-47.2107.7175.5-40.90000109.2A36 T40A36-T38 PolarHBondContact O-N 2.94Å; T38-T40 PolarHBondContact O-N 2.87Å
39I39.1Very low39.3Very low151 Ų151138.7 Ų138.777%0.77477%0.766SS**  trans-70.891.9170.3-58.4172.3000105.3G37 Q41G37-I39 PolarHBondContact O-N 3.36Å; I39-Q41 PolarHBondContact O-N 3.28Å
40T37.9Very low40.5Very low108 Ų108136.1 Ų136.166%0.66376%0.757SS**  trans-57.2104.2164.244.80000106.9T38 Q42T38-T40 PolarHBondContact O-N 2.87Å; T40-Q42 PolarHBondContact O-N 2.84Å
41Q39.1Very low42Very low187 Ų187131.7 Ų131.787%0.87474%0.736SS**  trans-65.888.2167.6-72.5-1804.400106.8I39 A43I39-Q41 PolarHBondContact O-N 3.28Å; Q41-A43 PolarHBondContact O-N 2.89Å; Q41-A43 VanDerWaalsContact O-N 3.11Å
42Q33.9Very low43.9Very low161 Ų161126 Ų12675%0.75271%0.705SS**  trans-67.1109.1167.3-161.280.927.100105.4T40 V44T40-Q42 PolarHBondContact O-N 2.84Å; Q42-V44 PolarHBondContact O-N 3.25Å
43A36Very low46.4Very low86 Ų86122.3 Ų122.371%0.71169%0.688SS**  trans-56.8106.4172.500000107.9Q41 V45Q41-A43 PolarHBondContact O-N 2.89Å; Q41-A43 VanDerWaalsContact O-N 3.11Å; A43-V45 VanDerWaalsContact C-N 3.35Å; A43-V45 PolarHBondContact O-N 2.87Å
44V40.9Very low49Very low114 Ų114122 Ų12269%0.69168%0.677SS**  trans-71.5100170.3-179.80000105.1Q42 F46Q42-V44 PolarHBondContact O-N 3.25Å; V44-F46 PolarHBondContact O-N 3.48Å
45V38.4Very low51.7Low125 Ų125115.8 Ų115.876%0.75864%0.639SS**  trans-62.5104.9164.9179.70000105.1A43 E47A43-V45 VanDerWaalsContact C-N 3.35Å; A43-V45 PolarHBondContact O-N 2.87Å; V45-E47 PolarHBondContact O-N 3.13Å
46F48.6Very low54.5Low181 Ų181109.9 Ų109.979%0.79461%0.614SS**  trans-60.1108.3167.6-85.2-94.7000106.3V44 E48V44-F46 PolarHBondContact O-N 3.48Å; F46-E48 PolarHBondContact O-N 2.87Å; F46-E48 VanDerWaalsContact O-N 3.16Å
47E47.4Very low57.3Low183 Ų183108.2 Ų108.286%0.85560%0.596SS**  trans-59.2118.9163.2-79.3-176.2152.700106.6V45 E49V45-E47 PolarHBondContact O-N 3.13Å; E47-E49 PolarHBondContact O-N 3.42Å
48E51.7Low60.2Low149 Ų149108.2 Ų108.270%0.69658%0.579SS**  trans-57.4107.5172.1-77.6-176.6146.400107.6F46 P50F46-E48 PolarHBondContact O-N 2.87Å; F46-E48 VanDerWaalsContact O-N 3.16Å; E48-P50 WeakPolarHBondContact O-CD 3.48Å; E48-P50 VanDerWaalsContact O-N 3.07Å
49E60Low63.1Low105 Ų105102.2 Ų102.249%0.49154%0.543SS..  trans-68.9107177.6-161.5173.3-151.800107.5E47 V51 I52E47-E49 PolarHBondContact O-N 3.42Å; E49-V51 PolarHBondContact O-N 2.88Å; E49-I52 HydrophobicContact CB-CD1 4.38Å; E49-I52 PolarHBondContact O-N 2.94Å
50P64.6Low65.8Low86 Ų8698.1 Ų98.156%0.55852%0.52SS*.Hα-helixtrans-63.5-19.4-165.424.9-34.6000112.7E48 N54E48-P50 WeakPolarHBondContact O-CD 3.48Å; E48-P50 VanDerWaalsContact O-N 3.07Å; P50-N54 PolarHBondContact O-N 3.29Å; P50-N54 PolarHBondContact O-ND2 2.9Å
51V69.1Low68.6Low75 Ų7597.9 Ų97.946%0.45551%0.511SS..Hα-helixtrans-65.1-39.3177.1-176.30000111.7E49 F55E49-V51 PolarHBondContact O-N 2.88Å; V51-F55 PolarHBondContact O-N 3.49Å
52I80.4Confident71.3Confident33 Ų3389 Ų8917%0.16947%0.47CS..Hα-helixtrans-73.7-38.9-179.4-62.7176.3000110.3E49 F55 L56 A134E49-I52 HydrophobicContact CB-CD1 4.38Å; E49-I52 PolarHBondContact O-N 2.94Å; I52-F55 WeakPolarHBondContact O-CB 3.1Å; I52-F55 PolarHBondContact O-N 2.97Å; I52-L56 HydrophobicContact CG2-CD1 3.82Å; I52-L56 HydrophobicContact CG2-CG 4.16Å; I52-L56 WeakPolarHBondContact O-CG 3.38Å; I52-L56 PolarHBondContact O-N 3.34Å; I52-A134 HydrophobicContact CD1-CB 3.79Å; I52-A134 HydrophobicContact CG1-CB 4.04Å
53Q85.8Confident74.3Confident99 Ų9987 Ų8746%0.46346%0.455SS..Hα-helixtrans-67.4-39.5-177.4-163.9159.615.100112.5L56 S57Q53-L56 PolarHBondContact O-N 3.42Å; Q53-S57 WeakPolarHBondContact O-CB 3.42Å; Q53-S57 PolarHBondContact O-N 2.79Å
54N88.1Confident77.3Confident111 Ų11186.5 Ų86.559%0.59444%0.441SS*.Hα-helixtrans-61.5-44.6173.3-71.1-25.2000111.6P50 S57 E58P50-N54 PolarHBondContact O-N 3.29Å; P50-N54 PolarHBondContact O-ND2 2.9Å; N54-S57 PolarHBondContact O-N 3.02Å; N54-E58 PolarHBondContact O-N 3.46Å
55F91Very high80Confident0 Ų084.2 Ų84.20%043%0.425CS..Hα-helixtrans-60.6-46.8176.2179-81.9000111.8V51 I52 S57 E58 A59 L117 Q120 Q138 Q141V51-F55 PolarHBondContact O-N 3.49Å; I52-F55 WeakPolarHBondContact O-CB 3.1Å; I52-F55 PolarHBondContact O-N 2.97Å; F55-S57 VanDerWaalsContact C-N 3.33Å; F55-S57 PolarHBondContact O-N 3Å; F55-E58 PolarHBondContact O-N 3.48Å; F55-A59 HydrophobicContact CE1-CB 4.4Å; F55-A59 WeakPolarHBondContact O-CB 3.47Å; F55-A59 PolarHBondContact O-N 2.98Å; F55-L117 HydrophobicContact CD2-CD2 3.81Å; F55-L117 HydrophobicContact CE2-CB 4Å; F55-L117 HydrophobicContact CE2-CD1 4.45Å; F55-L117 HydrophobicContact CE2-CD2 3.66Å; F55-L117 HydrophobicContact CE2-CG 4.25Å; F55-L117 HydrophobicContact CZ-CB 4.33Å; F55-L117 HydrophobicContact CZ-CD1 4.27Å; F55-L117 HydrophobicContact CZ-CD2 4.25Å; F55-Q120 HydrophobicContact CD2-CG 4.29Å; F55-Q138 HydrophobicContact CD1-CB 4.45Å; F55-Q138 HydrophobicContact CD1-CG 3.8Å; F55-Q138 HydrophobicContact CD2-CB 4.37Å; F55-Q138 HydrophobicContact CD2-CG 3.75Å; F55-Q138 HydrophobicContact CE1-CB 3.95Å; F55-Q138 HydrophobicContact CE1-CG 3.82Å; F55-Q138 HydrophobicContact CE2-CB 3.83Å; F55-Q138 HydrophobicContact CE2-CG 3.72Å; F55-Q138 HydrophobicContact CG-CG 3.79Å; F55-Q138 VanDerWaalsContact CZ-CA 3.5Å; F55-Q138 HydrophobicContact CZ-CB 3.61Å; F55-Q138 HydrophobicContact CZ-CG 3.78Å; F55-Q138 WeakPolarHBondContact CZ-O 3.48Å; F55-Q141 HydrophobicContact CE1-CB 3.9Å; F55-Q141 HydrophobicContact CE1-CG 4.42Å; F55-Q141 HydrophobicContact CZ-CB 4.5Å
56L91.7Very high82.8Confident64 Ų6478.3 Ų78.334%0.33539%0.389SS..Hα-helixtrans-66.4-35.1-179.6-70.4176.7000112.3I52 Q53 A59 Q60 I137 Q141I52-L56 HydrophobicContact CG2-CD1 3.82Å; I52-L56 HydrophobicContact CG2-CG 4.16Å; I52-L56 WeakPolarHBondContact O-CG 3.38Å; I52-L56 PolarHBondContact O-N 3.34Å; Q53-L56 PolarHBondContact O-N 3.42Å; L56-A59 PolarHBondContact O-N 3.02Å; L56-Q60 WeakPolarHBondContact O-CB 3.44Å; L56-Q60 PolarHBondContact O-N 3.32Å; L56-I137 HydrophobicContact CD2-CG2 4.05Å; L56-Q141 HydrophobicContact CD2-CG 4.05Å
57S93.6Very high85.1Confident62 Ų6272.1 Ų72.143%0.43437%0.368SS..Hα-helixtrans-64.7-43.6173.3-1750000111.7Q53 N54 F55 Q60 Q61Q53-S57 WeakPolarHBondContact O-CB 3.42Å; Q53-S57 PolarHBondContact O-N 2.79Å; N54-S57 PolarHBondContact O-N 3.02Å; F55-S57 VanDerWaalsContact C-N 3.33Å; F55-S57 PolarHBondContact O-N 3Å; S57-Q60 WeakPolarHBondContact O-CB 3.34Å; S57-Q60 PolarHBondContact O-N 3.2Å; S57-Q61 WeakPolarHBondContact O-CG 3.35Å; S57-Q61 PolarHBondContact O-N 2.73Å
58E94.1Very high87.4Confident63 Ų6366.6 Ų66.629%0.29435%0.347SS..Hα-helixtrans-65.9-43.3175.3-175.4170.8-173.800111.8N54 F55 Q60 Q61 I62 L117N54-E58 PolarHBondContact O-N 3.46Å; F55-E58 PolarHBondContact O-N 3.48Å; E58-Q60 VanDerWaalsContact C-N 3.26Å; E58-Q60 PolarHBondContact O-N 3.09Å; E58-Q61 PolarHBondContact O-N 2.97Å; E58-I62 HydrophobicContact CG-CD1 4.34Å; E58-I62 WeakPolarHBondContact O-CG1 3.49Å; E58-I62 PolarHBondContact O-N 2.84Å; E58-L117 HydrophobicContact CB-CD2 4.23Å; E58-L117 HydrophobicContact CG-CD2 3.94Å
59A93.8Very high89.5Confident4 Ų459.5 Ų59.53%0.03331%0.314CS..Hα-helixtrans-58.7-38.4174.400000112F55 L56 I62 R63 L117 L145F55-A59 HydrophobicContact CE1-CB 4.4Å; F55-A59 WeakPolarHBondContact O-CB 3.47Å; F55-A59 PolarHBondContact O-N 2.98Å; L56-A59 PolarHBondContact O-N 3.02Å; A59-I62 PolarHBondContact O-N 3.27Å; A59-R63 PolarHBondContact O-N 3.12Å; A59-L117 HydrophobicContact CB-CD1 4.16Å; A59-L145 HydrophobicContact CB-CD1 3.88Å
60Q95.5Very high91.3Very high64 Ų6456.1 Ų56.130%0.29930%0.298SS..Hα-helixtrans-61.7-49.4174178.458.545.400111.6L56 S57 E58 I62 R63 D64L56-Q60 WeakPolarHBondContact O-CB 3.44Å; L56-Q60 PolarHBondContact O-N 3.32Å; S57-Q60 WeakPolarHBondContact O-CB 3.34Å; S57-Q60 PolarHBondContact O-N 3.2Å; E58-Q60 VanDerWaalsContact C-N 3.26Å; E58-Q60 PolarHBondContact O-N 3.09Å; Q60-I62 VanDerWaalsContact C-N 3.34Å; Q60-I62 PolarHBondContact O-N 3.28Å; Q60-R63 VanDerWaalsContact NE2-NH2 3.15Å; Q60-R63 VanDerWaalsContact O-CB 3.3Å; Q60-R63 WeakPolarHBondContact O-CB 3.24Å; Q60-R63 PolarHBondContact O-N 2.86Å; Q60-R63 VanDerWaalsContact O-N 3.11Å; Q60-D64 PolarHBondContact NE2-OD1 2.92Å; Q60-D64 PolarHBondContact NE2-OD2 3.3Å; Q60-D64 PolarHBondContact O-N 3.39Å; Q60-D64 VanDerWaalsContact O-N 3.07Å
61Q96.9Very high92.7Very high104 Ų10455.2 Ų55.249%0.48629%0.291SS..Hα-helixtrans-61.1-42.9178.2-68.1173.412.600111.7S57 E58 R63 D64 D65 R113S57-Q61 WeakPolarHBondContact O-CG 3.35Å; S57-Q61 PolarHBondContact O-N 2.73Å; E58-Q61 PolarHBondContact O-N 2.97Å; Q61-R63 VanDerWaalsContact C-N 3.26Å; Q61-R63 PolarHBondContact O-N 2.81Å; Q61-D64 PolarHBondContact O-N 3.45Å; Q61-D65 PolarHBondContact O-N 3.06Å; Q61-R113 VanDerWaalsContact CB-NH2 3.34Å
62I96.8Very high93.9Very high0 Ų053.6 Ų53.60%028%0.278CS..Hα-helixtrans-59-40.6175-70.1177.2000110.8E58 A59 Q60 D64 D65 I66 L110 R113 L114 L117 L145E58-I62 HydrophobicContact CG-CD1 4.34Å; E58-I62 WeakPolarHBondContact O-CG1 3.49Å; E58-I62 PolarHBondContact O-N 2.84Å; A59-I62 PolarHBondContact O-N 3.27Å; Q60-I62 VanDerWaalsContact C-N 3.34Å; Q60-I62 PolarHBondContact O-N 3.28Å; I62-D64 VanDerWaalsContact C-N 3.34Å; I62-D64 PolarHBondContact O-N 2.77Å; I62-D65 PolarHBondContact O-N 3.5Å; I62-I66 HydrophobicContact CG2-CD1 3.71Å; I62-I66 HydrophobicContact CG2-CG1 4.29Å; I62-I66 WeakPolarHBondContact O-CB 3.45Å; I62-I66 VanDerWaalsContact O-CG1 3.24Å; I62-I66 WeakPolarHBondContact O-CG1 3.08Å; I62-I66 PolarHBondContact O-N 3.25Å; I62-L110 HydrophobicContact CG2-CD2 4.07Å; I62-R113 HydrophobicContact CD1-CB 3.73Å; I62-R113 HydrophobicContact CG1-CB 4.12Å; I62-R113 VanDerWaalsContact CG1-CZ 3.46Å; I62-L114 HydrophobicContact CG2-CD2 3.99Å; I62-L114 HydrophobicContact CG2-CG 4.22Å; I62-L117 HydrophobicContact CD1-CD1 3.49Å; I62-L117 VanDerWaalsContact CD1-CD1 3.49Å; I62-L117 HydrophobicContact CD1-CG 3.85Å; I62-L145 HydrophobicContact CB-CD1 4.32Å; I62-L145 HydrophobicContact CG2-CD1 4.05Å; I62-L145 HydrophobicContact CG2-CD2 4.5Å
63R96.9Very high94.5Very high118 Ų11852 Ų5245%0.44527%0.27SS..Hα-helixtrans-61.9-42.5177.6-166.3172.170-151.611.5112.4A59 Q60 Q61 I66 S67 L145A59-R63 PolarHBondContact O-N 3.12Å; Q60-R63 VanDerWaalsContact NE2-NH2 3.15Å; Q60-R63 VanDerWaalsContact O-CB 3.3Å; Q60-R63 WeakPolarHBondContact O-CB 3.24Å; Q60-R63 PolarHBondContact O-N 2.86Å; Q60-R63 VanDerWaalsContact O-N 3.11Å; Q61-R63 VanDerWaalsContact C-N 3.26Å; Q61-R63 PolarHBondContact O-N 2.81Å; R63-I66 PolarHBondContact O-N 3.47Å; R63-S67 PolarHBondContact O-N 2.96Å; R63-S67 PolarHBondContact O-OG 2.82Å; R63-L145 HydrophobicContact CB-CD2 3.69Å; R63-L145 HydrophobicContact CG-CD2 4Å
64D97.5Very high94.8Very high77 Ų7751.8 Ų51.841%0.41227%0.272SS..Hα-helixtrans-69.3-37.9-179.8-61.7-26.5000110.8Q60 Q61 I62 S67 T68Q60-D64 PolarHBondContact NE2-OD1 2.92Å; Q60-D64 PolarHBondContact NE2-OD2 3.3Å; Q60-D64 PolarHBondContact O-N 3.39Å; Q60-D64 VanDerWaalsContact O-N 3.07Å; Q61-D64 PolarHBondContact O-N 3.45Å; I62-D64 VanDerWaalsContact C-N 3.34Å; I62-D64 PolarHBondContact O-N 2.77Å; D64-S67 WeakPolarHBondContact O-CB 3.28Å; D64-S67 PolarHBondContact O-N 2.81Å; D64-T68 PolarHBondContact O-N 3.19Å; D64-T68 PolarHBondContact O-OG1 2.92Å
65D97.4Very high94.9Very high66 Ų6652.2 Ų52.235%0.35327%0.268SS..Hα-helixtrans-68.4-38.8174.4-70-27.9000112.4Q61 I62 S67 T68 L69 L110 R113Q61-D65 PolarHBondContact O-N 3.06Å; I62-D65 PolarHBondContact O-N 3.5Å; D65-S67 VanDerWaalsContact C-N 3.29Å; D65-S67 PolarHBondContact O-N 3.34Å; D65-T68 WeakPolarHBondContact O-CB 3.48Å; D65-T68 PolarHBondContact O-N 3.15Å; D65-L69 WeakPolarHBondContact O-CB 3.4Å; D65-L69 PolarHBondContact O-N 2.76Å; D65-L110 HydrophobicContact CB-CD2 3.63Å; D65-L110 HydrophobicContact CB-CG 4.38Å; D65-R113 IonicContact OD2-CZ 3.75Å; D65-R113 IonicContact OD2-NH1 2.71Å; D65-R113 PolarHBondContact OD2-NH1 3.41Å; D65-R113 IonicContact OD2-NH2 3.3Å
66I97Very high94.8Very high1 Ų152.2 Ų52.21%0.00527%0.268CS..Hα-helixtrans-61.6-39.4171.9-70.9165.8000110.7I62 R63 T68 L69 E70 L110 L145 R148 F149 V152I62-I66 HydrophobicContact CG2-CD1 3.71Å; I62-I66 HydrophobicContact CG2-CG1 4.29Å; I62-I66 WeakPolarHBondContact O-CB 3.45Å; I62-I66 VanDerWaalsContact O-CG1 3.24Å; I62-I66 WeakPolarHBondContact O-CG1 3.08Å; I62-I66 PolarHBondContact O-N 3.25Å; R63-I66 PolarHBondContact O-N 3.47Å; I66-T68 VanDerWaalsContact C-N 3.31Å; I66-L69 PolarHBondContact O-N 3.13Å; I66-E70 WeakPolarHBondContact O-CB 3.17Å; I66-E70 PolarHBondContact O-N 3.21Å; I66-L110 HydrophobicContact CG1-CD1 3.95Å; I66-L110 HydrophobicContact CG1-CD2 3.99Å; I66-L145 HydrophobicContact CD1-CB 4.29Å; I66-L145 HydrophobicContact CD1-CD2 4.32Å; I66-R148 HydrophobicContact CG2-CB 4.49Å; I66-R148 HydrophobicContact CG2-CG 3.74Å; I66-F149 HydrophobicContact CD1-CB 4.01Å; I66-F149 HydrophobicContact CG1-CB 4.36Å; I66-F149 HydrophobicContact CG1-CD2 4.48Å; I66-V152 HydrophobicContact CG2-CG2 4.16Å
67S97.5Very high94.6Very high51 Ų5150.5 Ų50.536%0.35726%0.261SS..Hα-helixtrans-67.4-35177.4-55.30000111.8R63 D64 D65 T71R63-S67 PolarHBondContact O-N 2.96Å; R63-S67 PolarHBondContact O-OG 2.82Å; D64-S67 WeakPolarHBondContact O-CB 3.28Å; D64-S67 PolarHBondContact O-N 2.81Å; D65-S67 VanDerWaalsContact C-N 3.29Å; D65-S67 PolarHBondContact O-N 3.34Å; S67-T71 PolarHBondContact O-N 3.35Å; S67-T71 VanDerWaalsContact O-N 3.11Å; S67-T71 PolarHBondContact O-OG1 2.9Å
68T96.6Very high94.2Very high67 Ų6752.9 Ų52.941%0.41127%0.266SS..Hα-helixtrans-66.5-48.2173.5-57.50000110.7D64 D65 I66 E70 T71 E72D64-T68 PolarHBondContact O-N 3.19Å; D64-T68 PolarHBondContact O-OG1 2.92Å; D65-T68 WeakPolarHBondContact O-CB 3.48Å; D65-T68 PolarHBondContact O-N 3.15Å; I66-T68 VanDerWaalsContact C-N 3.31Å; T68-E70 VanDerWaalsContact C-N 3.33Å; T68-E70 PolarHBondContact O-N 3.35Å; T68-T71 WeakPolarHBondContact O-CB 3.39Å; T68-T71 PolarHBondContact O-N 3.05Å; T68-T71 VanDerWaalsContact O-N 3.09Å; T68-E72 PolarHBondContact O-N 3.19Å
69L96.2Very high93.5Very high0 Ų051.9 Ų51.90%026%0.261CS..Hα-helixtrans-57.3-45.1174.9178.564.8000111.4D65 I66 T71 E72 V73 I103 Q106 A107 L110 F149 V152 M153D65-L69 WeakPolarHBondContact O-CB 3.4Å; D65-L69 PolarHBondContact O-N 2.76Å; I66-L69 PolarHBondContact O-N 3.13Å; L69-T71 VanDerWaalsContact C-N 3.27Å; L69-T71 PolarHBondContact O-N 3.06Å; L69-E72 PolarHBondContact O-N 2.72Å; L69-E72 VanDerWaalsContact O-N 3.1Å; L69-V73 HydrophobicContact CD1-CG2 4.33Å; L69-V73 HydrophobicContact CG-CG2 4.41Å; L69-V73 WeakPolarHBondContact O-CG2 3.33Å; L69-V73 PolarHBondContact O-N 3.18Å; L69-I103 HydrophobicContact CD1-CB 4.31Å; L69-I103 HydrophobicContact CD1-CG1 4.38Å; L69-I103 HydrophobicContact CD1-CG2 3.92Å; L69-Q106 HydrophobicContact CD1-CB 4.03Å; L69-A107 HydrophobicContact CD2-CB 4.47Å; L69-L110 HydrophobicContact CB-CD1 4.14Å; L69-L110 HydrophobicContact CD2-CD1 3.69Å; L69-F149 HydrophobicContact CD2-CD2 4.16Å; L69-F149 HydrophobicContact CD2-CE2 3.87Å; L69-V152 HydrophobicContact CD2-CG1 4.05Å; L69-V152 HydrophobicContact CG-CG1 3.92Å; L69-M153 HydrophobicContact CD2-SD 4Å
70E96.4Very high92.7Very high34 Ų3452 Ų5216%0.15926%0.261CS..Hα-helixtrans-57.2-43175.9-176.9175.4-160.900111.4I66 T68 E72 V73 L74 R148 V152I66-E70 WeakPolarHBondContact O-CB 3.17Å; I66-E70 PolarHBondContact O-N 3.21Å; T68-E70 VanDerWaalsContact C-N 3.33Å; T68-E70 PolarHBondContact O-N 3.35Å; E70-E72 VanDerWaalsContact C-N 3.32Å; E70-E72 PolarHBondContact O-N 3.27Å; E70-V73 PolarHBondContact O-N 2.87Å; E70-L74 HydrophobicContact CG-CD1 4.23Å; E70-L74 WeakPolarHBondContact O-CB 3.32Å; E70-L74 VanDerWaalsContact O-CG 3.27Å; E70-L74 WeakPolarHBondContact O-CG 3.43Å; E70-L74 PolarHBondContact O-N 2.9Å; E70-R148 IonicContact OE1-CZ 3.18Å; E70-R148 IonicContact OE1-NH1 2.95Å; E70-R148 IonicContact OE1-NH2 3.13Å; E70-R148 PolarHBondContact OE1-NH2 2.8Å; E70-R148 IonicContact OE2-CZ 3.89Å; E70-R148 IonicContact OE2-NE 2.82Å; E70-R148 IonicContact OE2-NH2 2.89Å; E70-R148 PolarHBondContact OE2-NH2 2.95Å; E70-V152 HydrophobicContact CB-CG1 4.22Å; E70-V152 HydrophobicContact CB-CG2 3.81Å; E70-V152 HydrophobicContact CG-CG2 4.08Å
71T95.2Very high91.7Very high66 Ų6655.3 Ų55.341%0.40527%0.274SS..Hα-helixtrans-63.6-38.7177-57.80000111.8S67 T68 L69 K75S67-T71 PolarHBondContact O-N 3.35Å; S67-T71 VanDerWaalsContact O-N 3.11Å; S67-T71 PolarHBondContact O-OG1 2.9Å; T68-T71 WeakPolarHBondContact O-CB 3.39Å; T68-T71 PolarHBondContact O-N 3.05Å; T68-T71 VanDerWaalsContact O-N 3.09Å; L69-T71 VanDerWaalsContact C-N 3.27Å; L69-T71 PolarHBondContact O-N 3.06Å; T71-K75 HydrophobicContact CG2-CD 4.44Å; T71-K75 VanDerWaalsContact O-CG 3.26Å; T71-K75 WeakPolarHBondContact O-CG 3.36Å; T71-K75 PolarHBondContact O-N 2.99Å
72E93.3Very high90.4Very high41 Ų4154.4 Ų54.419%0.19228%0.276CS..Hα-helixtrans-67.3-43.5175.1-68.2-171.9-17400112.4T68 L69 E70 L74 K75 F76 I103 Q106T68-E72 PolarHBondContact O-N 3.19Å; L69-E72 PolarHBondContact O-N 2.72Å; L69-E72 VanDerWaalsContact O-N 3.1Å; E70-E72 VanDerWaalsContact C-N 3.32Å; E70-E72 PolarHBondContact O-N 3.27Å; E72-L74 PolarHBondContact O-N 3.11Å; E72-K75 WeakPolarHBondContact O-CB 3.44Å; E72-K75 PolarHBondContact O-N 3.37Å; E72-F76 PolarHBondContact O-N 3.14Å; E72-I103 HydrophobicContact CB-CD1 4.27Å; E72-I103 HydrophobicContact CB-CG1 3.86Å; E72-Q106 PolarHBondContact OE1-NE2 2.97Å; E72-Q106 PolarHBondContact OE2-OE1 3.37Å
73V94Very high88.8Confident0 Ų054.9 Ų54.90%028%0.279CS..Hα-helixtrans-61.3-43.8175.4170.30000111L69 E70 K75 F76 C77 I103 V152 Q155 Y156L69-V73 HydrophobicContact CD1-CG2 4.33Å; L69-V73 HydrophobicContact CG-CG2 4.41Å; L69-V73 WeakPolarHBondContact O-CG2 3.33Å; L69-V73 PolarHBondContact O-N 3.18Å; E70-V73 PolarHBondContact O-N 2.87Å; V73-K75 VanDerWaalsContact C-N 3.34Å; V73-K75 PolarHBondContact O-N 3.43Å; V73-F76 WeakPolarHBondContact O-CB 3.37Å; V73-F76 PolarHBondContact O-N 3.12Å; V73-C77 PolarHBondContact O-N 2.7Å; V73-C77 PolarHBondContact O-SG 2.99Å; V73-C77 VanDerWaalsContact O-SG 3.34Å; V73-I103 HydrophobicContact CG2-CD1 4.24Å; V73-I103 HydrophobicContact CG2-CG2 4.25Å; V73-V152 HydrophobicContact CB-CG1 4.45Å; V73-V152 HydrophobicContact CG2-CG1 4.02Å; V73-Q155 HydrophobicContact CG1-CB 4.23Å; V73-Y156 HydrophobicContact CG1-CD2 4.39Å; V73-Y156 HydrophobicContact CG2-CD2 4.14Å; V73-Y156 HydrophobicContact CG2-CG 4.22Å
74L92.3Very high86.8Confident95 Ų9553 Ų5350%0.49728%0.28SS..Hα-helixtrans-62.7-41175.6-72.1173.9000112E70 E72 F76 C77 Q78E70-L74 HydrophobicContact CG-CD1 4.23Å; E70-L74 WeakPolarHBondContact O-CB 3.32Å; E70-L74 VanDerWaalsContact O-CG 3.27Å; E70-L74 WeakPolarHBondContact O-CG 3.43Å; E70-L74 PolarHBondContact O-N 2.9Å; E72-L74 PolarHBondContact O-N 3.11Å; L74-F76 VanDerWaalsContact C-N 3.35Å; L74-C77 PolarHBondContact O-N 3.49Å; L74-Q78 WeakPolarHBondContact O-CB 3.4Å; L74-Q78 PolarHBondContact O-N 2.95Å
75K89.2Confident84.8Confident119 Ų11954 Ų5452%0.51730%0.299SS..Hα-helixtrans-62.2-42.9173.9-75.2167.1-176.7166.70111.3T71 E72 V73 Q78 Q79T71-K75 HydrophobicContact CG2-CD 4.44Å; T71-K75 VanDerWaalsContact O-CG 3.26Å; T71-K75 WeakPolarHBondContact O-CG 3.36Å; T71-K75 PolarHBondContact O-N 2.99Å; E72-K75 WeakPolarHBondContact O-CB 3.44Å; E72-K75 PolarHBondContact O-N 3.37Å; V73-K75 VanDerWaalsContact C-N 3.34Å; V73-K75 PolarHBondContact O-N 3.43Å; K75-Q78 PolarHBondContact O-N 2.89Å; K75-Q79 VanDerWaalsContact O-CG 3.29Å; K75-Q79 WeakPolarHBondContact O-CG 3.43Å; K75-Q79 PolarHBondContact O-N 2.83Å
76F88.3Confident82.8Confident0 Ų052.6 Ų52.60%029%0.293CS..Hα-helixtrans-58.9-53.7175.2173.8-94.3000110.7E72 V73 L74 Q78 Q79 Q80 E96 I99 I103 Y156 L160 K163E72-F76 PolarHBondContact O-N 3.14Å; V73-F76 WeakPolarHBondContact O-CB 3.37Å; V73-F76 PolarHBondContact O-N 3.12Å; L74-F76 VanDerWaalsContact C-N 3.35Å; F76-Q78 VanDerWaalsContact C-N 3.28Å; F76-Q78 PolarHBondContact O-N 2.72Å; F76-Q79 WeakPolarHBondContact O-CB 3.5Å; F76-Q79 PolarHBondContact O-N 3.17Å; F76-Q79 VanDerWaalsContact O-N 3.1Å; F76-Q80 HydrophobicContact CD1-CG 4.33Å; F76-Q80 HydrophobicContact CE1-CG 3.94Å; F76-Q80 HydrophobicContact CE2-CG 4.49Å; F76-Q80 HydrophobicContact CZ-CG 4.02Å; F76-Q80 WeakPolarHBondContact O-CG 3.47Å; F76-Q80 PolarHBondContact O-N 3.14Å; F76-E96 HydrophobicContact CE2-CG 4.47Å; F76-I99 HydrophobicContact CB-CG2 4.25Å; F76-I99 HydrophobicContact CD2-CG2 4.5Å; F76-I103 HydrophobicContact CB-CD1 3.97Å; F76-I103 HydrophobicContact CG-CD1 4.44Å; F76-Y156 HydrophobicContact CD1-CD2 4.08Å; F76-Y156 AromaticContact CD1-CE2 3.94Å; F76-Y156 HydrophobicContact CD1-CE2 3.94Å; F76-Y156 HydrophobicContact CE1-CD2 4.35Å; F76-Y156 HydrophobicContact CE1-CE2 4.01Å; F76-Y156 HydrophobicContact CG-CE2 4.24Å; F76-Y156 HydrophobicContact CZ-CE2 4.37Å; F76-L160 HydrophobicContact CE1-CD2 4.21Å; F76-L160 HydrophobicContact CZ-CD2 3.83Å; F76-K163 HydrophobicContact CZ-CD 4.15Å
77C87.4Confident80.9Confident28 Ų2853.2 Ų53.219%0.18930%0.296CS..Hα-helixtrans-58.3-39.3178.5-690000112.4V73 L74 Q80 K81V73-C77 PolarHBondContact O-N 2.7Å; V73-C77 PolarHBondContact O-SG 2.99Å; V73-C77 VanDerWaalsContact O-SG 3.34Å; L74-C77 PolarHBondContact O-N 3.49Å; C77-Q80 PolarHBondContact O-N 3.33Å; C77-K81 WeakPolarHBondContact O-CG 3.36Å; C77-K81 PolarHBondContact O-N 3.02Å
78Q85.5Confident79Confident113 Ų11359.7 Ų59.753%0.52831%0.313SS..Hα-helixtrans-67.2-41.6176.3-173.561.820.400112.1L74 K75 F76 Q80 K81 T82L74-Q78 WeakPolarHBondContact O-CB 3.4Å; L74-Q78 PolarHBondContact O-N 2.95Å; K75-Q78 PolarHBondContact O-N 2.89Å; F76-Q78 VanDerWaalsContact C-N 3.28Å; F76-Q78 PolarHBondContact O-N 2.72Å; Q78-Q80 VanDerWaalsContact C-N 3.29Å; Q78-Q80 PolarHBondContact O-N 3.01Å; Q78-K81 WeakPolarHBondContact O-CB 3.21Å; Q78-K81 PolarHBondContact O-N 3.47Å; Q78-T82 PolarHBondContact O-N 3.12Å; Q78-T82 PolarHBondContact O-OG1 3.1Å
79Q80.4Confident77.3Confident41 Ų4164.1 Ų64.119%0.19232%0.322CS..Hα-helixtrans-60.7-40.7175-74.9172.9400111.4K75 F76 K81 T82 L83 I99K75-Q79 VanDerWaalsContact O-CG 3.29Å; K75-Q79 WeakPolarHBondContact O-CG 3.43Å; K75-Q79 PolarHBondContact O-N 2.83Å; F76-Q79 WeakPolarHBondContact O-CB 3.5Å; F76-Q79 PolarHBondContact O-N 3.17Å; F76-Q79 VanDerWaalsContact O-N 3.1Å; Q79-K81 VanDerWaalsContact C-N 3.27Å; Q79-K81 PolarHBondContact O-N 2.82Å; Q79-T82 PolarHBondContact O-N 2.71Å; Q79-L83 WeakPolarHBondContact O-CB 3.47Å; Q79-L83 WeakPolarHBondContact O-CD1 3.36Å; Q79-L83 WeakPolarHBondContact O-CG 3.22Å; Q79-L83 PolarHBondContact O-N 3.46Å; Q79-I99 VanDerWaalsContact NE2-CD1 3.28Å; Q79-I99 VanDerWaalsContact OE1-CD1 3.29Å
80Q76.7Confident75.4Confident6 Ų670.7 Ų70.73%0.02835%0.351CS..Hα-helixtrans-59.5-40.7176-60.9-44-34.700111.9F76 C77 Q78 T82 L83 E96 K163 R166F76-Q80 HydrophobicContact CD1-CG 4.33Å; F76-Q80 HydrophobicContact CE1-CG 3.94Å; F76-Q80 HydrophobicContact CE2-CG 4.49Å; F76-Q80 HydrophobicContact CZ-CG 4.02Å; F76-Q80 WeakPolarHBondContact O-CG 3.47Å; F76-Q80 PolarHBondContact O-N 3.14Å; C77-Q80 PolarHBondContact O-N 3.33Å; Q78-Q80 VanDerWaalsContact C-N 3.29Å; Q78-Q80 PolarHBondContact O-N 3.01Å; Q80-T82 VanDerWaalsContact C-N 3.32Å; Q80-T82 PolarHBondContact O-N 3.03Å; Q80-L83 PolarHBondContact O-N 3.34Å; Q80-E96 PolarHBondContact NE2-OE1 3.41Å; Q80-K163 HydrophobicContact CG-CB 4.06Å; Q80-K163 HydrophobicContact CG-CG 4.47Å; Q80-K163 VanDerWaalsContact OE1-CG 3.29Å; Q80-R166 PolarHBondContact O-NH1 3.44Å
81K73.8Confident73.7Confident134 Ų13473.6 Ų73.658%0.58338%0.375SS*.Hα-helixtrans-57.4-41.9177.2-71.5175.5-176.2176.80112.5C77 Q78 Q79 R166C77-K81 WeakPolarHBondContact O-CG 3.36Å; C77-K81 PolarHBondContact O-N 3.02Å; Q78-K81 WeakPolarHBondContact O-CB 3.21Å; Q78-K81 PolarHBondContact O-N 3.47Å; Q79-K81 VanDerWaalsContact C-N 3.27Å; Q79-K81 PolarHBondContact O-N 2.82Å; K81-R166 VanDerWaalsContact CA-NH1 3.28Å; K81-R166 PolarHBondContact O-NH1 2.94Å
82T70.9Confident72.2Confident86 Ų8672.5 Ų72.553%0.52837%0.368SS..Hα-helixtrans-85.2-16.9-177.91.60000114.8Q78 Q79 Q80 V84 A85 T86Q78-T82 PolarHBondContact O-N 3.12Å; Q78-T82 PolarHBondContact O-OG1 3.1Å; Q79-T82 PolarHBondContact O-N 2.71Å; Q80-T82 VanDerWaalsContact C-N 3.32Å; Q80-T82 PolarHBondContact O-N 3.03Å; T82-V84 PolarHBondContact O-N 3.01Å; T82-A85 PolarHBondContact O-N 2.89Å; T82-T86 PolarHBondContact O-OG1 3.18Å; T82-T86 VanDerWaalsContact O-OG1 3.13Å
83L61.6Low70.8Confident10 Ų1072 Ų725%0.05237%0.366CS..Hα-helixtrans-68.2-30.3-169.5-100.9161.8000114.6Q79 Q80 A85 T86 M87 V92 E96Q79-L83 WeakPolarHBondContact O-CB 3.47Å; Q79-L83 WeakPolarHBondContact O-CD1 3.36Å; Q79-L83 WeakPolarHBondContact O-CG 3.22Å; Q79-L83 PolarHBondContact O-N 3.46Å; Q80-L83 PolarHBondContact O-N 3.34Å; L83-A85 PolarHBondContact O-N 3.26Å; L83-A85 VanDerWaalsContact O-N 3.14Å; L83-T86 CarbonylContact O-C 3.43Å; L83-T86 PolarHBondContact O-N 3.31Å; L83-T86 PolarHBondContact O-OG1 3.27Å; L83-M87 WeakPolarHBondContact O-CG 3.24Å; L83-M87 PolarHBondContact O-N 3.41Å; L83-V92 HydrophobicContact CD2-CG1 3.68Å; L83-V92 HydrophobicContact CG-CG1 4.28Å; L83-E96 VanDerWaalsContact CD1-OE2 3.24Å; L83-E96 WeakPolarHBondContact CD1-OE2 3.5Å
84V56.1Low69.5Low78 Ų7880.1 Ų80.147%0.47340%0.401SS..THydrogen-bonded Turntrans-57.4-34.1179.7178.50000112.2T82 M87 R166T82-V84 PolarHBondContact O-N 3.01Å; V84-M87 HydrophobicContact CB-CE 4.05Å; V84-M87 HydrophobicContact CG1-CE 4.2Å; V84-M87 HydrophobicContact CG2-CE 3.75Å; V84-R166 HydrophobicContact CG2-CB 4.31Å; V84-R166 HydrophobicContact CG2-CG 3.99Å
85A55.5Low68.5Low97 Ų9781.8 Ų81.880%0.80240%0.404SS*.THydrogen-bonded Turntrans-81.2-13.4177.100000113.9T82 L83T82-A85 PolarHBondContact O-N 2.89Å; L83-A85 PolarHBondContact O-N 3.26Å; L83-A85 VanDerWaalsContact O-N 3.14Å
86T54Low67.7Low38 Ų3876.3 Ų76.323%0.23338%0.381CS..THydrogen-bonded Turntrans-125.67.2-171.1410000114.7T82 L83 R88 R89T82-T86 PolarHBondContact O-OG1 3.18Å; T82-T86 VanDerWaalsContact O-OG1 3.13Å; L83-T86 CarbonylContact O-C 3.43Å; L83-T86 PolarHBondContact O-N 3.31Å; L83-T86 PolarHBondContact O-OG1 3.27Å; T86-R88 PolarHBondContact O-N 3.27Å; T86-R89 WeakPolarHBondContact O-CB 3.43Å; T86-R89 PolarHBondContact O-N 2.6Å
87M57.6Low67.1Low14 Ų1480.3 Ų80.37%0.06941%0.408CS..THydrogen-bonded Turntrans-54.5-11.7-178.5-64.5-152-143.100115.2L83 V84 R89 F170 R220L83-M87 WeakPolarHBondContact O-CG 3.24Å; L83-M87 PolarHBondContact O-N 3.41Å; V84-M87 HydrophobicContact CB-CE 4.05Å; V84-M87 HydrophobicContact CG1-CE 4.2Å; V84-M87 HydrophobicContact CG2-CE 3.75Å; M87-R89 VanDerWaalsContact C-N 3.32Å; M87-F170 HydrophobicContact CB-CE2 4.17Å; M87-F170 HydrophobicContact CE-CB 3.89Å; M87-F170 HydrophobicContact CE-CD2 3.67Å; M87-F170 HydrophobicContact CE-CG 4.04Å; M87-F170 HydrophobicContact CG-CD2 4.48Å; M87-F170 HydrophobicContact SD-CB 4.14Å; M87-F170 HydrophobicContact SD-CD1 4.47Å; M87-F170 HydrophobicContact SD-CD2 3.51Å; M87-F170 VanDerWaalsContact SD-CD2 3.51Å; M87-F170 HydrophobicContact SD-CE2 3.99Å; M87-F170 HydrophobicContact SD-CG 3.78Å; M87-R220 PolarHBondContact O-NH2 2.91Å
88R58.5Low66.9Low187 Ų18781.4 Ų81.471%0.70642%0.416SS*.THydrogen-bonded Turntrans-81.9-1.3172.5-65.6-176.3175.7166.12.3114.6T86 E216T86-R88 PolarHBondContact O-N 3.27Å; R88-E216 IonicContact NE-OE1 3.99Å; R88-E216 IonicContact NE-OE2 3.9Å
89R61.1Low66.9Low160 Ų16077.2 Ų77.260%0.60440%0.397SS*.  trans-105.5103.6-173.2-64.4-174.3-179.1-1751.2112.9T86 M87 S91 V92T86-R89 WeakPolarHBondContact O-CB 3.43Å; T86-R89 PolarHBondContact O-N 2.6Å; M87-R89 VanDerWaalsContact C-N 3.32Å; R89-S91 VanDerWaalsContact C-N 3.29Å; R89-S91 PolarHBondContact O-N 3.29Å; R89-V92 HydrophobicContact CB-CG2 3.93Å; R89-V92 PolarHBondContact O-N 2.92Å; R89-V92 VanDerWaalsContact O-N 3.16Å
90F56.2Low67.1Low138 Ų13875.9 Ų75.961%0.60539%0.392SS*.Hα-helixtrans-54.1-34.5177.5-75.8-86.1000115.4V92 M93 K94F90-V92 VanDerWaalsContact C-N 3.3Å; F90-V92 PolarHBondContact O-N 3.49Å; F90-M93 PolarHBondContact O-N 3.2Å; F90-K94 PolarHBondContact O-N 3.35Å
91S59.2Low67.6Low95 Ų9582.8 Ų82.866%0.66442%0.418SS*.Hα-helixtrans-67.3-30-17957.90000113.3R89 K95R89-S91 VanDerWaalsContact C-N 3.29Å; R89-S91 PolarHBondContact O-N 3.29Å; S91-K95 PolarHBondContact O-N 2.92Å
92V64.4Low68.4Low43 Ų4379.2 Ų79.226%0.26141%0.405SS..Hα-helixtrans-70.9-41.8178-176.60000109.9L83 R89 F90 K94 K95 E96L83-V92 HydrophobicContact CD2-CG1 3.68Å; L83-V92 HydrophobicContact CG-CG1 4.28Å; R89-V92 HydrophobicContact CB-CG2 3.93Å; R89-V92 PolarHBondContact O-N 2.92Å; R89-V92 VanDerWaalsContact O-N 3.16Å; F90-V92 VanDerWaalsContact C-N 3.3Å; F90-V92 PolarHBondContact O-N 3.49Å; V92-K94 PolarHBondContact O-N 3.28Å; V92-K95 PolarHBondContact O-N 3.35Å; V92-E96 WeakPolarHBondContact O-CB 3.16Å; V92-E96 PolarHBondContact O-N 3.49Å
93M64Low69.4Low30 Ų3075.1 Ų75.115%0.14838%0.38CS..Hα-helixtrans-62.8-41.7178.8-68.7178.853.700113.8F90 K95 E96 S97 Q219 R220 E223F90-M93 PolarHBondContact O-N 3.2Å; M93-K95 VanDerWaalsContact C-N 3.33Å; M93-K95 PolarHBondContact O-N 3.13Å; M93-E96 WeakPolarHBondContact O-CB 3.36Å; M93-E96 PolarHBondContact O-N 2.97Å; M93-S97 PolarHBondContact O-N 2.92Å; M93-Q219 HydrophobicContact CE-CG 3.6Å; M93-Q219 VanDerWaalsContact SD-CD 3.58Å; M93-Q219 HydrophobicContact SD-CG 4.19Å; M93-Q219 PolarHBondContact SD-NE2 3.12Å; M93-R220 PolarHBondContact SD-NH2 2.97Å; M93-E223 HydrophobicContact CE-CG 4Å; M93-E223 WeakPolarHBondContact CE-OE1 3.26Å
94K67.4Low70.7Confident171 Ų17177.9 Ų77.974%0.74339%0.392SS*.Hα-helixtrans-64.3-40178.9-172.1176-179.9178.70111.7F90 V92 E96 S97 S98F90-K94 PolarHBondContact O-N 3.35Å; V92-K94 PolarHBondContact O-N 3.28Å; K94-E96 VanDerWaalsContact C-N 3.31Å; K94-S97 PolarHBondContact O-N 3.06Å; K94-S98 PolarHBondContact O-N 2.98Å
95K70.4Confident72.4Confident129 Ų12977.7 Ų77.756%0.56139%0.387SS*.Hα-helixtrans-66.9-34.4176.3-176.4176.6179.8177.60112.1S91 V92 M93 S98 I99S91-K95 PolarHBondContact O-N 2.92Å; V92-K95 PolarHBondContact O-N 3.35Å; M93-K95 VanDerWaalsContact C-N 3.33Å; M93-K95 PolarHBondContact O-N 3.13Å; K95-S98 PolarHBondContact O-OG 3.45Å; K95-I99 HydrophobicContact CG-CD1 4.22Å; K95-I99 WeakPolarHBondContact O-CD1 3.39Å; K95-I99 VanDerWaalsContact O-CG1 3.32Å; K95-I99 WeakPolarHBondContact O-CG1 3.34Å; K95-I99 PolarHBondContact O-N 2.96Å
96E72.9Confident74.3Confident5 Ų575.7 Ų75.72%0.02336%0.361CS..Hα-helixtrans-70.4-39.8177.9-167.3-169.3158.100112.4F76 Q80 L83 V92 M93 K94 S98 I99 T100 K163F76-E96 HydrophobicContact CE2-CG 4.47Å; Q80-E96 PolarHBondContact NE2-OE1 3.41Å; L83-E96 VanDerWaalsContact CD1-OE2 3.24Å; L83-E96 WeakPolarHBondContact CD1-OE2 3.5Å; V92-E96 WeakPolarHBondContact O-CB 3.16Å; V92-E96 PolarHBondContact O-N 3.49Å; M93-E96 WeakPolarHBondContact O-CB 3.36Å; M93-E96 PolarHBondContact O-N 2.97Å; K94-E96 VanDerWaalsContact C-N 3.31Å; E96-S98 VanDerWaalsContact C-N 3.32Å; E96-S98 PolarHBondContact O-N 3.45Å; E96-I99 PolarHBondContact O-N 3.41Å; E96-T100 PolarHBondContact O-N 3.35Å; E96-T100 PolarHBondContact O-OG1 3.48Å; E96-K163 WeakPolarHBondContact OE1-CD 3.48Å; E96-K163 WeakPolarHBondContact OE1-CE 3.38Å; E96-K163 IonicContact OE1-NZ 2.6Å; E96-K163 PolarHBondContact OE1-NZ 3.37Å
97S75.4Confident76.1Confident83 Ų8374 Ų7458%0.5835%0.351SS*.Hα-helixtrans-60.1-40.3174.5176.10000112.1M93 K94 R101M93-S97 PolarHBondContact O-N 2.92Å; K94-S97 PolarHBondContact O-N 3.06Å; S97-R101 PolarHBondContact O-N 2.92Å
98S82.6Confident77.7Confident51 Ų5176.7 Ų76.736%0.35736%0.364SS..Hα-helixtrans-66-43.8175.6580000112.2K94 K95 E96 T100 R101 D102K94-S98 PolarHBondContact O-N 2.98Å; K95-S98 PolarHBondContact O-OG 3.45Å; E96-S98 VanDerWaalsContact C-N 3.32Å; E96-S98 PolarHBondContact O-N 3.45Å; S98-T100 VanDerWaalsContact C-N 3.33Å; S98-T100 PolarHBondContact O-N 2.99Å; S98-R101 WeakPolarHBondContact O-CB 3.32Å; S98-R101 PolarHBondContact O-N 3.31Å; S98-R101 VanDerWaalsContact O-N 3.15Å; S98-D102 PolarHBondContact O-N 3.27Å
99I85.8Confident79.4Confident26 Ų2670.1 Ų70.113%0.13335%0.346CS..Hα-helixtrans-60.6-43.3178.9-68.6164.2000111.2F76 Q79 K95 E96 R101 D102 I103F76-I99 HydrophobicContact CB-CG2 4.25Å; F76-I99 HydrophobicContact CD2-CG2 4.5Å; Q79-I99 VanDerWaalsContact NE2-CD1 3.28Å; Q79-I99 VanDerWaalsContact OE1-CD1 3.29Å; K95-I99 HydrophobicContact CG-CD1 4.22Å; K95-I99 WeakPolarHBondContact O-CD1 3.39Å; K95-I99 VanDerWaalsContact O-CG1 3.32Å; K95-I99 WeakPolarHBondContact O-CG1 3.34Å; K95-I99 PolarHBondContact O-N 2.96Å; E96-I99 PolarHBondContact O-N 3.41Å; I99-R101 VanDerWaalsContact C-N 3.3Å; I99-R101 PolarHBondContact O-N 3.03Å; I99-D102 PolarHBondContact O-N 2.94Å; I99-I103 HydrophobicContact CG2-CD1 3.75Å; I99-I103 HydrophobicContact CG2-CG1 4.34Å; I99-I103 WeakPolarHBondContact O-CB 3.4Å; I99-I103 VanDerWaalsContact O-CG1 3.3Å; I99-I103 WeakPolarHBondContact O-CG1 3.4Å; I99-I103 PolarHBondContact O-N 3.12Å
100T85.5Confident81Confident13 Ų1362.7 Ų62.78%0.0832%0.319CS..Hα-helixtrans-59.7-42.8177.4-52.70000111.2E96 S98 K104 Y156 N230E96-T100 PolarHBondContact O-N 3.35Å; E96-T100 PolarHBondContact O-OG1 3.48Å; S98-T100 VanDerWaalsContact C-N 3.33Å; S98-T100 PolarHBondContact O-N 2.99Å; T100-K104 PolarHBondContact O-N 3.01Å; T100-K104 VanDerWaalsContact O-N 3.13Å; T100-Y156 WeakPolarHBondContact CG2-OH 3.27Å; T100-N230 WeakPolarHBondContact CG2-ND2 3.3Å
101R86.6Confident82.7Confident150 Ų15057.4 Ų57.457%0.56630%0.296SS*.Hα-helixtrans-66.5-40.7177.9-162.6-166.186.8955112.1S97 S98 I99 K104 L105S97-R101 PolarHBondContact O-N 2.92Å; S98-R101 WeakPolarHBondContact O-CB 3.32Å; S98-R101 PolarHBondContact O-N 3.31Å; S98-R101 VanDerWaalsContact O-N 3.15Å; I99-R101 VanDerWaalsContact C-N 3.3Å; I99-R101 PolarHBondContact O-N 3.03Å; R101-K104 WeakPolarHBondContact O-CB 3.26Å; R101-K104 PolarHBondContact O-N 3.09Å; R101-L105 VanDerWaalsContact CZ-CD1 3.48Å; R101-L105 WeakPolarHBondContact O-CG 3.46Å; R101-L105 PolarHBondContact O-N 3.47Å
102D90.4Very high84.3Confident60 Ų6060.9 Ų60.932%0.32129%0.294SS..Hα-helixtrans-69.1-44.9-178.3-63.8-21.8000110.7S98 I99 K104 L105 Q106S98-D102 PolarHBondContact O-N 3.27Å; I99-D102 PolarHBondContact O-N 2.94Å; D102-K104 VanDerWaalsContact C-N 3.28Å; D102-K104 PolarHBondContact O-N 3.29Å; D102-L105 PolarHBondContact O-N 3.02Å; D102-Q106 WeakPolarHBondContact O-CB 3.21Å; D102-Q106 WeakPolarHBondContact O-CG 3.41Å; D102-Q106 PolarHBondContact O-N 3.38Å
103I92.4Very high85.7Confident0 Ų061.1 Ų61.10%029%0.291CS..Hα-helixtrans-54.3-45.5171.8-72.1171000110.7L69 E72 V73 F76 I99 Q106 A107 Y156L69-I103 HydrophobicContact CD1-CB 4.31Å; L69-I103 HydrophobicContact CD1-CG1 4.38Å; L69-I103 HydrophobicContact CD1-CG2 3.92Å; E72-I103 HydrophobicContact CB-CD1 4.27Å; E72-I103 HydrophobicContact CB-CG1 3.86Å; V73-I103 HydrophobicContact CG2-CD1 4.24Å; V73-I103 HydrophobicContact CG2-CG2 4.25Å; F76-I103 HydrophobicContact CB-CD1 3.97Å; F76-I103 HydrophobicContact CG-CD1 4.44Å; I99-I103 HydrophobicContact CG2-CD1 3.75Å; I99-I103 HydrophobicContact CG2-CG1 4.34Å; I99-I103 WeakPolarHBondContact O-CB 3.4Å; I99-I103 VanDerWaalsContact O-CG1 3.3Å; I99-I103 WeakPolarHBondContact O-CG1 3.4Å; I99-I103 PolarHBondContact O-N 3.12Å; I103-Q106 PolarHBondContact O-N 3.38Å; I103-A107 VanDerWaalsContact O-CB 3.31Å; I103-A107 WeakPolarHBondContact O-CB 3.23Å; I103-A107 PolarHBondContact O-N 3.12Å; I103-Y156 HydrophobicContact CD1-CD2 4.28Å; I103-Y156 HydrophobicContact CD1-CE2 3.91Å; I103-Y156 HydrophobicContact CG2-CD1 4.1Å; I103-Y156 HydrophobicContact CG2-CD2 4.11Å; I103-Y156 HydrophobicContact CG2-CE1 3.85Å; I103-Y156 HydrophobicContact CG2-CE2 3.89Å; I103-Y156 HydrophobicContact CG2-CG 4.22Å
104K89.4Confident87.1Confident68 Ų6859.8 Ų59.830%0.29628%0.284SS..Hα-helixtrans-59.1-53.8178.1175.6-179.3175.6174.40111.8T100 R101 D102 Q106 A107 E108 E233T100-K104 PolarHBondContact O-N 3.01Å; T100-K104 VanDerWaalsContact O-N 3.13Å; R101-K104 WeakPolarHBondContact O-CB 3.26Å; R101-K104 PolarHBondContact O-N 3.09Å; D102-K104 VanDerWaalsContact C-N 3.28Å; D102-K104 PolarHBondContact O-N 3.29Å; K104-Q106 VanDerWaalsContact C-N 3.29Å; K104-Q106 PolarHBondContact O-N 3.38Å; K104-A107 PolarHBondContact O-N 3.34Å; K104-E108 WeakPolarHBondContact CE-OE1 3.25Å; K104-E108 WeakPolarHBondContact O-CG 3.39Å; K104-E108 PolarHBondContact O-N 3.05Å; K104-E233 WeakPolarHBondContact CD-OE2 3.47Å; K104-E233 WeakPolarHBondContact CE-OE2 3.38Å; K104-E233 IonicContact NZ-OE1 2.9Å; K104-E233 PolarHBondContact NZ-OE1 3.19Å; K104-E233 IonicContact NZ-OE2 2.6Å; K104-E233 PolarHBondContact NZ-OE2 3.01Å
105L91.8Very high88.2Confident73 Ų7353.9 Ų53.938%0.38226%0.261SS..Hα-helixtrans-62.2-38.6-178-70.8177.1000112.2R101 D102 S109R101-L105 VanDerWaalsContact CZ-CD1 3.48Å; R101-L105 WeakPolarHBondContact O-CG 3.46Å; R101-L105 PolarHBondContact O-N 3.47Å; D102-L105 PolarHBondContact O-N 3.02Å; L105-S109 VanDerWaalsContact O-CB 3.3Å; L105-S109 WeakPolarHBondContact O-CB 3.45Å; L105-S109 PolarHBondContact O-N 3.44Å
106Q94Very high89.2Confident55 Ų5549.3 Ų49.326%0.25725%0.25SC..Hα-helixtrans-64.2-45.9174.5-75.2-178.3-1.300111.4L69 E72 D102 I103 K104 E108 S109 L110L69-Q106 HydrophobicContact CD1-CB 4.03Å; E72-Q106 PolarHBondContact OE1-NE2 2.97Å; E72-Q106 PolarHBondContact OE2-OE1 3.37Å; D102-Q106 WeakPolarHBondContact O-CB 3.21Å; D102-Q106 WeakPolarHBondContact O-CG 3.41Å; D102-Q106 PolarHBondContact O-N 3.38Å; I103-Q106 PolarHBondContact O-N 3.38Å; K104-Q106 VanDerWaalsContact C-N 3.29Å; K104-Q106 PolarHBondContact O-N 3.38Å; Q106-E108 PolarHBondContact O-N 3.3Å; Q106-S109 PolarHBondContact O-N 3.42Å; Q106-L110 WeakPolarHBondContact O-CB 3.39Å; Q106-L110 WeakPolarHBondContact O-CG 3.33Å; Q106-L110 PolarHBondContact O-N 3.2Å
107A92.6Very high90.1Very high2 Ų249 Ų492%0.01725%0.249CC..Hα-helixtrans-61.5-44.6178.600000112.4L69 I103 K104 S109 L110 H111 F149 M153 L237L69-A107 HydrophobicContact CD2-CB 4.47Å; I103-A107 VanDerWaalsContact O-CB 3.31Å; I103-A107 WeakPolarHBondContact O-CB 3.23Å; I103-A107 PolarHBondContact O-N 3.12Å; K104-A107 PolarHBondContact O-N 3.34Å; A107-S109 VanDerWaalsContact C-N 3.35Å; A107-S109 PolarHBondContact O-N 3.25Å; A107-L110 PolarHBondContact O-N 3.07Å; A107-H111 VanDerWaalsContact O-CB 3.3Å; A107-H111 WeakPolarHBondContact O-CB 3.47Å; A107-H111 PolarHBondContact O-N 3Å; A107-F149 HydrophobicContact CB-CE2 4.31Å; A107-F149 HydrophobicContact CB-CZ 4.32Å; A107-M153 HydrophobicContact CB-CE 3.89Å; A107-M153 HydrophobicContact CB-SD 3.79Å; A107-L237 HydrophobicContact CB-CD2 4.09Å
108E91.6Very high90.8Very high71 Ų7146.2 Ų46.233%0.33223%0.229SC..Hα-helixtrans-65.1-36.6176.2-70.9173178.200112.6K104 Q106 R112K104-E108 WeakPolarHBondContact CE-OE1 3.25Å; K104-E108 WeakPolarHBondContact O-CG 3.39Å; K104-E108 PolarHBondContact O-N 3.05Å; Q106-E108 PolarHBondContact O-N 3.3Å; E108-R112 WeakPolarHBondContact O-CG 3.46Å; E108-R112 PolarHBondContact O-N 3.25Å; E108-R112 PolarHBondContact O-NE 3.48Å
109S94.1Very high91.1Very high49 Ų4949 Ų4934%0.34323%0.234SC..Hα-helixtrans-66.9-48.6175.1-175.30000111.5L105 Q106 A107 H111 R112 R113L105-S109 VanDerWaalsContact O-CB 3.3Å; L105-S109 WeakPolarHBondContact O-CB 3.45Å; L105-S109 PolarHBondContact O-N 3.44Å; Q106-S109 PolarHBondContact O-N 3.42Å; A107-S109 VanDerWaalsContact C-N 3.35Å; A107-S109 PolarHBondContact O-N 3.25Å; S109-H111 PolarHBondContact O-N 3.3Å; S109-R112 PolarHBondContact O-N 3.32Å; S109-R113 WeakPolarHBondContact O-CG 3.4Å; S109-R113 PolarHBondContact O-N 3.18Å
110L94.9Very high91.3Very high4 Ų450.2 Ų50.22%0.02124%0.24CC..Hα-helixtrans-60.9-43.7177.7-80.6172.1000111.8I62 D65 I66 L69 Q106 A107 R112 R113 L114 F149I62-L110 HydrophobicContact CG2-CD2 4.07Å; D65-L110 HydrophobicContact CB-CD2 3.63Å; D65-L110 HydrophobicContact CB-CG 4.38Å; I66-L110 HydrophobicContact CG1-CD1 3.95Å; I66-L110 HydrophobicContact CG1-CD2 3.99Å; L69-L110 HydrophobicContact CB-CD1 4.14Å; L69-L110 HydrophobicContact CD2-CD1 3.69Å; Q106-L110 WeakPolarHBondContact O-CB 3.39Å; Q106-L110 WeakPolarHBondContact O-CG 3.33Å; Q106-L110 PolarHBondContact O-N 3.2Å; A107-L110 PolarHBondContact O-N 3.07Å; L110-R112 PolarHBondContact O-N 3.48Å; L110-R113 PolarHBondContact O-N 3.01Å; L110-L114 WeakPolarHBondContact O-CB 3.27Å; L110-L114 WeakPolarHBondContact O-CG 3.5Å; L110-L114 PolarHBondContact O-N 3.21Å; L110-F149 HydrophobicContact CB-CD2 4.31Å; L110-F149 HydrophobicContact CB-CE2 3.95Å; L110-F149 HydrophobicContact CB-CZ 4.43Å; L110-F149 HydrophobicContact CD1-CD2 4.31Å; L110-F149 HydrophobicContact CD1-CE2 4.25Å
111H91.9Very high91.4Very high28 Ų2849.8 Ų49.813%0.1324%0.237CC..Hα-helixtrans-59.6-46.7177-178.162.4000111.9A107 S109 R113 L114 D115 F149 L237A107-H111 VanDerWaalsContact O-CB 3.3Å; A107-H111 WeakPolarHBondContact O-CB 3.47Å; A107-H111 PolarHBondContact O-N 3Å; S109-H111 PolarHBondContact O-N 3.3Å; H111-R113 VanDerWaalsContact C-N 3.32Å; H111-R113 PolarHBondContact O-N 3.5Å; H111-L114 PolarHBondContact O-N 3.12Å; H111-D115 PolarHBondContact O-N 2.82Å; H111-F149 HydrophobicContact CB-CE1 4.18Å; H111-F149 HydrophobicContact CB-CZ 4.25Å; H111-L237 HydrophobicContact CB-CD1 3.95Å
112R92.2Very high91.5Very high168 Ų16846.3 Ų46.363%0.63423%0.227SC*.Hα-helixtrans-61.6-37.8176.6-76.4-177.3-71.7-176-3.2113E108 S109 L110 G116E108-R112 WeakPolarHBondContact O-CG 3.46Å; E108-R112 PolarHBondContact O-N 3.25Å; E108-R112 PolarHBondContact O-NE 3.48Å; S109-R112 PolarHBondContact O-N 3.32Å; L110-R112 PolarHBondContact O-N 3.48Å; R112-G116 PolarHBondContact O-N 2.94Å
113R94.6Very high91.4Very high48 Ų4851.3 Ų51.318%0.18124%0.242CC..Hα-helixtrans-72.7-39.2178.2-71.5173.863.4-1595112.3Q61 I62 D65 S109 L110 H111 G116 L117Q61-R113 VanDerWaalsContact CB-NH2 3.34Å; I62-R113 HydrophobicContact CD1-CB 3.73Å; I62-R113 HydrophobicContact CG1-CB 4.12Å; I62-R113 VanDerWaalsContact CG1-CZ 3.46Å; D65-R113 IonicContact OD2-CZ 3.75Å; D65-R113 IonicContact OD2-NH1 2.71Å; D65-R113 PolarHBondContact OD2-NH1 3.41Å; D65-R113 IonicContact OD2-NH2 3.3Å; S109-R113 WeakPolarHBondContact O-CG 3.4Å; S109-R113 PolarHBondContact O-N 3.18Å; L110-R113 PolarHBondContact O-N 3.01Å; H111-R113 VanDerWaalsContact C-N 3.32Å; H111-R113 PolarHBondContact O-N 3.5Å; R113-G116 WeakPolarHBondContact O-CA 3.42Å; R113-G116 PolarHBondContact O-N 3.45Å; R113-L117 PolarHBondContact O-N 3.41Å
114L92.4Very high91Very high1 Ų151.9 Ų51.91%0.00525%0.246CC..Hα-helixtrans-61-45.7172.5-77.9167.3000111.3I62 L110 H111 G116 L117 S118 H142 L145 F149I62-L114 HydrophobicContact CG2-CD2 3.99Å; I62-L114 HydrophobicContact CG2-CG 4.22Å; L110-L114 WeakPolarHBondContact O-CB 3.27Å; L110-L114 WeakPolarHBondContact O-CG 3.5Å; L110-L114 PolarHBondContact O-N 3.21Å; H111-L114 PolarHBondContact O-N 3.12Å; L114-G116 VanDerWaalsContact C-N 3.28Å; L114-G116 PolarHBondContact O-N 2.93Å; L114-L117 PolarHBondContact O-N 3.5Å; L114-S118 PolarHBondContact O-N 3.44Å; L114-H142 PolarHBondContact O-CD2 3.37Å; L114-H142 VanDerWaalsContact O-CD2 3.25Å; L114-H142 PolarHBondContact O-NE2 2.92Å; L114-L145 HydrophobicContact CD2-CB 3.7Å; L114-F149 HydrophobicContact CD1-CB 3.81Å; L114-F149 HydrophobicContact CD1-CD1 3.66Å; L114-F149 HydrophobicContact CD1-CE1 4.37Å; L114-F149 HydrophobicContact CD1-CG 3.78Å
115D90.4Very high90.8Very high48 Ų4849.5 Ų49.526%0.25724%0.235SC..Hα-helixtrans-60.3-38.2173.117957.1000112.2H111 S118 K119H111-D115 PolarHBondContact O-N 2.82Å; D115-S118 WeakPolarHBondContact O-CB 3.29Å; D115-S118 PolarHBondContact O-N 3.29Å; D115-K119 WeakPolarHBondContact O-CG 3.38Å; D115-K119 PolarHBondContact O-N 3.16Å; D115-K119 IonicContact OD1-NZ 2.69Å; D115-K119 VanDerWaalsContact OD2-CE 3.27Å; D115-K119 WeakPolarHBondContact OD2-CE 3.31Å; D115-K119 IonicContact OD2-NZ 3.9Å; D115-K119 PolarHBondContact OD2-NZ 3.05Å
116G92Very high90.6Very high32 Ų3251.8 Ų51.833%0.3325%0.248SC..Hα-helixtrans-57.6-48.6171.200000113.3R112 R113 L114 S118 K119 Q120R112-G116 PolarHBondContact O-N 2.94Å; R113-G116 WeakPolarHBondContact O-CA 3.42Å; R113-G116 PolarHBondContact O-N 3.45Å; L114-G116 VanDerWaalsContact C-N 3.28Å; L114-G116 PolarHBondContact O-N 2.93Å; G116-S118 VanDerWaalsContact C-N 3.34Å; G116-S118 PolarHBondContact O-N 3.01Å; G116-K119 PolarHBondContact O-N 2.8Å; G116-Q120 PolarHBondContact O-N 3.36Å
117L90.8Very high90.2Very high0 Ų056.4 Ų56.40%027%0.27CS..Hα-helixtrans-63.3-39.6176-71.4-167.9000112.2F55 E58 A59 I62 R113 L114 Q120 A121 L145F55-L117 HydrophobicContact CD2-CD2 3.81Å; F55-L117 HydrophobicContact CE2-CB 4Å; F55-L117 HydrophobicContact CE2-CD1 4.45Å; F55-L117 HydrophobicContact CE2-CD2 3.66Å; F55-L117 HydrophobicContact CE2-CG 4.25Å; F55-L117 HydrophobicContact CZ-CB 4.33Å; F55-L117 HydrophobicContact CZ-CD1 4.27Å; F55-L117 HydrophobicContact CZ-CD2 4.25Å; E58-L117 HydrophobicContact CB-CD2 4.23Å; E58-L117 HydrophobicContact CG-CD2 3.94Å; A59-L117 HydrophobicContact CB-CD1 4.16Å; I62-L117 HydrophobicContact CD1-CD1 3.49Å; I62-L117 VanDerWaalsContact CD1-CD1 3.49Å; I62-L117 HydrophobicContact CD1-CG 3.85Å; R113-L117 PolarHBondContact O-N 3.41Å; L114-L117 PolarHBondContact O-N 3.5Å; L117-Q120 PolarHBondContact O-N 2.92Å; L117-A121 PolarHBondContact O-N 3.27Å; L117-L145 HydrophobicContact CD1-CD1 4.27Å
118S89.8Confident89.7Confident23 Ų2360.9 Ų60.916%0.16129%0.293CS..Hα-helixtrans-58.7-49.4175.4-169.60000111.1L114 D115 G116 Q120 A121 Q122L114-S118 PolarHBondContact O-N 3.44Å; D115-S118 WeakPolarHBondContact O-CB 3.29Å; D115-S118 PolarHBondContact O-N 3.29Å; G116-S118 VanDerWaalsContact C-N 3.34Å; G116-S118 PolarHBondContact O-N 3.01Å; S118-Q120 VanDerWaalsContact C-N 3.32Å; S118-Q120 PolarHBondContact O-N 3.39Å; S118-A121 WeakPolarHBondContact O-CB 3.34Å; S118-A121 PolarHBondContact O-N 2.96Å; S118-Q122 PolarHBondContact O-N 2.91Å
119K90.5Very high89Confident109 Ų10959.1 Ų59.147%0.47429%0.293SS..Hα-helixtrans-63.2-35.8176.7-73.7168.8178.7164.30112.8D115 G116 Q122 R123D115-K119 WeakPolarHBondContact O-CG 3.38Å; D115-K119 PolarHBondContact O-N 3.16Å; D115-K119 IonicContact OD1-NZ 2.69Å; D115-K119 VanDerWaalsContact OD2-CE 3.27Å; D115-K119 WeakPolarHBondContact OD2-CE 3.31Å; D115-K119 IonicContact OD2-NZ 3.9Å; D115-K119 PolarHBondContact OD2-NZ 3.05Å; G116-K119 PolarHBondContact O-N 2.8Å; K119-Q122 PolarHBondContact O-N 3.15Å; K119-R123 VanDerWaalsContact O-CG 3.3Å; K119-R123 WeakPolarHBondContact O-CG 3.43Å; K119-R123 PolarHBondContact O-N 3.41Å
120Q89.9Confident88Confident53 Ų5360.3 Ų60.325%0.24830%0.298CS..Hα-helixtrans-65.5-44.7174.8-172.4175.2700111.2F55 G116 L117 S118 Q122 R123 T124F55-Q120 HydrophobicContact CD2-CG 4.29Å; G116-Q120 PolarHBondContact O-N 3.36Å; L117-Q120 PolarHBondContact O-N 2.92Å; S118-Q120 VanDerWaalsContact C-N 3.32Å; S118-Q120 PolarHBondContact O-N 3.39Å; Q120-Q122 VanDerWaalsContact C-N 3.32Å; Q120-Q122 PolarHBondContact O-N 3.25Å; Q120-R123 PolarHBondContact O-N 3.48Å; Q120-T124 PolarHBondContact O-N 3.27Å; Q120-T124 VanDerWaalsContact O-N 3.07Å; Q120-T124 PolarHBondContact O-OG1 3.49Å
121A87Confident86.9Confident4 Ų464.4 Ų64.43%0.03332%0.32CS..Hα-helixtrans-59.8-42175.600000111.8L117 S118 T124 E125 Q138 R139L117-A121 PolarHBondContact O-N 3.27Å; S118-A121 WeakPolarHBondContact O-CB 3.34Å; S118-A121 PolarHBondContact O-N 2.96Å; A121-T124 PolarHBondContact O-N 2.89Å; A121-E125 PolarHBondContact O-N 3.35Å; A121-Q138 HydrophobicContact CB-CB 3.78Å; A121-R139 HydrophobicContact CB-CG 4.42Å
122Q87.6Confident86.2Confident76 Ų7663.9 Ų63.936%0.35532%0.321SS..Hα-helixtrans-63-44.5176.8-167.858.947.700112.3S118 K119 Q120 T124 E125 D126S118-Q122 PolarHBondContact O-N 2.91Å; K119-Q122 PolarHBondContact O-N 3.15Å; Q120-Q122 VanDerWaalsContact C-N 3.32Å; Q120-Q122 PolarHBondContact O-N 3.25Å; Q122-T124 VanDerWaalsContact C-N 3.3Å; Q122-T124 PolarHBondContact O-N 2.96Å; Q122-E125 PolarHBondContact NE2-OE2 3.02Å; Q122-E125 WeakPolarHBondContact O-CB 3.4Å; Q122-E125 PolarHBondContact O-N 3.32Å; Q122-E125 VanDerWaalsContact O-N 3.13Å; Q122-E125 PolarHBondContact OE1-OE2 3.17Å; Q122-D126 PolarHBondContact NE2-OD1 3.39Å; Q122-D126 VanDerWaalsContact O-CG 3.22Å; Q122-D126 PolarHBondContact O-N 3.49Å
123R88.8Confident85.6Confident165 Ų16560 Ų6062%0.62332%0.316SS*.Hα-helixtrans-62.2-38.2177.1-72.4170.6-176.5176.52.2112.4K119 Q120 E125 D126 Q127K119-R123 VanDerWaalsContact O-CG 3.3Å; K119-R123 WeakPolarHBondContact O-CG 3.43Å; K119-R123 PolarHBondContact O-N 3.41Å; Q120-R123 PolarHBondContact O-N 3.48Å; R123-E125 VanDerWaalsContact C-N 3.33Å; R123-D126 PolarHBondContact O-N 3.28Å; R123-Q127 VanDerWaalsContact O-CG 3.27Å; R123-Q127 WeakPolarHBondContact O-CG 3.27Å; R123-Q127 PolarHBondContact O-N 2.94Å; R123-Q127 PolarHBondContact O-NE2 3.25Å
124T85.1Confident85Confident13 Ų1358 Ų588%0.0831%0.31CS..Hα-helixtrans-68.8-35.8176.4-590000110.9Q120 A121 Q122 Q127 L128 A134 V135 Q138Q120-T124 PolarHBondContact O-N 3.27Å; Q120-T124 VanDerWaalsContact O-N 3.07Å; Q120-T124 PolarHBondContact O-OG1 3.49Å; A121-T124 PolarHBondContact O-N 2.89Å; Q122-T124 VanDerWaalsContact C-N 3.3Å; Q122-T124 PolarHBondContact O-N 2.96Å; T124-Q127 PolarHBondContact O-N 2.96Å; T124-L128 HydrophobicContact CG2-CD1 3.74Å; T124-L128 HydrophobicContact CG2-CG 4.44Å; T124-L128 WeakPolarHBondContact O-CB 3.12Å; T124-L128 PolarHBondContact O-N 3.1Å; T124-A134 HydrophobicContact CG2-CB 4.2Å; T124-V135 HydrophobicContact CG2-CG2 3.74Å; T124-Q138 PolarHBondContact OG1-NE2 3.25Å; T124-Q138 PolarHBondContact OG1-OE1 3.07Å
125E84.5Confident84.5Confident18 Ų1858 Ų588%0.08431%0.31CS..Hα-helixtrans-62.6-45.7172.3-179.6175.8-144.100112.4A121 Q122 R123 Q127 G129 T130 V135 R139A121-E125 PolarHBondContact O-N 3.35Å; Q122-E125 PolarHBondContact NE2-OE2 3.02Å; Q122-E125 WeakPolarHBondContact O-CB 3.4Å; Q122-E125 PolarHBondContact O-N 3.32Å; Q122-E125 VanDerWaalsContact O-N 3.13Å; Q122-E125 PolarHBondContact OE1-OE2 3.17Å; R123-E125 VanDerWaalsContact C-N 3.33Å; E125-Q127 PolarHBondContact O-N 2.96Å; E125-G129 CarbonylContact O-C 3.45Å; E125-G129 WeakPolarHBondContact O-CA 3.43Å; E125-G129 PolarHBondContact O-N 3.17Å; E125-T130 WeakPolarHBondContact OE1-CB 3.34Å; E125-T130 VanDerWaalsContact OE1-CG2 3.24Å; E125-T130 WeakPolarHBondContact OE1-CG2 3.38Å; E125-T130 PolarHBondContact OE1-OG1 3.39Å; E125-V135 HydrophobicContact CB-CG1 3.83Å; E125-V135 HydrophobicContact CB-CG2 4.17Å; E125-V135 HydrophobicContact CG-CG1 4.25Å; E125-R139 VanDerWaalsContact CD-CZ 3.48Å; E125-R139 IonicContact OE1-CZ 3.75Å; E125-R139 IonicContact OE1-NH1 2.78Å; E125-R139 PolarHBondContact OE1-NH1 3.31Å; E125-R139 IonicContact OE1-NH2 2.65Å; E125-R139 PolarHBondContact OE1-NH2 2.92Å; E125-R139 IonicContact OE2-CZ 2.82Å; E125-R139 VanDerWaalsContact OE2-CZ 3.3Å; E125-R139 IonicContact OE2-NE 2.97Å; E125-R139 IonicContact OE2-NH1 3.29Å; E125-R139 IonicContact OE2-NH2 3.93Å; E125-R139 PolarHBondContact OE2-NH2 2.9Å
126D87.6Confident84.1Confident120 Ų12057.7 Ų57.764%0.64231%0.305SS*.Hα-helixtrans-62.2-27.5179.2-60.9-22.4000112.1Q122 R123Q122-D126 PolarHBondContact NE2-OD1 3.39Å; Q122-D126 VanDerWaalsContact O-CG 3.22Å; Q122-D126 PolarHBondContact O-N 3.49Å; R123-D126 PolarHBondContact O-N 3.28Å
127Q85.7Confident83.7Confident153 Ų15359.1 Ų59.172%0.71531%0.305SS*.Hα-helixtrans-89.7-45.3-178.3-70.3170.93200113.8R123 T124 E125R123-Q127 VanDerWaalsContact O-CG 3.27Å; R123-Q127 WeakPolarHBondContact O-CG 3.27Å; R123-Q127 PolarHBondContact O-N 2.94Å; R123-Q127 PolarHBondContact O-NE2 3.25Å; T124-Q127 PolarHBondContact O-N 2.96Å; E125-Q127 PolarHBondContact O-N 2.96Å
128L81.9Confident83.5Confident96 Ų9659.2 Ų59.250%0.50331%0.305SS..Hα-helixtrans-105.8-9-171.1-61175.7000113.1T124 A132 A134T124-L128 HydrophobicContact CG2-CD1 3.74Å; T124-L128 HydrophobicContact CG2-CG 4.44Å; T124-L128 WeakPolarHBondContact O-CB 3.12Å; T124-L128 PolarHBondContact O-N 3.1Å; L128-A132 HydrophobicContact CB-CB 3.59Å; L128-A132 HydrophobicContact CD1-CB 4.43Å; L128-A134 HydrophobicContact CD1-CB 4.43Å
129G76.3Confident83.2Confident33 Ų3362.1 Ų62.134%0.3431%0.312SS..  trans81.9156.9-173.500000113.3E125 N131 A132E125-G129 CarbonylContact O-C 3.45Å; E125-G129 WeakPolarHBondContact O-CA 3.43Å; E125-G129 PolarHBondContact O-N 3.17Å; G129-N131 PolarHBondContact O-N 3.39Å; G129-N131 VanDerWaalsContact O-N 3.1Å; G129-A132 WeakPolarHBondContact O-CB 3.15Å; G129-A132 PolarHBondContact O-N 3.01Å; G129-A132 VanDerWaalsContact O-N 3.12Å
130T73.7Confident82.9Confident74 Ų7458.9 Ų58.945%0.45430%0.304SS..THydrogen-bonded Turntrans-55.7-29.9-174.8-52.20000115E125E125-T130 WeakPolarHBondContact OE1-CB 3.34Å; E125-T130 VanDerWaalsContact OE1-CG2 3.24Å; E125-T130 WeakPolarHBondContact OE1-CG2 3.38Å; E125-T130 PolarHBondContact OE1-OG1 3.39Å
131N71.9Confident82.8Confident90 Ų9059.5 Ų59.548%0.48131%0.306SS..THydrogen-bonded Turntrans-89.2-0.5-175.9-66.4-28.9000114.1G129 Y265G129-N131 PolarHBondContact O-N 3.39Å; G129-N131 VanDerWaalsContact O-N 3.1Å; N131-Y265 HydrophobicContact CB-CE2 3.9Å
132A78.3Confident82.9Confident17 Ų1759.5 Ų59.514%0.1431%0.306CS..  trans-63.1140.4177.800000111.4L128 G129 A134 V135 R136L128-A132 HydrophobicContact CB-CB 3.59Å; L128-A132 HydrophobicContact CD1-CB 4.43Å; G129-A132 WeakPolarHBondContact O-CB 3.15Å; G129-A132 PolarHBondContact O-N 3.01Å; G129-A132 VanDerWaalsContact O-N 3.12Å; A132-A134 VanDerWaalsContact C-N 3.29Å; A132-A134 PolarHBondContact O-N 3.45Å; A132-V135 HydrophobicContact CB-CB 4.4Å; A132-V135 HydrophobicContact CB-CG2 3.93Å; A132-V135 PolarHBondContact O-N 3.34Å; A132-V135 VanDerWaalsContact O-N 3.17Å; A132-R136 PolarHBondContact O-N 2.94Å; A132-R136 VanDerWaalsContact O-N 3.14Å
133V79.1Confident82.8Confident86 Ų8656 Ų5652%0.52129%0.29SS..Hα-helixtrans-58-43.3-178.7-179.90000111.1V135 R136 I137V133-V135 VanDerWaalsContact C-N 3.35Å; V133-V135 PolarHBondContact O-N 3.35Å; V133-R136 PolarHBondContact O-N 2.86Å; V133-I137 HydrophobicContact CG1-CD1 3.87Å; V133-I137 HydrophobicContact CG1-CG1 4.44Å; V133-I137 WeakPolarHBondContact O-CG1 3.35Å; V133-I137 PolarHBondContact O-N 2.84Å
134A81.8Confident82.8Confident8 Ų850.5 Ų50.57%0.06628%0.28CS..Hα-helixtrans-56.2-46.6177.200000112.2I52 T124 L128 A132 R136 I137 Q138I52-A134 HydrophobicContact CD1-CB 3.79Å; I52-A134 HydrophobicContact CG1-CB 4.04Å; T124-A134 HydrophobicContact CG2-CB 4.2Å; L128-A134 HydrophobicContact CD1-CB 4.43Å; A132-A134 VanDerWaalsContact C-N 3.29Å; A132-A134 PolarHBondContact O-N 3.45Å; A134-R136 PolarHBondContact O-N 2.93Å; A134-I137 PolarHBondContact O-N 3.28Å; A134-Q138 WeakPolarHBondContact O-CB 3.27Å; A134-Q138 VanDerWaalsContact O-CG 3.23Å; A134-Q138 WeakPolarHBondContact O-CG 3.4Å; A134-Q138 PolarHBondContact O-N 3.26Å
135V82.6Confident83.1Confident0 Ų050.5 Ų50.50%028%0.279CS..Hα-helixtrans-62.5-44.1179.91770000111.1T124 E125 A132 V133 I137 Q138 R139T124-V135 HydrophobicContact CG2-CG2 3.74Å; E125-V135 HydrophobicContact CB-CG1 3.83Å; E125-V135 HydrophobicContact CB-CG2 4.17Å; E125-V135 HydrophobicContact CG-CG1 4.25Å; A132-V135 HydrophobicContact CB-CB 4.4Å; A132-V135 HydrophobicContact CB-CG2 3.93Å; A132-V135 PolarHBondContact O-N 3.34Å; A132-V135 VanDerWaalsContact O-N 3.17Å; V133-V135 VanDerWaalsContact C-N 3.35Å; V133-V135 PolarHBondContact O-N 3.35Å; V135-I137 PolarHBondContact O-N 3.17Å; V135-Q138 PolarHBondContact O-N 3.42Å; V135-R139 HydrophobicContact CG1-CG 4.46Å; V135-R139 WeakPolarHBondContact O-CB 3.41Å; V135-R139 WeakPolarHBondContact O-CG 3.27Å; V135-R139 PolarHBondContact O-N 3.46Å
136R80.6Confident83.3Confident42 Ų4250.2 Ų50.216%0.15828%0.278CS..Hα-helixtrans-61.8-44.8177.7-65.8-171.1-60.1176.56.4111.8A132 V133 A134 S140 N258 T262A132-R136 PolarHBondContact O-N 2.94Å; A132-R136 VanDerWaalsContact O-N 3.14Å; V133-R136 PolarHBondContact O-N 2.86Å; A134-R136 PolarHBondContact O-N 2.93Å; R136-S140 VanDerWaalsContact O-CB 3.26Å; R136-S140 WeakPolarHBondContact O-CB 3.44Å; R136-S140 PolarHBondContact O-N 3.48Å; R136-N258 PolarHBondContact NH1-O 2.97Å; R136-T262 PolarHBondContact NH1-OG1 3.16Å; R136-T262 PolarHBondContact NH2-OG1 3.32Å
137I83.4Confident83.3Confident62 Ų6249.2 Ų49.232%0.31827%0.265SS..Hα-helixtrans-61.1-50176.6-67.8170000109.9L56 V133 A134 V135 R139 S140 Q141L56-I137 HydrophobicContact CD2-CG2 4.05Å; V133-I137 HydrophobicContact CG1-CD1 3.87Å; V133-I137 HydrophobicContact CG1-CG1 4.44Å; V133-I137 WeakPolarHBondContact O-CG1 3.35Å; V133-I137 PolarHBondContact O-N 2.84Å; A134-I137 PolarHBondContact O-N 3.28Å; V135-I137 PolarHBondContact O-N 3.17Å; I137-R139 PolarHBondContact O-N 3.37Å; I137-S140 PolarHBondContact O-N 3.5Å; I137-Q141 HydrophobicContact CG2-CG 4.27Å; I137-Q141 WeakPolarHBondContact O-CB 3.43Å; I137-Q141 WeakPolarHBondContact O-CG 3.3Å; I137-Q141 PolarHBondContact O-N 3.29Å
138Q87.2Confident83.6Confident1 Ų146.2 Ų46.21%0.00525%0.247CC..Hα-helixtrans-61.1-46.8-177.6-70.8171.3-28.500112.4F55 A121 T124 A134 V135 Q141 H142F55-Q138 HydrophobicContact CD1-CB 4.45Å; F55-Q138 HydrophobicContact CD1-CG 3.8Å; F55-Q138 HydrophobicContact CD2-CB 4.37Å; F55-Q138 HydrophobicContact CD2-CG 3.75Å; F55-Q138 HydrophobicContact CE1-CB 3.95Å; F55-Q138 HydrophobicContact CE1-CG 3.82Å; F55-Q138 HydrophobicContact CE2-CB 3.83Å; F55-Q138 HydrophobicContact CE2-CG 3.72Å; F55-Q138 HydrophobicContact CG-CG 3.79Å; F55-Q138 VanDerWaalsContact CZ-CA 3.5Å; F55-Q138 HydrophobicContact CZ-CB 3.61Å; F55-Q138 HydrophobicContact CZ-CG 3.78Å; F55-Q138 WeakPolarHBondContact CZ-O 3.48Å; A121-Q138 HydrophobicContact CB-CB 3.78Å; T124-Q138 PolarHBondContact OG1-NE2 3.25Å; T124-Q138 PolarHBondContact OG1-OE1 3.07Å; A134-Q138 WeakPolarHBondContact O-CB 3.27Å; A134-Q138 VanDerWaalsContact O-CG 3.23Å; A134-Q138 WeakPolarHBondContact O-CG 3.4Å; A134-Q138 PolarHBondContact O-N 3.26Å; V135-Q138 PolarHBondContact O-N 3.42Å; Q138-Q141 PolarHBondContact O-N 3.01Å; Q138-H142 WeakPolarHBondContact O-CB 3.39Å; Q138-H142 PolarHBondContact O-N 3.46Å
139R84.3Confident84.1Confident84 Ų8441.7 Ų41.732%0.31722%0.223SC..Hα-helixtrans-61.6-46176.3-78.5-177.4157.3172.5-6.8112.5A121 E125 V135 I137 Q141 H142 A143A121-R139 HydrophobicContact CB-CG 4.42Å; E125-R139 VanDerWaalsContact CD-CZ 3.48Å; E125-R139 IonicContact OE1-CZ 3.75Å; E125-R139 IonicContact OE1-NH1 2.78Å; E125-R139 PolarHBondContact OE1-NH1 3.31Å; E125-R139 IonicContact OE1-NH2 2.65Å; E125-R139 PolarHBondContact OE1-NH2 2.92Å; E125-R139 IonicContact OE2-CZ 2.82Å; E125-R139 VanDerWaalsContact OE2-CZ 3.3Å; E125-R139 IonicContact OE2-NE 2.97Å; E125-R139 IonicContact OE2-NH1 3.29Å; E125-R139 IonicContact OE2-NH2 3.93Å; E125-R139 PolarHBondContact OE2-NH2 2.9Å; V135-R139 HydrophobicContact CG1-CG 4.46Å; V135-R139 WeakPolarHBondContact O-CB 3.41Å; V135-R139 WeakPolarHBondContact O-CG 3.27Å; V135-R139 PolarHBondContact O-N 3.46Å; I137-R139 PolarHBondContact O-N 3.37Å; R139-Q141 VanDerWaalsContact C-N 3.33Å; R139-Q141 PolarHBondContact O-N 3.11Å; R139-H142 PolarHBondContact O-N 3.01Å; R139-A143 WeakPolarHBondContact O-CB 3.39Å; R139-A143 PolarHBondContact O-N 3.35Å
140S83.8Confident84.7Confident42 Ų4240.8 Ų40.829%0.29421%0.21SC..Hα-helixtrans-60.7-44.2178.9-175.10000111.6R136 I137 A144R136-S140 VanDerWaalsContact O-CB 3.26Å; R136-S140 WeakPolarHBondContact O-CB 3.44Å; R136-S140 PolarHBondContact O-N 3.48Å; I137-S140 PolarHBondContact O-N 3.5Å; S140-A144 WeakPolarHBondContact O-CB 3.48Å; S140-A144 PolarHBondContact O-N 2.87Å
141Q88.1Confident85.5Confident65 Ų6540.8 Ų40.830%0.30421%0.205SC..Hα-helixtrans-67.6-47179.4-67.9-69.960.200111.9F55 L56 I137 Q138 R139 A143 A144 L145F55-Q141 HydrophobicContact CE1-CB 3.9Å; F55-Q141 HydrophobicContact CE1-CG 4.42Å; F55-Q141 HydrophobicContact CZ-CB 4.5Å; L56-Q141 HydrophobicContact CD2-CG 4.05Å; I137-Q141 HydrophobicContact CG2-CG 4.27Å; I137-Q141 WeakPolarHBondContact O-CB 3.43Å; I137-Q141 WeakPolarHBondContact O-CG 3.3Å; I137-Q141 PolarHBondContact O-N 3.29Å; Q138-Q141 PolarHBondContact O-N 3.01Å; R139-Q141 VanDerWaalsContact C-N 3.33Å; R139-Q141 PolarHBondContact O-N 3.11Å; Q141-A143 VanDerWaalsContact C-N 3.34Å; Q141-A143 PolarHBondContact O-N 3.37Å; Q141-A144 PolarHBondContact O-N 2.64Å; Q141-L145 VanDerWaalsContact O-CG 3.31Å; Q141-L145 WeakPolarHBondContact O-CG 3.39Å; Q141-L145 PolarHBondContact O-N 2.85Å
142H89.3Confident86.5Confident4 Ų436.5 Ų36.52%0.01918%0.182CC..Hα-helixtrans-54.3-51.2175.8171.2-94.1000111L114 Q138 R139 A144 L145 H146 Q248L114-H142 PolarHBondContact O-CD2 3.37Å; L114-H142 VanDerWaalsContact O-CD2 3.25Å; L114-H142 PolarHBondContact O-NE2 2.92Å; Q138-H142 WeakPolarHBondContact O-CB 3.39Å; Q138-H142 PolarHBondContact O-N 3.46Å; R139-H142 PolarHBondContact O-N 3.01Å; H142-A144 PolarHBondContact O-N 2.69Å; H142-L145 PolarHBondContact O-N 3.02Å; H142-H146 WeakPolarHBondContact O-CB 3.41Å; H142-H146 PolarHBondContact O-N 3.03Å; H142-Q248 PolarHBondContact ND1-OE1 3.29Å
143A85.9Confident87.2Confident4 Ų435.8 Ų35.83%0.03318%0.176CC..Hα-helixtrans-66.8-37.8-176.900000113.5R139 Q141 H146 R147 I252R139-A143 WeakPolarHBondContact O-CB 3.39Å; R139-A143 PolarHBondContact O-N 3.35Å; Q141-A143 VanDerWaalsContact C-N 3.34Å; Q141-A143 PolarHBondContact O-N 3.37Å; A143-H146 PolarHBondContact O-N 3.07Å; A143-R147 WeakPolarHBondContact O-CB 3.42Å; A143-R147 VanDerWaalsContact O-CG 3.29Å; A143-R147 WeakPolarHBondContact O-CG 3.49Å; A143-R147 PolarHBondContact O-N 3.23Å; A143-I252 HydrophobicContact CB-CD1 3.02Å; A143-I252 HydrophobicContact CB-CG1 4.43Å; A143-I252 HydrophobicContact CB-CG2 4.49Å
144A87.4Confident87.7Confident49 Ų4936.7 Ų36.741%0.40517%0.17SC..Hα-helixtrans-61.4-45.5175.100000111.3S140 Q141 H142 R148S140-A144 WeakPolarHBondContact O-CB 3.48Å; S140-A144 PolarHBondContact O-N 2.87Å; Q141-A144 PolarHBondContact O-N 2.64Å; H142-A144 PolarHBondContact O-N 2.69Å; A144-R148 PolarHBondContact O-N 3.25Å; A144-R148 VanDerWaalsContact O-N 3.12Å
145L91.9Very high88.1Confident13 Ų1338.8 Ų38.87%0.06818%0.178CC..Hα-helixtrans-66.3-42.9176.7-65171.3000111.9A59 I62 R63 I66 L114 L117 Q141 H142 R147 R148 F149A59-L145 HydrophobicContact CB-CD1 3.88Å; I62-L145 HydrophobicContact CB-CD1 4.32Å; I62-L145 HydrophobicContact CG2-CD1 4.05Å; I62-L145 HydrophobicContact CG2-CD2 4.5Å; R63-L145 HydrophobicContact CB-CD2 3.69Å; R63-L145 HydrophobicContact CG-CD2 4Å; I66-L145 HydrophobicContact CD1-CB 4.29Å; I66-L145 HydrophobicContact CD1-CD2 4.32Å; L114-L145 HydrophobicContact CD2-CB 3.7Å; L117-L145 HydrophobicContact CD1-CD1 4.27Å; Q141-L145 VanDerWaalsContact O-CG 3.31Å; Q141-L145 WeakPolarHBondContact O-CG 3.39Å; Q141-L145 PolarHBondContact O-N 2.85Å; H142-L145 PolarHBondContact O-N 3.02Å; L145-R147 PolarHBondContact O-N 2.97Å; L145-R148 PolarHBondContact O-N 2.89Å; L145-F149 WeakPolarHBondContact O-CB 3.46Å; L145-F149 PolarHBondContact O-N 3.4Å
146H89.2Confident88.6Confident11 Ų1139.3 Ų39.35%0.05118%0.181CC..Hα-helixtrans-61.7-45178.5-166.963.9000111.7H142 A143 R148 F149 Q150 I241H142-H146 WeakPolarHBondContact O-CB 3.41Å; H142-H146 PolarHBondContact O-N 3.03Å; A143-H146 PolarHBondContact O-N 3.07Å; H146-R148 VanDerWaalsContact C-N 3.32Å; H146-R148 PolarHBondContact O-N 3.41Å; H146-F149 PolarHBondContact O-N 2.65Å; H146-Q150 PolarHBondContact NE2-NE2 3.07Å; H146-Q150 WeakPolarHBondContact O-CB 3.47Å; H146-Q150 VanDerWaalsContact O-CG 3.27Å; H146-Q150 WeakPolarHBondContact O-CG 3.34Å; H146-Q150 PolarHBondContact O-N 3.34Å; H146-I241 PolarHBondContact NE2-O 2.9Å; H146-I241 VanDerWaalsContact NE2-O 3.15Å
147R86.9Confident89Confident100 Ų10039.4 Ų39.438%0.37718%0.184SC..Hα-helixtrans-60.3-41.3174.4-74.7179.2-170.7126.53.3112.1A143 L145 Q150 Q151A143-R147 WeakPolarHBondContact O-CB 3.42Å; A143-R147 VanDerWaalsContact O-CG 3.29Å; A143-R147 WeakPolarHBondContact O-CG 3.49Å; A143-R147 PolarHBondContact O-N 3.23Å; L145-R147 PolarHBondContact O-N 2.97Å; R147-Q150 WeakPolarHBondContact O-CB 3.4Å; R147-Q150 PolarHBondContact O-N 3.2Å; R147-Q151 PolarHBondContact O-N 3.46Å
148R91.4Very high89.3Confident90 Ų9042.1 Ų42.134%0.3420%0.196SC..Hα-helixtrans-66.1-46177.6-174.361.4175.6174.4-2.4111.3I66 E70 A144 L145 H146 Q150 Q151 V152I66-R148 HydrophobicContact CG2-CB 4.49Å; I66-R148 HydrophobicContact CG2-CG 3.74Å; E70-R148 IonicContact OE1-CZ 3.18Å; E70-R148 IonicContact OE1-NH1 2.95Å; E70-R148 IonicContact OE1-NH2 3.13Å; E70-R148 PolarHBondContact OE1-NH2 2.8Å; E70-R148 IonicContact OE2-CZ 3.89Å; E70-R148 IonicContact OE2-NE 2.82Å; E70-R148 IonicContact OE2-NH2 2.89Å; E70-R148 PolarHBondContact OE2-NH2 2.95Å; A144-R148 PolarHBondContact O-N 3.25Å; A144-R148 VanDerWaalsContact O-N 3.12Å; L145-R148 PolarHBondContact O-N 2.89Å; H146-R148 VanDerWaalsContact C-N 3.32Å; H146-R148 PolarHBondContact O-N 3.41Å; R148-Q150 VanDerWaalsContact C-N 3.34Å; R148-Q150 PolarHBondContact O-N 2.87Å; R148-Q151 WeakPolarHBondContact O-CB 3.36Å; R148-Q151 PolarHBondContact O-N 3.25Å; R148-Q151 VanDerWaalsContact O-N 3.17Å; R148-V152 WeakPolarHBondContact O-CG2 3.34Å; R148-V152 PolarHBondContact O-N 3.32Å; R148-V152 VanDerWaalsContact O-N 3.07Å
149F92.6Very high89.3Confident0 Ų042.3 Ų42.30%020%0.198CC..Hα-helixtrans-58.2-46.7175.4176.3-118.6000111.6I66 L69 A107 L110 H111 L114 L145 H146 Q151 V152 M153 I241I66-F149 HydrophobicContact CD1-CB 4.01Å; I66-F149 HydrophobicContact CG1-CB 4.36Å; I66-F149 HydrophobicContact CG1-CD2 4.48Å; L69-F149 HydrophobicContact CD2-CD2 4.16Å; L69-F149 HydrophobicContact CD2-CE2 3.87Å; A107-F149 HydrophobicContact CB-CE2 4.31Å; A107-F149 HydrophobicContact CB-CZ 4.32Å; L110-F149 HydrophobicContact CB-CD2 4.31Å; L110-F149 HydrophobicContact CB-CE2 3.95Å; L110-F149 HydrophobicContact CB-CZ 4.43Å; L110-F149 HydrophobicContact CD1-CD2 4.31Å; L110-F149 HydrophobicContact CD1-CE2 4.25Å; H111-F149 HydrophobicContact CB-CE1 4.18Å; H111-F149 HydrophobicContact CB-CZ 4.25Å; L114-F149 HydrophobicContact CD1-CB 3.81Å; L114-F149 HydrophobicContact CD1-CD1 3.66Å; L114-F149 HydrophobicContact CD1-CE1 4.37Å; L114-F149 HydrophobicContact CD1-CG 3.78Å; L145-F149 WeakPolarHBondContact O-CB 3.46Å; L145-F149 PolarHBondContact O-N 3.4Å; H146-F149 PolarHBondContact O-N 2.65Å; F149-Q151 VanDerWaalsContact C-N 3.31Å; F149-Q151 PolarHBondContact O-N 2.99Å; F149-V152 PolarHBondContact O-N 2.88Å; F149-V152 VanDerWaalsContact O-N 3.16Å; F149-M153 HydrophobicContact CD2-CG 4.14Å; F149-M153 HydrophobicContact CE1-CG 4.23Å; F149-M153 HydrophobicContact CE2-CG 3.74Å; F149-M153 HydrophobicContact CE2-SD 3.84Å; F149-M153 HydrophobicContact CZ-CG 3.79Å; F149-M153 HydrophobicContact CZ-SD 4.15Å; F149-M153 WeakPolarHBondContact O-CG 3.48Å; F149-M153 PolarHBondContact O-N 3.48Å; F149-I241 HydrophobicContact CD1-CD1 4.15Å; F149-I241 HydrophobicContact CE1-CD1 3.39Å; F149-I241 HydrophobicContact CE1-CG1 4.05Å; F149-I241 HydrophobicContact CZ-CD1 4.12Å
150Q89.2Confident89.4Confident14 Ų1438.3 Ų38.37%0.06518%0.183CC..Hα-helixtrans-56.2-42.9174-79178.3-17.800113H146 R147 R148 M153 R154 I241H146-Q150 PolarHBondContact NE2-NE2 3.07Å; H146-Q150 WeakPolarHBondContact O-CB 3.47Å; H146-Q150 VanDerWaalsContact O-CG 3.27Å; H146-Q150 WeakPolarHBondContact O-CG 3.34Å; H146-Q150 PolarHBondContact O-N 3.34Å; R147-Q150 WeakPolarHBondContact O-CB 3.4Å; R147-Q150 PolarHBondContact O-N 3.2Å; R148-Q150 VanDerWaalsContact C-N 3.34Å; R148-Q150 PolarHBondContact O-N 2.87Å; Q150-M153 PolarHBondContact O-N 3.38Å; Q150-R154 WeakPolarHBondContact O-CG 3.42Å; Q150-R154 PolarHBondContact O-N 3.22Å; Q150-I241 HydrophobicContact CG-CG2 3.33Å; Q150-I241 PolarHBondContact NE2-O 3.33Å
151Q90.4Very high89.6Confident75 Ų7539.4 Ų39.435%0.3519%0.185SC..Hα-helixtrans-61.1-45.6176.7-177-176.98.700111.7R147 R148 F149 R154 Q155R147-Q151 PolarHBondContact O-N 3.46Å; R148-Q151 WeakPolarHBondContact O-CB 3.36Å; R148-Q151 PolarHBondContact O-N 3.25Å; R148-Q151 VanDerWaalsContact O-N 3.17Å; F149-Q151 VanDerWaalsContact C-N 3.31Å; F149-Q151 PolarHBondContact O-N 2.99Å; Q151-R154 PolarHBondContact O-N 3.2Å; Q151-Q155 WeakPolarHBondContact O-CG 3.48Å; Q151-Q155 PolarHBondContact O-N 3.48Å; Q151-Q155 VanDerWaalsContact O-N 3.1Å
152V93.9Very high89.5Confident0 Ų039.2 Ų39.20%019%0.189CC..Hα-helixtrans-63-43.8178.1174.50000111I66 L69 E70 V73 R148 F149 R154 Q155 Y156I66-V152 HydrophobicContact CG2-CG2 4.16Å; L69-V152 HydrophobicContact CD2-CG1 4.05Å; L69-V152 HydrophobicContact CG-CG1 3.92Å; E70-V152 HydrophobicContact CB-CG1 4.22Å; E70-V152 HydrophobicContact CB-CG2 3.81Å; E70-V152 HydrophobicContact CG-CG2 4.08Å; V73-V152 HydrophobicContact CB-CG1 4.45Å; V73-V152 HydrophobicContact CG2-CG1 4.02Å; R148-V152 WeakPolarHBondContact O-CG2 3.34Å; R148-V152 PolarHBondContact O-N 3.32Å; R148-V152 VanDerWaalsContact O-N 3.07Å; F149-V152 PolarHBondContact O-N 2.88Å; F149-V152 VanDerWaalsContact O-N 3.16Å; V152-R154 PolarHBondContact O-N 2.98Å; V152-Q155 WeakPolarHBondContact O-CB 3.33Å; V152-Q155 PolarHBondContact O-N 3.44Å; V152-Y156 PolarHBondContact O-N 3.15Å
153M91.3Very high89.2Confident2 Ų240 Ų401%0.0119%0.192CC..Hα-helixtrans-66.5-35.4178-64.5-48.7-59.300112.6L69 A107 F149 Q150 Y156 N157 L234 L237 F238L69-M153 HydrophobicContact CD2-SD 4Å; A107-M153 HydrophobicContact CB-CE 3.89Å; A107-M153 HydrophobicContact CB-SD 3.79Å; F149-M153 HydrophobicContact CD2-CG 4.14Å; F149-M153 HydrophobicContact CE1-CG 4.23Å; F149-M153 HydrophobicContact CE2-CG 3.74Å; F149-M153 HydrophobicContact CE2-SD 3.84Å; F149-M153 HydrophobicContact CZ-CG 3.79Å; F149-M153 HydrophobicContact CZ-SD 4.15Å; F149-M153 WeakPolarHBondContact O-CG 3.48Å; F149-M153 PolarHBondContact O-N 3.48Å; Q150-M153 PolarHBondContact O-N 3.38Å; M153-Y156 HydrophobicContact CE-CD1 3.94Å; M153-Y156 WeakPolarHBondContact O-CB 3.2Å; M153-Y156 PolarHBondContact O-N 3.48Å; M153-N157 PolarHBondContact O-N 3.14Å; M153-L234 HydrophobicContact CE-CD1 3.23Å; M153-L237 HydrophobicContact CE-CD2 3.92Å; M153-F238 HydrophobicContact CB-CE1 3.61Å; M153-F238 HydrophobicContact CB-CZ 3.81Å; M153-F238 WeakPolarHBondContact O-CZ 2.87Å
154R90Very high89.1Confident105 Ų10540.6 Ų40.640%0.39619%0.194SC..Hα-helixtrans-61.3-44.8172.1-77.6-169.5-62.2-90.51.8111.9Q150 Q151 V152 Y156 N157 E158 F238Q150-R154 WeakPolarHBondContact O-CG 3.42Å; Q150-R154 PolarHBondContact O-N 3.22Å; Q151-R154 PolarHBondContact O-N 3.2Å; V152-R154 PolarHBondContact O-N 2.98Å; R154-Y156 VanDerWaalsContact C-N 3.27Å; R154-Y156 PolarHBondContact O-N 3.46Å; R154-N157 WeakPolarHBondContact O-CB 3.3Å; R154-N157 PolarHBondContact O-N 2.95Å; R154-E158 WeakPolarHBondContact O-CG 3.47Å; R154-E158 PolarHBondContact O-N 2.82Å; R154-F238 HydrophobicContact CG-CZ 4.47Å
155Q91.7Very high89Confident51 Ų5141.6 Ų41.624%0.23819%0.193CC..Hα-helixtrans-61.6-37.5175.5-69.7175.8400112V73 Q151 V152 E158 G159V73-Q155 HydrophobicContact CG1-CB 4.23Å; Q151-Q155 WeakPolarHBondContact O-CG 3.48Å; Q151-Q155 PolarHBondContact O-N 3.48Å; Q151-Q155 VanDerWaalsContact O-N 3.1Å; V152-Q155 WeakPolarHBondContact O-CB 3.33Å; V152-Q155 PolarHBondContact O-N 3.44Å; Q155-E158 PolarHBondContact O-N 2.6Å; Q155-G159 PolarHBondContact O-N 3Å
156Y91.4Very high88.5Confident11 Ų1144.3 Ų44.34%0.04320%0.202CC..Hα-helixtrans-63.7-43174.7-177.7-125000112V73 F76 T100 I103 V152 M153 R154 E158 G159 L160 L234V73-Y156 HydrophobicContact CG1-CD2 4.39Å; V73-Y156 HydrophobicContact CG2-CD2 4.14Å; V73-Y156 HydrophobicContact CG2-CG 4.22Å; F76-Y156 HydrophobicContact CD1-CD2 4.08Å; F76-Y156 AromaticContact CD1-CE2 3.94Å; F76-Y156 HydrophobicContact CD1-CE2 3.94Å; F76-Y156 HydrophobicContact CE1-CD2 4.35Å; F76-Y156 HydrophobicContact CE1-CE2 4.01Å; F76-Y156 HydrophobicContact CG-CE2 4.24Å; F76-Y156 HydrophobicContact CZ-CE2 4.37Å; T100-Y156 WeakPolarHBondContact CG2-OH 3.27Å; I103-Y156 HydrophobicContact CD1-CD2 4.28Å; I103-Y156 HydrophobicContact CD1-CE2 3.91Å; I103-Y156 HydrophobicContact CG2-CD1 4.1Å; I103-Y156 HydrophobicContact CG2-CD2 4.11Å; I103-Y156 HydrophobicContact CG2-CE1 3.85Å; I103-Y156 HydrophobicContact CG2-CE2 3.89Å; I103-Y156 HydrophobicContact CG2-CG 4.22Å; V152-Y156 PolarHBondContact O-N 3.15Å; M153-Y156 HydrophobicContact CE-CD1 3.94Å; M153-Y156 WeakPolarHBondContact O-CB 3.2Å; M153-Y156 PolarHBondContact O-N 3.48Å; R154-Y156 VanDerWaalsContact C-N 3.27Å; R154-Y156 PolarHBondContact O-N 3.46Å; Y156-E158 PolarHBondContact O-N 3.03Å; Y156-G159 WeakPolarHBondContact O-CA 3.46Å; Y156-G159 PolarHBondContact O-N 3.38Å; Y156-G159 VanDerWaalsContact O-N 3.14Å; Y156-L160 HydrophobicContact CD1-CD1 4.2Å; Y156-L160 HydrophobicContact CE1-CD1 3.78Å; Y156-L160 HydrophobicContact CE1-CG 4.34Å; Y156-L160 HydrophobicContact CE2-CD2 4.33Å; Y156-L160 HydrophobicContact CE2-CG 4.25Å; Y156-L160 PolarHBondContact O-N 2.94Å; Y156-L234 HydrophobicContact CD1-CD1 4.37Å; Y156-L234 HydrophobicContact CD1-CD2 3.93Å; Y156-L234 HydrophobicContact CE1-CD2 4.39Å
157N90.1Very high88.2Confident44 Ų4444 Ų4424%0.23520%0.201CC..Hα-helixtrans-59.4-45.4174.9-17265.1000112.5M153 R154 G159 L160 L161 L234 F238M153-N157 PolarHBondContact O-N 3.14Å; R154-N157 WeakPolarHBondContact O-CB 3.3Å; R154-N157 PolarHBondContact O-N 2.95Å; N157-G159 VanDerWaalsContact C-N 3.26Å; N157-G159 PolarHBondContact O-N 2.98Å; N157-L160 PolarHBondContact O-N 3.26Å; N157-L160 VanDerWaalsContact O-N 3.15Å; N157-L161 WeakPolarHBondContact O-CG 3.4Å; N157-L161 PolarHBondContact O-N 3.41Å; N157-L234 HydrophobicContact CB-CD2 3.7Å; N157-F238 HydrophobicContact CB-CE2 4Å; N157-F238 HydrophobicContact CB-CZ 4.33Å
158E89.3Confident88Confident119 Ų11940.1 Ų40.156%0.55619%0.187SC*.Hα-helixtrans-59.5-38.7174.8-70.3171.3-174.400111.8R154 Q155 Y156 T162R154-E158 WeakPolarHBondContact O-CG 3.47Å; R154-E158 PolarHBondContact O-N 2.82Å; Q155-E158 PolarHBondContact O-N 2.6Å; Y156-E158 PolarHBondContact O-N 3.03Å; E158-T162 WeakPolarHBondContact O-CB 3.3Å; E158-T162 PolarHBondContact O-N 2.86Å; E158-T162 PolarHBondContact O-OG1 3.34Å
159G88Confident87.7Confident5 Ų541.3 Ų41.35%0.05220%0.196CC..Hα-helixtrans-63.2-41.7173.500000113.2Q155 Y156 N157 K163Q155-G159 PolarHBondContact O-N 3Å; Y156-G159 WeakPolarHBondContact O-CA 3.46Å; Y156-G159 PolarHBondContact O-N 3.38Å; Y156-G159 VanDerWaalsContact O-N 3.14Å; N157-G159 VanDerWaalsContact C-N 3.26Å; N157-G159 PolarHBondContact O-N 2.98Å; G159-K163 PolarHBondContact O-N 3.44Å
160L86.3Confident87.2Confident1 Ų142.8 Ų42.81%0.00520%0.202CC..Hα-helixtrans-65.3-46.2176.3-72.3174.9000111.7F76 Y156 N157 T162 K163 Q164 L227 M231 L234F76-L160 HydrophobicContact CE1-CD2 4.21Å; F76-L160 HydrophobicContact CZ-CD2 3.83Å; Y156-L160 HydrophobicContact CD1-CD1 4.2Å; Y156-L160 HydrophobicContact CE1-CD1 3.78Å; Y156-L160 HydrophobicContact CE1-CG 4.34Å; Y156-L160 HydrophobicContact CE2-CD2 4.33Å; Y156-L160 HydrophobicContact CE2-CG 4.25Å; Y156-L160 PolarHBondContact O-N 2.94Å; N157-L160 PolarHBondContact O-N 3.26Å; N157-L160 VanDerWaalsContact O-N 3.15Å; L160-T162 VanDerWaalsContact C-N 3.34Å; L160-T162 PolarHBondContact O-N 3.38Å; L160-K163 WeakPolarHBondContact O-CB 3.48Å; L160-K163 PolarHBondContact O-N 2.86Å; L160-K163 VanDerWaalsContact O-N 3.1Å; L160-Q164 PolarHBondContact O-N 2.96Å; L160-L227 WeakPolarHBondContact O-CD2 3.47Å; L160-M231 HydrophobicContact CB-CG 4.12Å; L160-M231 HydrophobicContact CD1-CG 4.12Å; L160-L234 HydrophobicContact CD1-CD2 3.82Å
161L86.4Confident86.7Confident65 Ų6542.1 Ų42.134%0.3420%0.199SC..Hα-helixtrans-57.6-47.4175-73.2168.6000111.3N157 K163 Q164 D165 M231N157-L161 WeakPolarHBondContact O-CG 3.4Å; N157-L161 PolarHBondContact O-N 3.41Å; L161-K163 PolarHBondContact O-N 2.85Å; L161-Q164 WeakPolarHBondContact O-CB 3.35Å; L161-Q164 PolarHBondContact O-N 3.48Å; L161-Q164 VanDerWaalsContact O-N 3.09Å; L161-D165 PolarHBondContact O-N 3.44Å; L161-M231 HydrophobicContact CD2-CE 3.32Å; L161-M231 HydrophobicContact CG-CE 3.96Å
162T86.7Confident86.4Confident61 Ų6140.1 Ų40.137%0.37419%0.19SC..Hα-helixtrans-58.3-37.8176.5-60.10000112E158 L160 R166E158-T162 WeakPolarHBondContact O-CB 3.3Å; E158-T162 PolarHBondContact O-N 2.86Å; E158-T162 PolarHBondContact O-OG1 3.34Å; L160-T162 VanDerWaalsContact C-N 3.34Å; L160-T162 PolarHBondContact O-N 3.38Å; T162-R166 WeakPolarHBondContact O-CD 3.36Å; T162-R166 WeakPolarHBondContact O-CG 3.41Å; T162-R166 PolarHBondContact O-N 2.94Å
163K82.9Confident85.9Confident19 Ų1947.2 Ų47.28%0.08322%0.217CC..Hα-helixtrans-70.8-42.4176.1-178.3-174.6-179.2-168.30111.4F76 Q80 E96 G159 L160 L161 D165 R166 C167 L227F76-K163 HydrophobicContact CZ-CD 4.15Å; Q80-K163 HydrophobicContact CG-CB 4.06Å; Q80-K163 HydrophobicContact CG-CG 4.47Å; Q80-K163 VanDerWaalsContact OE1-CG 3.29Å; E96-K163 WeakPolarHBondContact OE1-CD 3.48Å; E96-K163 WeakPolarHBondContact OE1-CE 3.38Å; E96-K163 IonicContact OE1-NZ 2.6Å; E96-K163 PolarHBondContact OE1-NZ 3.37Å; G159-K163 PolarHBondContact O-N 3.44Å; L160-K163 WeakPolarHBondContact O-CB 3.48Å; L160-K163 PolarHBondContact O-N 2.86Å; L160-K163 VanDerWaalsContact O-N 3.1Å; L161-K163 PolarHBondContact O-N 2.85Å; K163-D165 PolarHBondContact O-N 3.17Å; K163-R166 PolarHBondContact O-N 3.09Å; K163-C167 PolarHBondContact O-N 3.22Å; K163-C167 PolarHBondContact O-SG 3.44Å; K163-L227 HydrophobicContact CB-CD2 3.81Å; K163-L227 HydrophobicContact CD-CD1 3.7Å; K163-L227 HydrophobicContact CD-CD2 3.8Å; K163-L227 HydrophobicContact CD-CG 4.03Å; K163-L227 VanDerWaalsContact CE-CD1 3.5Å; K163-L227 HydrophobicContact CG-CD1 4.18Å; K163-L227 HydrophobicContact CG-CD2 3.72Å; K163-L227 HydrophobicContact CG-CG 4.44Å
164Q84.1Confident85.3Confident18 Ų1847.9 Ų47.98%0.08422%0.22CC..Hα-helixtrans-56.7-50.3177-167.8-163.823.700110.6L160 L161 R166 C167 K168 L224 L227 E228L160-Q164 PolarHBondContact O-N 2.96Å; L161-Q164 WeakPolarHBondContact O-CB 3.35Å; L161-Q164 PolarHBondContact O-N 3.48Å; L161-Q164 VanDerWaalsContact O-N 3.09Å; Q164-R166 VanDerWaalsContact C-N 3.32Å; Q164-R166 PolarHBondContact O-N 3.11Å; Q164-C167 PolarHBondContact O-N 3.22Å; Q164-K168 WeakPolarHBondContact O-CG 3.24Å; Q164-K168 PolarHBondContact O-N 2.93Å; Q164-L224 HydrophobicContact CB-CD1 4.46Å; Q164-L224 HydrophobicContact CG-CD1 3.66Å; Q164-L227 HydrophobicContact CB-CD2 3.83Å; Q164-L227 VanDerWaalsContact N-CD2 3.34Å; Q164-E228 PolarHBondContact NE2-OE1 3.27Å
165D85.2Confident84.8Confident70 Ų7042.9 Ų42.937%0.37420%0.201SC..Hα-helixtrans-58.6-44.6177.8-68.8-19.3000111.3L161 K163 C167 K168 H169L161-D165 PolarHBondContact O-N 3.44Å; K163-D165 PolarHBondContact O-N 3.17Å; D165-C167 PolarHBondContact O-N 3.06Å; D165-K168 PolarHBondContact O-N 3.49Å; D165-H169 WeakPolarHBondContact O-CB 3.42Å; D165-H169 PolarHBondContact O-N 2.87Å; D165-H169 PolarHBondContact O-ND1 3.27Å
166R82.2Confident84.4Confident70 Ų7044.6 Ų44.626%0.26421%0.209SC..Hα-helixtrans-62.6-41.2177.8-73.1168-174.8-119-7.1112.6Q80 K81 V84 T162 K163 Q164 F170Q80-R166 PolarHBondContact O-NH1 3.44Å; K81-R166 VanDerWaalsContact CA-NH1 3.28Å; K81-R166 PolarHBondContact O-NH1 2.94Å; V84-R166 HydrophobicContact CG2-CB 4.31Å; V84-R166 HydrophobicContact CG2-CG 3.99Å; T162-R166 WeakPolarHBondContact O-CD 3.36Å; T162-R166 WeakPolarHBondContact O-CG 3.41Å; T162-R166 PolarHBondContact O-N 2.94Å; K163-R166 PolarHBondContact O-N 3.09Å; Q164-R166 VanDerWaalsContact C-N 3.32Å; Q164-R166 PolarHBondContact O-N 3.11Å; R166-F170 WeakPolarHBondContact O-CB 3.45Å; R166-F170 PolarHBondContact O-N 3.02Å
167C81.1Confident83.7Confident4 Ų448.3 Ų48.33%0.02723%0.229CC..Hα-helixtrans-63.5-44.3176-73.40000111K163 Q164 D165 F170 I171 L224K163-C167 PolarHBondContact O-N 3.22Å; K163-C167 PolarHBondContact O-SG 3.44Å; Q164-C167 PolarHBondContact O-N 3.22Å; D165-C167 PolarHBondContact O-N 3.06Å; C167-F170 PolarHBondContact O-N 2.94Å; C167-I171 WeakPolarHBondContact O-CG1 3.46Å; C167-I171 PolarHBondContact O-N 3.35Å; C167-L224 HydrophobicContact CB-CD1 4.03Å
168K83.5Confident83Confident19 Ų1947.1 Ų47.18%0.08322%0.223CC..Hα-helixtrans-59.4-52.8175.1-69.4179.1-174.11770111.7Q164 D165 F170 I171 M172 V187 N188 L224Q164-K168 WeakPolarHBondContact O-CG 3.24Å; Q164-K168 PolarHBondContact O-N 2.93Å; D165-K168 PolarHBondContact O-N 3.49Å; K168-F170 VanDerWaalsContact C-N 3.26Å; K168-F170 PolarHBondContact O-N 3.4Å; K168-I171 PolarHBondContact O-N 3.38Å; K168-I171 VanDerWaalsContact O-N 3.11Å; K168-M172 WeakPolarHBondContact O-CG 3.42Å; K168-M172 PolarHBondContact O-N 2.86Å; K168-V187 HydrophobicContact CB-CG1 4.37Å; K168-V187 HydrophobicContact CG-CG1 4.25Å; K168-N188 WeakPolarHBondContact CD-OD1 3.4Å; K168-N188 WeakPolarHBondContact CE-OD1 3.44Å; K168-N188 PolarHBondContact NZ-OD1 3.43Å; K168-L224 HydrophobicContact CG-CD1 4.49Å; K168-L224 HydrophobicContact CG-CD2 4.06Å
169H84.7Confident82.2Confident115 Ų11548.6 Ų48.653%0.53223%0.229SC..Hα-helixtrans-58.7-37.8178.3-76.381.7000112.3D165 R173D165-H169 WeakPolarHBondContact O-CB 3.42Å; D165-H169 PolarHBondContact O-N 2.87Å; D165-H169 PolarHBondContact O-ND1 3.27Å; H169-R173 VanDerWaalsContact O-CB 3.29Å; H169-R173 WeakPolarHBondContact O-CB 3.48Å; H169-R173 PolarHBondContact O-N 2.87Å
170F81.8Confident81.6Confident31 Ų3150.8 Ų50.814%0.13624%0.237CC..Hα-helixtrans-64.7-46.4175.7-176.5-85000111.6M87 R166 C167 K168 R173 Q174 R220M87-F170 HydrophobicContact CB-CE2 4.17Å; M87-F170 HydrophobicContact CE-CB 3.89Å; M87-F170 HydrophobicContact CE-CD2 3.67Å; M87-F170 HydrophobicContact CE-CG 4.04Å; M87-F170 HydrophobicContact CG-CD2 4.48Å; M87-F170 HydrophobicContact SD-CB 4.14Å; M87-F170 HydrophobicContact SD-CD1 4.47Å; M87-F170 HydrophobicContact SD-CD2 3.51Å; M87-F170 VanDerWaalsContact SD-CD2 3.51Å; M87-F170 HydrophobicContact SD-CE2 3.99Å; M87-F170 HydrophobicContact SD-CG 3.78Å; R166-F170 WeakPolarHBondContact O-CB 3.45Å; R166-F170 PolarHBondContact O-N 3.02Å; C167-F170 PolarHBondContact O-N 2.94Å; K168-F170 VanDerWaalsContact C-N 3.26Å; K168-F170 PolarHBondContact O-N 3.4Å; F170-R173 PolarHBondContact O-N 3.5Å; F170-Q174 HydrophobicContact CD1-CG 3.9Å; F170-Q174 HydrophobicContact CE1-CG 3.48Å; F170-Q174 VanDerWaalsContact CE1-CG 3.48Å; F170-Q174 HydrophobicContact CZ-CG 3.88Å; F170-Q174 WeakPolarHBondContact O-CG 3.27Å; F170-Q174 PolarHBondContact O-N 2.71Å; F170-R220 HydrophobicContact CD1-CB 4.44Å; F170-R220 HydrophobicContact CD1-CG 3.63Å; F170-R220 HydrophobicContact CE1-CG 3.7Å
171I80.1Confident80.9Confident0 Ų056.1 Ų56.10%028%0.275CS..Hα-helixtrans-61-48.8177.9-68.2170.2000110.1C167 K168 R173 Q174 L175 V187 M190 I217 R220 L224C167-I171 WeakPolarHBondContact O-CG1 3.46Å; C167-I171 PolarHBondContact O-N 3.35Å; K168-I171 PolarHBondContact O-N 3.38Å; K168-I171 VanDerWaalsContact O-N 3.11Å; I171-R173 VanDerWaalsContact C-N 3.32Å; I171-R173 PolarHBondContact O-N 3.27Å; I171-Q174 PolarHBondContact O-N 2.67Å; I171-L175 HydrophobicContact CG2-CD1 3.74Å; I171-L175 HydrophobicContact CG2-CG 4.4Å; I171-L175 WeakPolarHBondContact O-CG 3.49Å; I171-L175 PolarHBondContact O-N 2.9Å; I171-V187 HydrophobicContact CG2-CG1 4.49Å; I171-M190 HydrophobicContact CD1-CE 4.25Å; I171-I217 HydrophobicContact CG1-CG2 4.29Å; I171-I217 HydrophobicContact CG2-CG2 4.13Å; I171-R220 HydrophobicContact CD1-CB 4.11Å; I171-R220 HydrophobicContact CG1-CB 3.91Å; I171-L224 HydrophobicContact CD1-CD2 3.93Å
172M83.8Confident80.6Confident33 Ų3353.8 Ų53.816%0.16326%0.263CS..Hα-helixtrans-54.8-49.2176-68.5174.674.400111K168 Q174 L175 E176 E184 V187K168-M172 WeakPolarHBondContact O-CG 3.42Å; K168-M172 PolarHBondContact O-N 2.86Å; M172-Q174 VanDerWaalsContact C-N 3.34Å; M172-Q174 PolarHBondContact O-N 3.13Å; M172-L175 PolarHBondContact O-N 3.24Å; M172-L175 VanDerWaalsContact O-N 3.15Å; M172-E176 WeakPolarHBondContact O-CG 3.23Å; M172-E176 PolarHBondContact O-N 2.87Å; M172-E184 HydrophobicContact CE-CB 4.19Å; M172-E184 HydrophobicContact SD-CB 4.27Å; M172-E184 HydrophobicContact SD-CG 4.34Å; M172-V187 HydrophobicContact CG-CG2 3.67Å
173R84.1Confident80.5Confident148 Ų14854.1 Ų54.156%0.55827%0.265SS*.Hα-helixtrans-62.9-39179.7-175.456.5174.3-179.90.9112.9H169 F170 I171 E176 I177H169-R173 VanDerWaalsContact O-CB 3.29Å; H169-R173 WeakPolarHBondContact O-CB 3.48Å; H169-R173 PolarHBondContact O-N 2.87Å; F170-R173 PolarHBondContact O-N 3.5Å; I171-R173 VanDerWaalsContact C-N 3.32Å; I171-R173 PolarHBondContact O-N 3.27Å; R173-E176 WeakPolarHBondContact CD-OE2 3.46Å; R173-E176 IonicContact CZ-OE2 2.64Å; R173-E176 IonicContact NH1-OE2 3.45Å; R173-E176 PolarHBondContact NH1-OE2 3.25Å; R173-I177 HydrophobicContact CG-CD1 4.34Å; R173-I177 WeakPolarHBondContact O-CD1 3.01Å; R173-I177 VanDerWaalsContact O-CG1 3.26Å; R173-I177 WeakPolarHBondContact O-CG1 3.46Å; R173-I177 PolarHBondContact O-N 3.4Å; R173-I177 VanDerWaalsContact O-N 3.14Å
174Q77.9Confident80.5Confident16 Ų1657 Ų578%0.07528%0.279CS..Hα-helixtrans-66.7-38.8175.6-69.7-54.2-46.200111.4F170 I171 M172 I177 L178 I217F170-Q174 HydrophobicContact CD1-CG 3.9Å; F170-Q174 HydrophobicContact CE1-CG 3.48Å; F170-Q174 VanDerWaalsContact CE1-CG 3.48Å; F170-Q174 HydrophobicContact CZ-CG 3.88Å; F170-Q174 WeakPolarHBondContact O-CG 3.27Å; F170-Q174 PolarHBondContact O-N 2.71Å; I171-Q174 PolarHBondContact O-N 2.67Å; M172-Q174 VanDerWaalsContact C-N 3.34Å; M172-Q174 PolarHBondContact O-N 3.13Å; Q174-I177 PolarHBondContact O-N 3.39Å; Q174-L178 VanDerWaalsContact O-CG 3.27Å; Q174-L178 WeakPolarHBondContact O-CG 3.37Å; Q174-L178 PolarHBondContact O-N 3.5Å; Q174-I217 HydrophobicContact CB-CD1 3.83Å; Q174-I217 HydrophobicContact CB-CG1 3.71Å; Q174-I217 HydrophobicContact CG-CG1 4.14Å
175L78.8Confident80.5Confident0 Ų062.5 Ų62.50%031%0.305CS..Hα-helixtrans-68.4-38.5176.6-67.6169000112I171 M172 I177 L178 K180 V182 W196 F199 L203I171-L175 HydrophobicContact CG2-CD1 3.74Å; I171-L175 HydrophobicContact CG2-CG 4.4Å; I171-L175 WeakPolarHBondContact O-CG 3.49Å; I171-L175 PolarHBondContact O-N 2.9Å; M172-L175 PolarHBondContact O-N 3.24Å; M172-L175 VanDerWaalsContact O-N 3.15Å; L175-I177 PolarHBondContact O-N 2.95Å; L175-L178 CarbonylContact O-C 3.59Å; L175-L178 WeakPolarHBondContact O-CA 3.44Å; L175-L178 WeakPolarHBondContact O-CB 3.46Å; L175-L178 PolarHBondContact O-N 2.79Å; L175-K180 CarbonylContact C-O 3.58Å; L175-K180 PolarHBondContact O-N 3.03Å; L175-K180 VanDerWaalsContact O-N 3.1Å; L175-K180 VanDerWaalsContact O-O 3.07Å; L175-V182 HydrophobicContact CB-CG2 4.13Å; L175-V182 HydrophobicContact CD1-CB 4.27Å; L175-V182 HydrophobicContact CD1-CG1 4.49Å; L175-V182 HydrophobicContact CD1-CG2 3.94Å; L175-W196 HydrophobicContact CD2-CH2 4.37Å; L175-F199 HydrophobicContact CD1-CD1 4.47Å; L175-L203 HydrophobicContact CD2-CD1 4.08Å
176E82.8Confident80.4Confident88 Ų8863.3 Ų63.341%0.41131%0.306SS..Hα-helixtrans-60-42.2173.2-76.1176-178.500112.6M172 R173 L178 E179 K180M172-E176 WeakPolarHBondContact O-CG 3.23Å; M172-E176 PolarHBondContact O-N 2.87Å; R173-E176 WeakPolarHBondContact CD-OE2 3.46Å; R173-E176 IonicContact CZ-OE2 2.64Å; R173-E176 IonicContact NH1-OE2 3.45Å; R173-E176 PolarHBondContact NH1-OE2 3.25Å; E176-L178 PolarHBondContact O-N 2.92Å; E176-E179 PolarHBondContact O-N 3.48Å; E176-K180 PolarHBondContact N-O 3.5Å
177I78.6Confident80.4Confident89 Ų8960 Ų6046%0.45629%0.294SS..Hα-helixtrans-61-27.3176.5-70.8165000111R173 Q174 L175 E179R173-I177 HydrophobicContact CG-CD1 4.34Å; R173-I177 WeakPolarHBondContact O-CD1 3.01Å; R173-I177 VanDerWaalsContact O-CG1 3.26Å; R173-I177 WeakPolarHBondContact O-CG1 3.46Å; R173-I177 PolarHBondContact O-N 3.4Å; R173-I177 VanDerWaalsContact O-N 3.14Å; Q174-I177 PolarHBondContact O-N 3.39Å; L175-I177 PolarHBondContact O-N 2.95Å; I177-E179 PolarHBondContact O-N 3.27Å
178L74.4Confident80.5Confident19 Ų1962.3 Ų62.310%0.09931%0.306CS..THydrogen-bonded Turntrans-88.217.5176.4-59.9175.5000112.8Q174 L175 E176 K180 L203 I209 I217Q174-L178 VanDerWaalsContact O-CG 3.27Å; Q174-L178 WeakPolarHBondContact O-CG 3.37Å; Q174-L178 PolarHBondContact O-N 3.5Å; L175-L178 CarbonylContact O-C 3.59Å; L175-L178 WeakPolarHBondContact O-CA 3.44Å; L175-L178 WeakPolarHBondContact O-CB 3.46Å; L175-L178 PolarHBondContact O-N 2.79Å; E176-L178 PolarHBondContact O-N 2.92Å; L178-K180 PolarHBondContact O-N 3.23Å; L178-K180 VanDerWaalsContact O-N 3.11Å; L178-L203 HydrophobicContact CD1-CD1 4.41Å; L178-L203 HydrophobicContact CD1-CD2 3.71Å; L178-L203 HydrophobicContact CD1-CG 4.3Å; L178-I209 HydrophobicContact CD1-CD1 4.15Å; L178-I209 HydrophobicContact CD2-CD1 4.06Å; L178-I209 HydrophobicContact CD2-CG1 3.71Å; L178-I209 HydrophobicContact CG-CD1 4.47Å; L178-I217 HydrophobicContact CD1-CD1 4.02Å
179E73.6Confident80.4Confident150 Ų15067.5 Ų67.570%0.70133%0.331SS*.THydrogen-bonded Turntrans60.118.3-179.6-60.7176.3-169.300113.8E176 I177 R208E176-E179 PolarHBondContact O-N 3.48Å; I177-E179 PolarHBondContact O-N 3.27Å; E179-R208 IonicContact OE1-NH1 3.93Å; E179-R208 PolarHBondContact OE1-NH1 3.39Å; E179-R208 IonicContact OE2-NH1 3.95Å
180K73.6Confident80.3Confident50 Ų5062.3 Ų62.322%0.21731%0.306CS..  trans-102.4104.4169.6-69.6-168.5178.9-1740109.8L175 E176 L178 V182 F199 L203L175-K180 CarbonylContact C-O 3.58Å; L175-K180 PolarHBondContact O-N 3.03Å; L175-K180 VanDerWaalsContact O-N 3.1Å; L175-K180 VanDerWaalsContact O-O 3.07Å; E176-K180 PolarHBondContact N-O 3.5Å; L178-K180 PolarHBondContact O-N 3.23Å; L178-K180 VanDerWaalsContact O-N 3.11Å; K180-V182 HydrophobicContact CB-CG2 4.31Å; K180-V182 PolarHBondContact O-N 3.42Å; K180-F199 PolarHBondContact NZ-O 2.96Å; K180-F199 VanDerWaalsContact NZ-O 3.1Å; K180-L203 HydrophobicContact CD-CD1 4.03Å
181S73.4Confident80.2Confident114 Ų11461.3 Ų61.380%0.79730%0.303SS*.  trans-71.4116166.956.70000108.8
182V78.5Confident80.2Confident16 Ų1665.5 Ų65.510%0.09734%0.338CS..  trans-120.3133.1176.7-176.40000108L175 K180 E186 V187 F199L175-V182 HydrophobicContact CB-CG2 4.13Å; L175-V182 HydrophobicContact CD1-CB 4.27Å; L175-V182 HydrophobicContact CD1-CG1 4.49Å; L175-V182 HydrophobicContact CD1-CG2 3.94Å; K180-V182 HydrophobicContact CB-CG2 4.31Å; K180-V182 PolarHBondContact O-N 3.42Å; V182-E186 WeakPolarHBondContact CA-OE2 3.46Å; V182-E186 HydrophobicContact CG1-CB 3.58Å; V182-E186 WeakPolarHBondContact CG1-OE2 3.47Å; V182-V187 HydrophobicContact CG1-CG2 3.76Å; V182-F199 HydrophobicContact CG1-CE1 3.74Å; V182-F199 HydrophobicContact CG1-CZ 3.75Å; V182-F199 HydrophobicContact CG2-CD1 4.4Å; V182-F199 HydrophobicContact CG2-CE1 3.88Å
183T84.9Confident80Confident67 Ų6767.3 Ų67.341%0.41135%0.351SS..  trans-76.2160.3177.158.20000111.1E185 E186 V187T183-E185 WeakPolarHBondContact CB-OE2 3.32Å; T183-E185 PolarHBondContact O-N 3.23Å; T183-E186 PolarHBondContact N-OE2 3.49Å; T183-E186 PolarHBondContact O-N 3.45Å; T183-E186 VanDerWaalsContact OG1-CD 3.25Å; T183-E186 VanDerWaalsContact OG1-CG 3.23Å; T183-E186 WeakPolarHBondContact OG1-CG 3.46Å; T183-E186 PolarHBondContact OG1-N 2.9Å; T183-E186 PolarHBondContact OG1-OE2 2.74Å; T183-V187 PolarHBondContact O-N 2.92Å
184E83.6Confident79.5Confident80 Ų8061.7 Ų61.737%0.37434%0.339SS..Hα-helixtrans-64-34.8177.6-167.3-177.1159.100110.9M172 V187 N188M172-E184 HydrophobicContact CE-CB 4.19Å; M172-E184 HydrophobicContact SD-CB 4.27Å; M172-E184 HydrophobicContact SD-CG 4.34Å; E184-V187 PolarHBondContact O-N 3.37Å; E184-N188 WeakPolarHBondContact O-CB 3.29Å; E184-N188 PolarHBondContact O-N 3.18Å; E184-N188 PolarHBondContact O-ND2 2.84Å; E184-N188 VanDerWaalsContact O-ND2 3.13Å
185E84.3Confident79.3Confident134 Ų13465.4 Ų65.463%0.62636%0.359SS*.Hα-helixtrans-60.2-44.5176.5-6774.9-16500112.2T183 V187 N188 E189T183-E185 WeakPolarHBondContact CB-OE2 3.32Å; T183-E185 PolarHBondContact O-N 3.23Å; E185-V187 PolarHBondContact O-N 3.24Å; E185-N188 WeakPolarHBondContact O-CB 3.46Å; E185-N188 PolarHBondContact O-N 3.09Å; E185-E189 PolarHBondContact O-N 3.28Å
186E82Confident79Confident86 Ų8666.5 Ų66.540%0.40236%0.363SS..Hα-helixtrans-65.9-37.2177-73.3165.7143.600111.9V182 T183 E189 M190 F199V182-E186 WeakPolarHBondContact CA-OE2 3.46Å; V182-E186 HydrophobicContact CG1-CB 3.58Å; V182-E186 WeakPolarHBondContact CG1-OE2 3.47Å; T183-E186 PolarHBondContact N-OE2 3.49Å; T183-E186 PolarHBondContact O-N 3.45Å; T183-E186 VanDerWaalsContact OG1-CD 3.25Å; T183-E186 VanDerWaalsContact OG1-CG 3.23Å; T183-E186 WeakPolarHBondContact OG1-CG 3.46Å; T183-E186 PolarHBondContact OG1-N 2.9Å; T183-E186 PolarHBondContact OG1-OE2 2.74Å; E186-E189 PolarHBondContact O-N 2.94Å; E186-M190 PolarHBondContact O-N 2.89Å; E186-F199 HydrophobicContact CB-CZ 4.43Å
187V82.2Confident78.3Confident0 Ų068.7 Ų68.70%037%0.374CS..Hα-helixtrans-67.3-40.1173.6176.90000110.8K168 I171 M172 V182 T183 E184 E185 E189 M190 V191K168-V187 HydrophobicContact CB-CG1 4.37Å; K168-V187 HydrophobicContact CG-CG1 4.25Å; I171-V187 HydrophobicContact CG2-CG1 4.49Å; M172-V187 HydrophobicContact CG-CG2 3.67Å; V182-V187 HydrophobicContact CG1-CG2 3.76Å; T183-V187 PolarHBondContact O-N 2.92Å; E184-V187 PolarHBondContact O-N 3.37Å; E185-V187 PolarHBondContact O-N 3.24Å; V187-E189 VanDerWaalsContact C-N 3.35Å; V187-M190 HydrophobicContact CG1-CE 4.04Å; V187-M190 PolarHBondContact O-N 3.46Å; V187-V191 VanDerWaalsContact O-CG2 3.3Å; V187-V191 WeakPolarHBondContact O-CG2 3.38Å; V187-V191 PolarHBondContact O-N 2.97Å
188N83.2Confident77.8Confident53 Ų5369.1 Ų69.128%0.28338%0.38SS..Hα-helixtrans-63.1-40.8175.2-72-35.2000111.8K168 E184 E185 V191 A192K168-N188 WeakPolarHBondContact CD-OD1 3.4Å; K168-N188 WeakPolarHBondContact CE-OD1 3.44Å; K168-N188 PolarHBondContact NZ-OD1 3.43Å; E184-N188 WeakPolarHBondContact O-CB 3.29Å; E184-N188 PolarHBondContact O-N 3.18Å; E184-N188 PolarHBondContact O-ND2 2.84Å; E184-N188 VanDerWaalsContact O-ND2 3.13Å; E185-N188 WeakPolarHBondContact O-CB 3.46Å; E185-N188 PolarHBondContact O-N 3.09Å; N188-V191 PolarHBondContact O-N 3.19Å; N188-A192 WeakPolarHBondContact O-CB 3.37Å; N188-A192 PolarHBondContact O-N 2.85Å
189E83.1Confident77.3Confident129 Ų12969.1 Ų69.160%0.60338%0.38SS*.Hα-helixtrans-64.3-42176-172.9177.7-178.100111.7E185 E186 V187 V191 A192 T193E185-E189 PolarHBondContact O-N 3.28Å; E186-E189 PolarHBondContact O-N 2.94Å; V187-E189 VanDerWaalsContact C-N 3.35Å; E189-V191 VanDerWaalsContact C-N 3.3Å; E189-V191 PolarHBondContact O-N 3.24Å; E189-A192 PolarHBondContact O-N 3.1Å; E189-T193 HydrophobicContact CG-CG2 4.25Å; E189-T193 WeakPolarHBondContact O-CB 3.48Å; E189-T193 WeakPolarHBondContact O-CG2 3.46Å; E189-T193 PolarHBondContact O-N 3.37Å; E189-T193 PolarHBondContact O-OG1 3.05Å
190M82.3Confident76.9Confident5 Ų563.6 Ų63.63%0.02536%0.355CS..Hα-helixtrans-58.9-42.1173.3175.5-150.461.600111.8I171 E186 V187 T193 G194 N195 W196 F199I171-M190 HydrophobicContact CD1-CE 4.25Å; E186-M190 PolarHBondContact O-N 2.89Å; V187-M190 HydrophobicContact CG1-CE 4.04Å; V187-M190 PolarHBondContact O-N 3.46Å; M190-T193 PolarHBondContact O-OG1 2.93Å; M190-G194 WeakPolarHBondContact O-CA 3.43Å; M190-G194 PolarHBondContact O-N 2.86Å; M190-N195 PolarHBondContact O-N 3.15Å; M190-W196 HydrophobicContact SD-CE3 3.6Å; M190-W196 VanDerWaalsContact SD-CE3 3.6Å; M190-W196 HydrophobicContact SD-CZ3 4.05Å; M190-F199 HydrophobicContact CB-CD2 4.38Å; M190-F199 HydrophobicContact CB-CE2 3.58Å; M190-F199 HydrophobicContact CB-CZ 4.43Å; M190-F199 HydrophobicContact CG-CD2 3.98Å; M190-F199 HydrophobicContact CG-CE2 3.67Å; M190-F199 HydrophobicContact SD-CD2 3.57Å; M190-F199 VanDerWaalsContact SD-CD2 3.57Å; M190-F199 HydrophobicContact SD-CE2 3.46Å; M190-F199 WeakPolarHBondContact SD-CE2 3.47Å
191V79.6Confident76.4Confident10 Ų1068.2 Ų68.26%0.06138%0.377CS..Hα-helixtrans-65.8-44.6176.6175.60000111.3V187 N188 E189 G194 L224 E228V187-V191 VanDerWaalsContact O-CG2 3.3Å; V187-V191 WeakPolarHBondContact O-CG2 3.38Å; V187-V191 PolarHBondContact O-N 2.97Å; N188-V191 PolarHBondContact O-N 3.19Å; E189-V191 VanDerWaalsContact C-N 3.3Å; E189-V191 PolarHBondContact O-N 3.24Å; V191-G194 PolarHBondContact O-N 3.33Å; V191-L224 HydrophobicContact CG1-CG 4.15Å; V191-L224 HydrophobicContact CG2-CD2 3.2Å; V191-L224 HydrophobicContact CG2-CG 3.63Å; V191-E228 HydrophobicContact CG1-CG 3.65Å
192A79.7Confident75.7Confident89 Ų8968.5 Ų68.574%0.73637%0.37SS*.Hα-helixtrans-66-38.9-178.300000112.6N188 E189N188-A192 WeakPolarHBondContact O-CB 3.37Å; N188-A192 PolarHBondContact O-N 2.85Å; E189-A192 PolarHBondContact O-N 3.1Å
193T78.8Confident74.9Confident70 Ų7067.8 Ų67.843%0.42937%0.365SS..Hα-helixtrans-81.8-20.9177.857.40000112.7E189 M190 N195E189-T193 HydrophobicContact CG-CG2 4.25Å; E189-T193 WeakPolarHBondContact O-CB 3.48Å; E189-T193 WeakPolarHBondContact O-CG2 3.46Å; E189-T193 PolarHBondContact O-N 3.37Å; E189-T193 PolarHBondContact O-OG1 3.05Å; M190-T193 PolarHBondContact O-OG1 2.93Å; T193-N195 PolarHBondContact O-N 3.01Å; T193-N195 PolarHBondContact OG1-N 2.64Å
194G73.8Confident73.9Confident30 Ų3070.1 Ų70.131%0.30938%0.375SS..  trans67.47.4-171.900000113.9M190 V191 W196 H221M190-G194 WeakPolarHBondContact O-CA 3.43Å; M190-G194 PolarHBondContact O-N 2.86Å; V191-G194 PolarHBondContact O-N 3.33Å; G194-W196 PolarHBondContact O-N 3.1Å; G194-H221 PolarHBondContact O-CE1 3.35Å
195N73.9Confident72.9Confident95 Ų9573 Ų7351%0.50839%0.393SS..  trans-97.687.1-172.5-72.7-23.3000110.8M190 T193 E197 V198M190-N195 PolarHBondContact O-N 3.15Å; T193-N195 PolarHBondContact O-N 3.01Å; T193-N195 PolarHBondContact OG1-N 2.64Å; N195-E197 PolarHBondContact O-N 3.35Å; N195-V198 HydrophobicContact CB-CG2 4.42Å
196W73.4Confident71.9Confident22 Ų2269.7 Ų69.78%0.08338%0.379CS..THydrogen-bonded Turntrans-62.7-24.8171.8166-104.7000113.4L175 M190 G194 V198 F199 I217L175-W196 HydrophobicContact CD2-CH2 4.37Å; M190-W196 HydrophobicContact SD-CE3 3.6Å; M190-W196 VanDerWaalsContact SD-CE3 3.6Å; M190-W196 HydrophobicContact SD-CZ3 4.05Å; G194-W196 PolarHBondContact O-N 3.1Å; W196-V198 PolarHBondContact O-N 3.36Å; W196-V198 VanDerWaalsContact O-N 3.1Å; W196-F199 HydrophobicContact CE3-CB 4.44Å; W196-F199 HydrophobicContact CE3-CD2 4.16Å; W196-F199 HydrophobicContact CH2-CB 4.1Å; W196-F199 HydrophobicContact CZ3-CB 4.07Å; W196-F199 HydrophobicContact CZ3-CD2 4.02Å; W196-F199 HydrophobicContact CZ3-CG 4.42Å; W196-F199 PolarHBondContact O-N 3.44Å; W196-I217 HydrophobicContact CE3-CG2 4.27Å; W196-I217 HydrophobicContact CH2-CB 3.78Å; W196-I217 HydrophobicContact CH2-CD1 4.29Å; W196-I217 HydrophobicContact CH2-CG2 3.12Å; W196-I217 HydrophobicContact CZ2-CB 4.19Å; W196-I217 HydrophobicContact CZ2-CG2 3.97Å; W196-I217 HydrophobicContact CZ3-CB 4.36Å; W196-I217 HydrophobicContact CZ3-CG2 3.29Å
197E68.1Low70.9Confident134 Ų13472.7 Ų72.763%0.62640%0.403SS*.Hα-helixtrans-60.2-25.8-172.8-64.4-170.8158.600113.8N195 F199 N200 E201N195-E197 PolarHBondContact O-N 3.35Å; E197-F199 PolarHBondContact O-N 3.18Å; E197-F199 VanDerWaalsContact O-N 3.13Å; E197-N200 PolarHBondContact O-N 3.2Å; E197-E201 PolarHBondContact O-N 3.32Å
198V66.6Low70.1Confident99 Ų9981.2 Ų81.260%0.644%0.435SS*.Hα-helixtrans-54.7-31.9174.7-177.10000111.8N195 W196N195-V198 HydrophobicContact CB-CG2 4.42Å; W196-V198 PolarHBondContact O-N 3.36Å; W196-V198 VanDerWaalsContact O-N 3.1Å
199F65.5Low69.3Low19 Ų1980.1 Ų80.18%0.08343%0.429CS..Hα-helixtrans-91-25.3175.8-62.8-61000113.3L175 K180 V182 E186 M190 W196 E197 L203L175-F199 HydrophobicContact CD1-CD1 4.47Å; K180-F199 PolarHBondContact NZ-O 2.96Å; K180-F199 VanDerWaalsContact NZ-O 3.1Å; V182-F199 HydrophobicContact CG1-CE1 3.74Å; V182-F199 HydrophobicContact CG1-CZ 3.75Å; V182-F199 HydrophobicContact CG2-CD1 4.4Å; V182-F199 HydrophobicContact CG2-CE1 3.88Å; E186-F199 HydrophobicContact CB-CZ 4.43Å; M190-F199 HydrophobicContact CB-CD2 4.38Å; M190-F199 HydrophobicContact CB-CE2 3.58Å; M190-F199 HydrophobicContact CB-CZ 4.43Å; M190-F199 HydrophobicContact CG-CD2 3.98Å; M190-F199 HydrophobicContact CG-CE2 3.67Å; M190-F199 HydrophobicContact SD-CD2 3.57Å; M190-F199 VanDerWaalsContact SD-CD2 3.57Å; M190-F199 HydrophobicContact SD-CE2 3.46Å; M190-F199 WeakPolarHBondContact SD-CE2 3.47Å; W196-F199 HydrophobicContact CE3-CB 4.44Å; W196-F199 HydrophobicContact CE3-CD2 4.16Å; W196-F199 HydrophobicContact CH2-CB 4.1Å; W196-F199 HydrophobicContact CZ3-CB 4.07Å; W196-F199 HydrophobicContact CZ3-CD2 4.02Å; W196-F199 HydrophobicContact CZ3-CG 4.42Å; W196-F199 PolarHBondContact O-N 3.44Å; E197-F199 PolarHBondContact O-N 3.18Å; E197-F199 VanDerWaalsContact O-N 3.13Å; F199-L203 WeakPolarHBondContact O-CB 3.38Å; F199-L203 WeakPolarHBondContact O-CD1 3.31Å
200N65.4Low68.6Low34 Ų3477.4 Ų77.418%0.18242%0.421CS..Hα-helixtrans-75.4-38.1-171.7-165.538.9000114E197 N202 L203 L204E197-N200 PolarHBondContact O-N 3.2Å; N200-N202 PolarHBondContact O-N 2.98Å; N200-N202 VanDerWaalsContact O-N 3.14Å; N200-L203 PolarHBondContact O-N 3.1Å; N200-L204 PolarHBondContact O-N 3.4Å
201E62.2Low68.2Low146 Ų14688 Ų8868%0.68246%0.461SS*.THydrogen-bonded Turntrans-58.5-32.5-174.1-74.7-170.6152.300113.4E197E197-E201 PolarHBondContact O-N 3.32Å
202N59Low68Low120 Ų12091 Ų9164%0.64248%0.483SS*.THydrogen-bonded Turntrans-94.2-9.1178.9-79.6-39.4000113.1N200N200-N202 PolarHBondContact O-N 2.98Å; N200-N202 VanDerWaalsContact O-N 3.14Å
203L62.3Low67.6Low1 Ų189 Ų891%0.00546%0.458CS..THydrogen-bonded Turntrans-93.8-35.3-172.3-120.9111.7000112.1L175 L178 K180 F199 N200 N205 D206 I209 L214L175-L203 HydrophobicContact CD2-CD1 4.08Å; L178-L203 HydrophobicContact CD1-CD1 4.41Å; L178-L203 HydrophobicContact CD1-CD2 3.71Å; L178-L203 HydrophobicContact CD1-CG 4.3Å; K180-L203 HydrophobicContact CD-CD1 4.03Å; F199-L203 WeakPolarHBondContact O-CB 3.38Å; F199-L203 WeakPolarHBondContact O-CD1 3.31Å; N200-L203 PolarHBondContact O-N 3.1Å; L203-N205 VanDerWaalsContact C-N 3.26Å; L203-N205 PolarHBondContact O-N 2.92Å; L203-D206 PolarHBondContact O-N 3.36Å; L203-I209 HydrophobicContact CB-CD1 4Å; L203-I209 HydrophobicContact CD2-CD1 3.61Å; L203-I209 HydrophobicContact CD2-CG2 4.03Å; L203-I209 HydrophobicContact CG-CD1 3.38Å; L203-I209 VanDerWaalsContact O-CD1 3.27Å; L203-I209 WeakPolarHBondContact O-CD1 3.46Å; L203-L214 HydrophobicContact CB-CD1 4.28Å; L203-L214 HydrophobicContact CD2-CD1 3.43Å; L203-L214 VanDerWaalsContact CD2-CD1 3.43Å
204L62.3Low67.5Low116 Ų11686.9 Ų86.961%0.60744%0.444SS*.THydrogen-bonded Turntrans-69.3-19.7-177.4-75.3167.2000114.5N200 L214N200-L204 PolarHBondContact O-N 3.4Å; L204-L214 HydrophobicContact CD2-CD2 4.38Å
205N63.2Low67.7Low141 Ų14187.9 Ų87.975%0.75445%0.447SS*.THydrogen-bonded Turntrans-88.9-7.2-179.1-66.7-34000113.2L203L203-N205 VanDerWaalsContact C-N 3.26Å; L203-N205 PolarHBondContact O-N 2.92Å
206D63Low67.8Low65 Ų6585 Ų8535%0.34843%0.43SS..  trans-92.5119.9-176.6-164-20.9000111.4L203 R208 I209L203-D206 PolarHBondContact O-N 3.36Å; D206-R208 PolarHBondContact O-N 2.95Å; D206-R208 VanDerWaalsContact O-N 3.15Å; D206-R208 PolarHBondContact OD1-N 3.28Å; D206-R208 VanDerWaalsContact OD1-N 3.1Å; D206-I209 HydrophobicContact CB-CD1 3.8Å; D206-I209 HydrophobicContact CB-CG1 3.91Å; D206-I209 PolarHBondContact O-N 2.9Å; D206-I209 VanDerWaalsContact O-N 3.16Å
207V62.4Low68Low149 Ų14983.9 Ų83.990%0.90343%0.426SS*.THydrogen-bonded Turntrans-63.6-20.1-177.9-179.50000112.1I209V207-I209 VanDerWaalsContact C-N 3.34Å
208R64Low68.5Low178 Ų17880.8 Ų80.867%0.67241%0.411SS*.THydrogen-bonded Turntrans-79.9-15.2179.7-64.6-178.8175.6-173.72.9113.6E179 D206E179-R208 IonicContact OE1-NH1 3.93Å; E179-R208 PolarHBondContact OE1-NH1 3.39Å; E179-R208 IonicContact OE2-NH1 3.95Å; D206-R208 PolarHBondContact O-N 2.95Å; D206-R208 VanDerWaalsContact O-N 3.15Å; D206-R208 PolarHBondContact OD1-N 3.28Å; D206-R208 VanDerWaalsContact OD1-N 3.1Å
209I67Low69.1Low30 Ų3077.4 Ų77.415%0.15439%0.389CS..  trans-89.1117.5-173.4-60.4-174.3000110L178 L203 D206 V207L178-I209 HydrophobicContact CD1-CD1 4.15Å; L178-I209 HydrophobicContact CD2-CD1 4.06Å; L178-I209 HydrophobicContact CD2-CG1 3.71Å; L178-I209 HydrophobicContact CG-CD1 4.47Å; L203-I209 HydrophobicContact CB-CD1 4Å; L203-I209 HydrophobicContact CD2-CD1 3.61Å; L203-I209 HydrophobicContact CD2-CG2 4.03Å; L203-I209 HydrophobicContact CG-CD1 3.38Å; L203-I209 VanDerWaalsContact O-CD1 3.27Å; L203-I209 WeakPolarHBondContact O-CD1 3.46Å; D206-I209 HydrophobicContact CB-CD1 3.8Å; D206-I209 HydrophobicContact CB-CG1 3.91Å; D206-I209 PolarHBondContact O-N 2.9Å; D206-I209 VanDerWaalsContact O-N 3.16Å; V207-I209 VanDerWaalsContact C-N 3.34Å
210T69.3Low69.7Low72 Ų7276.8 Ų76.844%0.44239%0.386SS..  trans-80.8142.7173.763.70000110.6S212 Q213 L214T210-S212 PolarHBondContact O-N 3.43Å; T210-Q213 VanDerWaalsContact N-OE1 3.08Å; T210-Q213 PolarHBondContact O-N 2.88Å; T210-Q213 VanDerWaalsContact OG1-CG 3.31Å; T210-Q213 WeakPolarHBondContact OG1-CG 3.36Å; T210-Q213 PolarHBondContact OG1-N 2.86Å; T210-Q213 PolarHBondContact OG1-OE1 3.06Å; T210-L214 PolarHBondContact O-N 3.21Å
211R73.6Confident70.4Confident228 Ų22875.7 Ų75.786%0.8638%0.38SS*.Hα-helixtrans-53.2-27.6171.6-171.7174.1177.8156.40.9112.7S215R211-S215 WeakPolarHBondContact O-CB 3.3Å; R211-S215 PolarHBondContact O-N 2.88Å
212S74.4Confident71.3Confident74 Ų7475 Ų7552%0.51737%0.371SS..Hα-helixtrans-66.9-45.6174.6-166.90000112.4T210 S215 E216T210-S212 PolarHBondContact O-N 3.43Å; S212-S215 PolarHBondContact O-N 2.78Å; S212-E216 WeakPolarHBondContact O-CG 3.19Å; S212-E216 PolarHBondContact O-N 3.26Å
213Q72.1Confident72.3Confident45 Ų4570.3 Ų70.321%0.2135%0.345CS..Hα-helixtrans-63.9-43.2177.8-74.8164.1-53.200111.2T210 S215 E216 I217T210-Q213 VanDerWaalsContact N-OE1 3.08Å; T210-Q213 PolarHBondContact O-N 2.88Å; T210-Q213 VanDerWaalsContact OG1-CG 3.31Å; T210-Q213 WeakPolarHBondContact OG1-CG 3.36Å; T210-Q213 PolarHBondContact OG1-N 2.86Å; T210-Q213 PolarHBondContact OG1-OE1 3.06Å; Q213-S215 VanDerWaalsContact C-N 3.34Å; Q213-S215 PolarHBondContact O-N 3.45Å; Q213-E216 PolarHBondContact O-N 3.21Å; Q213-I217 WeakPolarHBondContact O-CG1 3.4Å; Q213-I217 PolarHBondContact O-N 3.4Å
214L75.8Confident73.1Confident27 Ų2770.2 Ų70.214%0.14135%0.345CS..Hα-helixtrans-59.2-46.5175.6-161.295.9000111.4L203 L204 T210 E216 I217 E218L203-L214 HydrophobicContact CB-CD1 4.28Å; L203-L214 HydrophobicContact CD2-CD1 3.43Å; L203-L214 VanDerWaalsContact CD2-CD1 3.43Å; L204-L214 HydrophobicContact CD2-CD2 4.38Å; T210-L214 PolarHBondContact O-N 3.21Å; L214-E216 VanDerWaalsContact C-N 3.31Å; L214-E216 PolarHBondContact O-N 3.02Å; L214-I217 PolarHBondContact O-N 2.79Å; L214-E218 WeakPolarHBondContact O-CB 3.4Å; L214-E218 PolarHBondContact O-N 3.44Å
215S78.3Confident74Confident51 Ų5167.8 Ų67.836%0.35733%0.332SS..Hα-helixtrans-63.4-35.3177.9-178.30000112.7R211 S212 Q213 Q219R211-S215 WeakPolarHBondContact O-CB 3.3Å; R211-S215 PolarHBondContact O-N 2.88Å; S212-S215 PolarHBondContact O-N 2.78Å; Q213-S215 VanDerWaalsContact C-N 3.34Å; Q213-S215 PolarHBondContact O-N 3.45Å; S215-Q219 VanDerWaalsContact O-CB 3.24Å; S215-Q219 WeakPolarHBondContact O-CB 3.3Å; S215-Q219 PolarHBondContact O-N 2.9Å
216E76.9Confident75Confident33 Ų3364 Ų6415%0.15432%0.317CS..Hα-helixtrans-65.3-46.1175-78.3-179.4-157.800110.6R88 S212 Q213 L214 Q219 R220R88-E216 IonicContact NE-OE1 3.99Å; R88-E216 IonicContact NE-OE2 3.9Å; S212-E216 WeakPolarHBondContact O-CG 3.19Å; S212-E216 PolarHBondContact O-N 3.26Å; Q213-E216 PolarHBondContact O-N 3.21Å; L214-E216 VanDerWaalsContact C-N 3.31Å; L214-E216 PolarHBondContact O-N 3.02Å; E216-Q219 PolarHBondContact O-N 3.26Å; E216-R220 VanDerWaalsContact O-CG 3.28Å; E216-R220 WeakPolarHBondContact O-CG 3.41Å; E216-R220 PolarHBondContact O-N 3.33Å; E216-R220 VanDerWaalsContact O-N 3.09Å
217I75.8Confident75.9Confident0 Ų061 Ų610%030%0.3CS..Hα-helixtrans-67.9-44.3-179.5-54.1163000111.1I171 Q174 L178 W196 Q213 L214 Q219 R220 H221I171-I217 HydrophobicContact CG1-CG2 4.29Å; I171-I217 HydrophobicContact CG2-CG2 4.13Å; Q174-I217 HydrophobicContact CB-CD1 3.83Å; Q174-I217 HydrophobicContact CB-CG1 3.71Å; Q174-I217 HydrophobicContact CG-CG1 4.14Å; L178-I217 HydrophobicContact CD1-CD1 4.02Å; W196-I217 HydrophobicContact CE3-CG2 4.27Å; W196-I217 HydrophobicContact CH2-CB 3.78Å; W196-I217 HydrophobicContact CH2-CD1 4.29Å; W196-I217 HydrophobicContact CH2-CG2 3.12Å; W196-I217 HydrophobicContact CZ2-CB 4.19Å; W196-I217 HydrophobicContact CZ2-CG2 3.97Å; W196-I217 HydrophobicContact CZ3-CB 4.36Å; W196-I217 HydrophobicContact CZ3-CG2 3.29Å; Q213-I217 WeakPolarHBondContact O-CG1 3.4Å; Q213-I217 PolarHBondContact O-N 3.4Å; L214-I217 PolarHBondContact O-N 2.79Å; I217-Q219 VanDerWaalsContact C-N 3.26Å; I217-Q219 PolarHBondContact O-N 3.37Å; I217-R220 PolarHBondContact O-N 3.01Å; I217-H221 PolarHBondContact O-N 3.43Å
218E79.1Confident76.8Confident68 Ų6857.1 Ų57.132%0.31827%0.273SS..Hα-helixtrans-58.3-39.6176.1-170.3-159.9143.200111.6L214 H221 R222L214-E218 WeakPolarHBondContact O-CB 3.4Å; L214-E218 PolarHBondContact O-N 3.44Å; E218-H221 PolarHBondContact O-N 3.3Å; E218-R222 PolarHBondContact O-N 3.45Å; E218-R222 IonicContact OE1-CZ 3.22Å; E218-R222 IonicContact OE1-NH1 2.72Å; E218-R222 PolarHBondContact OE1-NH1 3.05Å; E218-R222 IonicContact OE1-NH2 3.25Å; E218-R222 PolarHBondContact OE1-NH2 3.26Å
219Q79.1Confident77.8Confident28 Ų2852.3 Ų52.313%0.13126%0.26CS..Hα-helixtrans-64.3-40.7175.4-179.2169.935.800112.3M93 S215 E216 I217 R222 E223M93-Q219 HydrophobicContact CE-CG 3.6Å; M93-Q219 VanDerWaalsContact SD-CD 3.58Å; M93-Q219 HydrophobicContact SD-CG 4.19Å; M93-Q219 PolarHBondContact SD-NE2 3.12Å; S215-Q219 VanDerWaalsContact O-CB 3.24Å; S215-Q219 WeakPolarHBondContact O-CB 3.3Å; S215-Q219 PolarHBondContact O-N 2.9Å; E216-Q219 PolarHBondContact O-N 3.26Å; I217-Q219 VanDerWaalsContact C-N 3.26Å; I217-Q219 PolarHBondContact O-N 3.37Å; Q219-R222 PolarHBondContact O-N 2.98Å; Q219-E223 WeakPolarHBondContact O-CG 3.35Å; Q219-E223 PolarHBondContact O-N 3.13Å
220R78.3Confident78.4Confident7 Ų752.1 Ų52.13%0.02626%0.259CS..Hα-helixtrans-68.2-36.8176.8-63-71.5147.4-150.5-17.7111.9M87 M93 F170 I171 E216 I217 E223 L224M87-R220 PolarHBondContact O-NH2 2.91Å; M93-R220 PolarHBondContact SD-NH2 2.97Å; F170-R220 HydrophobicContact CD1-CB 4.44Å; F170-R220 HydrophobicContact CD1-CG 3.63Å; F170-R220 HydrophobicContact CE1-CG 3.7Å; I171-R220 HydrophobicContact CD1-CB 4.11Å; I171-R220 HydrophobicContact CG1-CB 3.91Å; E216-R220 VanDerWaalsContact O-CG 3.28Å; E216-R220 WeakPolarHBondContact O-CG 3.41Å; E216-R220 PolarHBondContact O-N 3.33Å; E216-R220 VanDerWaalsContact O-N 3.09Å; I217-R220 PolarHBondContact O-N 3.01Å; R220-E223 IonicContact CZ-OE1 2.91Å; R220-E223 IonicContact CZ-OE2 3.41Å; R220-E223 IonicContact NE-OE2 2.7Å; R220-E223 IonicContact NH1-OE1 3.98Å; R220-E223 PolarHBondContact NH1-OE1 2.85Å; R220-E223 IonicContact NH1-OE2 3.88Å; R220-E223 PolarHBondContact NH1-OE2 2.69Å; R220-E223 IonicContact NH2-OE1 3.21Å; R220-E223 PolarHBondContact NH2-OE1 3.46Å; R220-E223 WeakPolarHBondContact O-CB 3.48Å; R220-E223 PolarHBondContact O-N 3.43Å; R220-L224 WeakPolarHBondContact O-CB 3.35Å; R220-L224 PolarHBondContact O-N 3.38Å
221H81.1Confident79.1Confident11 Ų1150.1 Ų50.15%0.05125%0.245CC..Hα-helixtrans-59.4-47.1171.5175.3-115.2000111.4G194 I217 E218 E223 L224 L225G194-H221 PolarHBondContact O-CE1 3.35Å; I217-H221 PolarHBondContact O-N 3.43Å; E218-H221 PolarHBondContact O-N 3.3Å; H221-E223 VanDerWaalsContact C-N 3.33Å; H221-E223 PolarHBondContact O-N 3.05Å; H221-L224 WeakPolarHBondContact O-CB 3.34Å; H221-L224 PolarHBondContact O-N 2.9Å; H221-L224 VanDerWaalsContact O-N 3.14Å; H221-L225 WeakPolarHBondContact O-CG 3.41Å; H221-L225 PolarHBondContact O-N 2.86Å
222R81.4Confident79.6Confident132 Ų13244.9 Ų44.950%0.49823%0.229SC..Hα-helixtrans-59.7-40.5174.9-76.6-170.4-74.5-120.3-10.9113.2E218 Q219 S226E218-R222 PolarHBondContact O-N 3.45Å; E218-R222 IonicContact OE1-CZ 3.22Å; E218-R222 IonicContact OE1-NH1 2.72Å; E218-R222 PolarHBondContact OE1-NH1 3.05Å; E218-R222 IonicContact OE1-NH2 3.25Å; E218-R222 PolarHBondContact OE1-NH2 3.26Å; Q219-R222 PolarHBondContact O-N 2.98Å; R222-S226 PolarHBondContact O-N 3.18Å
223E78.4Confident79.8Confident20 Ų2044.2 Ų44.29%0.09322%0.218CC..Hα-helixtrans-62.3-44.8174.1-72.4177.2178.200111.6M93 Q219 R220 H221 L225 S226 L227M93-E223 HydrophobicContact CE-CG 4Å; M93-E223 WeakPolarHBondContact CE-OE1 3.26Å; Q219-E223 WeakPolarHBondContact O-CG 3.35Å; Q219-E223 PolarHBondContact O-N 3.13Å; R220-E223 IonicContact CZ-OE1 2.91Å; R220-E223 IonicContact CZ-OE2 3.41Å; R220-E223 IonicContact NE-OE2 2.7Å; R220-E223 IonicContact NH1-OE1 3.98Å; R220-E223 PolarHBondContact NH1-OE1 2.85Å; R220-E223 IonicContact NH1-OE2 3.88Å; R220-E223 PolarHBondContact NH1-OE2 2.69Å; R220-E223 IonicContact NH2-OE1 3.21Å; R220-E223 PolarHBondContact NH2-OE1 3.46Å; R220-E223 WeakPolarHBondContact O-CB 3.48Å; R220-E223 PolarHBondContact O-N 3.43Å; H221-E223 VanDerWaalsContact C-N 3.33Å; H221-E223 PolarHBondContact O-N 3.05Å; E223-L225 VanDerWaalsContact C-N 3.33Å; E223-L225 PolarHBondContact O-N 3.15Å; E223-S226 CarbonylContact O-C 3.46Å; E223-S226 WeakPolarHBondContact O-CA 3.47Å; E223-S226 WeakPolarHBondContact O-CB 3.29Å; E223-S226 PolarHBondContact O-N 3.01Å; E223-L227 WeakPolarHBondContact O-CD1 3.43Å; E223-L227 PolarHBondContact O-N 3.11Å
224L79.4Confident80.4Confident0 Ų042.5 Ų42.50%021%0.21CC..Hα-helixtrans-61.5-42.3-179.2-166.449.8000111.3Q164 C167 K168 I171 V191 R220 H221 S226 L227 E228Q164-L224 HydrophobicContact CB-CD1 4.46Å; Q164-L224 HydrophobicContact CG-CD1 3.66Å; C167-L224 HydrophobicContact CB-CD1 4.03Å; K168-L224 HydrophobicContact CG-CD1 4.49Å; K168-L224 HydrophobicContact CG-CD2 4.06Å; I171-L224 HydrophobicContact CD1-CD2 3.93Å; V191-L224 HydrophobicContact CG1-CG 4.15Å; V191-L224 HydrophobicContact CG2-CD2 3.2Å; V191-L224 HydrophobicContact CG2-CG 3.63Å; R220-L224 WeakPolarHBondContact O-CB 3.35Å; R220-L224 PolarHBondContact O-N 3.38Å; H221-L224 WeakPolarHBondContact O-CB 3.34Å; H221-L224 PolarHBondContact O-N 2.9Å; H221-L224 VanDerWaalsContact O-N 3.14Å; L224-S226 VanDerWaalsContact C-N 3.34Å; L224-S226 PolarHBondContact O-N 3.38Å; L224-L227 WeakPolarHBondContact O-CB 3.41Å; L224-L227 PolarHBondContact O-N 3.33Å; L224-E228 WeakPolarHBondContact O-CG 3.44Å; L224-E228 PolarHBondContact O-N 2.95Å
225L82.3Confident80.7Confident64 Ų6448.2 Ų48.234%0.33523%0.229SC..Hα-helixtrans-61.1-40.5171.1-68.3177.1000112.7H221 E223 L227 E228 N229H221-L225 WeakPolarHBondContact O-CG 3.41Å; H221-L225 PolarHBondContact O-N 2.86Å; E223-L225 VanDerWaalsContact C-N 3.33Å; E223-L225 PolarHBondContact O-N 3.15Å; L225-L227 VanDerWaalsContact C-N 3.33Å; L225-E228 PolarHBondContact O-N 3.38Å; L225-N229 PolarHBondContact O-N 2.93Å; L225-N229 VanDerWaalsContact O-N 3.12Å
226S82.9Confident80.8Confident63 Ų6349.7 Ų49.744%0.44123%0.233SC..Hα-helixtrans-65-37.3174.8179.10000112R222 E223 L224 N229 N230R222-S226 PolarHBondContact O-N 3.18Å; E223-S226 CarbonylContact O-C 3.46Å; E223-S226 WeakPolarHBondContact O-CA 3.47Å; E223-S226 WeakPolarHBondContact O-CB 3.29Å; E223-S226 PolarHBondContact O-N 3.01Å; L224-S226 VanDerWaalsContact C-N 3.34Å; L224-S226 PolarHBondContact O-N 3.38Å; S226-N229 PolarHBondContact O-N 3.34Å; S226-N230 PolarHBondContact O-N 3.33Å; S226-N230 PolarHBondContact O-ND2 3.13Å; S226-N230 VanDerWaalsContact O-ND2 3.13Å; S226-N230 PolarHBondContact O-OD1 2.91Å
227L82.1Confident81Confident1 Ų149.3 Ų49.31%0.00523%0.232CC..Hα-helixtrans-63.1-46.1173.8-9189.6000111.8L160 K163 Q164 E223 L224 L225 N229 N230 M231L160-L227 WeakPolarHBondContact O-CD2 3.47Å; K163-L227 HydrophobicContact CB-CD2 3.81Å; K163-L227 HydrophobicContact CD-CD1 3.7Å; K163-L227 HydrophobicContact CD-CD2 3.8Å; K163-L227 HydrophobicContact CD-CG 4.03Å; K163-L227 VanDerWaalsContact CE-CD1 3.5Å; K163-L227 HydrophobicContact CG-CD1 4.18Å; K163-L227 HydrophobicContact CG-CD2 3.72Å; K163-L227 HydrophobicContact CG-CG 4.44Å; Q164-L227 HydrophobicContact CB-CD2 3.83Å; Q164-L227 VanDerWaalsContact N-CD2 3.34Å; E223-L227 WeakPolarHBondContact O-CD1 3.43Å; E223-L227 PolarHBondContact O-N 3.11Å; L224-L227 WeakPolarHBondContact O-CB 3.41Å; L224-L227 PolarHBondContact O-N 3.33Å; L225-L227 VanDerWaalsContact C-N 3.33Å; L227-N229 PolarHBondContact O-N 2.6Å; L227-N230 CarbonylContact O-C 3.17Å; L227-N230 WeakPolarHBondContact O-CB 3.46Å; L227-N230 PolarHBondContact O-N 3.39Å; L227-M231 WeakPolarHBondContact O-CG 3.48Å; L227-M231 PolarHBondContact O-N 3.24Å
228E81.7Confident81Confident68 Ų6850.3 Ų50.332%0.31824%0.237SC..Hα-helixtrans-55.3-43.8177.3-73.5-63.2157.500110.8Q164 V191 L224 L225 M231 K232Q164-E228 PolarHBondContact NE2-OE1 3.27Å; V191-E228 HydrophobicContact CG1-CG 3.65Å; L224-E228 WeakPolarHBondContact O-CG 3.44Å; L224-E228 PolarHBondContact O-N 2.95Å; L225-E228 PolarHBondContact O-N 3.38Å; E228-M231 PolarHBondContact O-N 3.02Å; E228-K232 WeakPolarHBondContact O-CB 3.32Å; E228-K232 PolarHBondContact O-N 3.26Å
229N83.9Confident80.9Confident77 Ų7752.8 Ų52.841%0.41225%0.25SC..Hα-helixtrans-62.3-45.8174.6-170.974.9000112.1L225 S226 L227 M231 K232 E233L225-N229 PolarHBondContact O-N 2.93Å; L225-N229 VanDerWaalsContact O-N 3.12Å; S226-N229 PolarHBondContact O-N 3.34Å; L227-N229 PolarHBondContact O-N 2.6Å; N229-M231 VanDerWaalsContact C-N 3.33Å; N229-M231 PolarHBondContact O-N 2.87Å; N229-K232 WeakPolarHBondContact O-CB 3.37Å; N229-K232 PolarHBondContact O-N 3.06Å; N229-E233 PolarHBondContact ND2-OE1 2.69Å; N229-E233 VanDerWaalsContact O-CG 3.32Å; N229-E233 WeakPolarHBondContact O-CG 3.41Å; N229-E233 PolarHBondContact O-N 3.4Å
230N81.1Confident80.4Confident26 Ų2655.4 Ų55.414%0.13926%0.264CS..Hα-helixtrans-63.3-38178.3-62.9-27.5000112.4T100 S226 L227 L234T100-N230 WeakPolarHBondContact CG2-ND2 3.3Å; S226-N230 PolarHBondContact O-N 3.33Å; S226-N230 PolarHBondContact O-ND2 3.13Å; S226-N230 VanDerWaalsContact O-ND2 3.13Å; S226-N230 PolarHBondContact O-OD1 2.91Å; L227-N230 CarbonylContact O-C 3.17Å; L227-N230 WeakPolarHBondContact O-CB 3.46Å; L227-N230 PolarHBondContact O-N 3.39Å; N230-L234 VanDerWaalsContact O-CB 3.29Å; N230-L234 WeakPolarHBondContact O-CB 3.39Å; N230-L234 PolarHBondContact O-N 3.39Å
231M82.4Confident80Confident30 Ų3055 Ų5515%0.14826%0.263CS..Hα-helixtrans-68.6-38.6176.2-72.4-179.873.300111.4L160 L161 L227 E228 N229 L234 R235L160-M231 HydrophobicContact CB-CG 4.12Å; L160-M231 HydrophobicContact CD1-CG 4.12Å; L161-M231 HydrophobicContact CD2-CE 3.32Å; L161-M231 HydrophobicContact CG-CE 3.96Å; L227-M231 WeakPolarHBondContact O-CG 3.48Å; L227-M231 PolarHBondContact O-N 3.24Å; E228-M231 PolarHBondContact O-N 3.02Å; N229-M231 VanDerWaalsContact C-N 3.33Å; N229-M231 PolarHBondContact O-N 2.87Å; M231-L234 PolarHBondContact O-N 2.91Å; M231-R235 WeakPolarHBondContact O-CB 3.5Å; M231-R235 PolarHBondContact O-N 2.94Å
232K84.2Confident79.1Confident118 Ų11858.9 Ų58.951%0.51328%0.28SS..Hα-helixtrans-62.1-47.9174.4-168.9179.8179178.50111.3E228 N229 L234 R235 D236E228-K232 WeakPolarHBondContact O-CB 3.32Å; E228-K232 PolarHBondContact O-N 3.26Å; N229-K232 WeakPolarHBondContact O-CB 3.37Å; N229-K232 PolarHBondContact O-N 3.06Å; K232-L234 PolarHBondContact O-N 3.15Å; K232-R235 WeakPolarHBondContact O-CB 3.21Å; K232-R235 PolarHBondContact O-N 2.87Å; K232-D236 PolarHBondContact O-N 3.41Å
233E80.3Confident78.2Confident60 Ų6058.5 Ų58.528%0.2829%0.285SS..Hα-helixtrans-62.6-41.2176-69.6174.9172.200112K104 N229 R235 D236 L237K104-E233 WeakPolarHBondContact CD-OE2 3.47Å; K104-E233 WeakPolarHBondContact CE-OE2 3.38Å; K104-E233 IonicContact NZ-OE1 2.9Å; K104-E233 PolarHBondContact NZ-OE1 3.19Å; K104-E233 IonicContact NZ-OE2 2.6Å; K104-E233 PolarHBondContact NZ-OE2 3.01Å; N229-E233 PolarHBondContact ND2-OE1 2.69Å; N229-E233 VanDerWaalsContact O-CG 3.32Å; N229-E233 WeakPolarHBondContact O-CG 3.41Å; N229-E233 PolarHBondContact O-N 3.4Å; E233-R235 VanDerWaalsContact C-N 3.31Å; E233-R235 PolarHBondContact O-N 3.14Å; E233-D236 PolarHBondContact O-N 2.89Å; E233-L237 PolarHBondContact O-N 2.87Å
234L83.2Confident77.1Confident8 Ų860 Ų604%0.04229%0.294CS..Hα-helixtrans-64.1-38176.1-179.159000111.9M153 Y156 N157 L160 N230 M231 K232 L237 F238M153-L234 HydrophobicContact CE-CD1 3.23Å; Y156-L234 HydrophobicContact CD1-CD1 4.37Å; Y156-L234 HydrophobicContact CD1-CD2 3.93Å; Y156-L234 HydrophobicContact CE1-CD2 4.39Å; N157-L234 HydrophobicContact CB-CD2 3.7Å; L160-L234 HydrophobicContact CD1-CD2 3.82Å; N230-L234 VanDerWaalsContact O-CB 3.29Å; N230-L234 WeakPolarHBondContact O-CB 3.39Å; N230-L234 PolarHBondContact O-N 3.39Å; M231-L234 PolarHBondContact O-N 2.91Å; K232-L234 PolarHBondContact O-N 3.15Å; L234-L237 HydrophobicContact CD1-CD2 4.3Å; L234-L237 PolarHBondContact O-N 3.5Å; L234-F238 HydrophobicContact CD1-CD2 4.15Å; L234-F238 HydrophobicContact CD1-CE2 3.83Å; L234-F238 HydrophobicContact CD1-CZ 4.12Å; L234-F238 HydrophobicContact CD2-CE2 3.83Å; L234-F238 HydrophobicContact CD2-CZ 4.47Å; L234-F238 HydrophobicContact CG-CD2 3.78Å; L234-F238 HydrophobicContact CG-CE2 3.52Å; L234-F238 HydrophobicContact CG-CZ 4.27Å; L234-F238 WeakPolarHBondContact O-CB 3.4Å; L234-F238 VanDerWaalsContact O-CD2 3.27Å; L234-F238 WeakPolarHBondContact O-CD2 3.34Å; L234-F238 WeakPolarHBondContact O-CG 3.29Å; L234-F238 PolarHBondContact O-N 3Å
235R82.1Confident75.9Confident148 Ų14863.1 Ų63.156%0.55831%0.312SS*.Hα-helixtrans-64.8-40.1173.8177.8-166.362.6154.69.5111.5M231 K232 E233 L237 F238 M239M231-R235 WeakPolarHBondContact O-CB 3.5Å; M231-R235 PolarHBondContact O-N 2.94Å; K232-R235 WeakPolarHBondContact O-CB 3.21Å; K232-R235 PolarHBondContact O-N 2.87Å; E233-R235 VanDerWaalsContact C-N 3.31Å; E233-R235 PolarHBondContact O-N 3.14Å; R235-L237 VanDerWaalsContact C-N 3.35Å; R235-F238 PolarHBondContact O-N 3.45Å; R235-M239 PolarHBondContact O-N 3.19Å
236D80.8Confident74.4Confident81 Ų8169.2 Ų69.243%0.43334%0.339SS..Hα-helixtrans-63.3-44.6175.9-61.4-11.9000109.9K232 E233 F238 M239 D240K232-D236 PolarHBondContact O-N 3.41Å; E233-D236 PolarHBondContact O-N 2.89Å; D236-F238 VanDerWaalsContact C-N 3.33Å; D236-F238 PolarHBondContact O-N 3.13Å; D236-M239 WeakPolarHBondContact O-CB 3.43Å; D236-M239 PolarHBondContact O-N 3.32Å; D236-D240 PolarHBondContact O-N 3.41Å
237L81.4Confident72.8Confident25 Ų2574.1 Ų74.113%0.13136%0.355CS..Hα-helixtrans-60.7-39.6171.8179.966.6000112.4A107 H111 M153 E233 L234 R235 D240 I241A107-L237 HydrophobicContact CB-CD2 4.09Å; H111-L237 HydrophobicContact CB-CD1 3.95Å; M153-L237 HydrophobicContact CE-CD2 3.92Å; E233-L237 PolarHBondContact O-N 2.87Å; L234-L237 HydrophobicContact CD1-CD2 4.3Å; L234-L237 PolarHBondContact O-N 3.5Å; R235-L237 VanDerWaalsContact C-N 3.35Å; L237-D240 PolarHBondContact O-N 3.24Å; L237-I241 HydrophobicContact CD1-CD1 4.03Å; L237-I241 HydrophobicContact CD1-CG1 4.42Å; L237-I241 HydrophobicContact CD2-CD1 4.15Å; L237-I241 HydrophobicContact CG-CD1 3.62Å; L237-I241 HydrophobicContact CG-CG1 4.39Å; L237-I241 WeakPolarHBondContact O-CB 3.4Å; L237-I241 WeakPolarHBondContact O-CD1 3.38Å; L237-I241 WeakPolarHBondContact O-CG1 2.92Å; L237-I241 PolarHBondContact O-N 3.4Å
238F75.1Confident71.2Confident22 Ų2276.1 Ų76.110%0.09636%0.364CS..Hα-helixtrans-67.5-34.9177.8-85.5-43.1000113M153 R154 N157 L234 R235 D236 D240 I241 F242M153-F238 HydrophobicContact CB-CE1 3.61Å; M153-F238 HydrophobicContact CB-CZ 3.81Å; M153-F238 WeakPolarHBondContact O-CZ 2.87Å; R154-F238 HydrophobicContact CG-CZ 4.47Å; N157-F238 HydrophobicContact CB-CE2 4Å; N157-F238 HydrophobicContact CB-CZ 4.33Å; L234-F238 HydrophobicContact CD1-CD2 4.15Å; L234-F238 HydrophobicContact CD1-CE2 3.83Å; L234-F238 HydrophobicContact CD1-CZ 4.12Å; L234-F238 HydrophobicContact CD2-CE2 3.83Å; L234-F238 HydrophobicContact CD2-CZ 4.47Å; L234-F238 HydrophobicContact CG-CD2 3.78Å; L234-F238 HydrophobicContact CG-CE2 3.52Å; L234-F238 HydrophobicContact CG-CZ 4.27Å; L234-F238 WeakPolarHBondContact O-CB 3.4Å; L234-F238 VanDerWaalsContact O-CD2 3.27Å; L234-F238 WeakPolarHBondContact O-CD2 3.34Å; L234-F238 WeakPolarHBondContact O-CG 3.29Å; L234-F238 PolarHBondContact O-N 3Å; R235-F238 PolarHBondContact O-N 3.45Å; D236-F238 VanDerWaalsContact C-N 3.33Å; D236-F238 PolarHBondContact O-N 3.13Å; F238-D240 VanDerWaalsContact C-N 3.26Å; F238-D240 PolarHBondContact O-N 3.44Å; F238-I241 HydrophobicContact CD1-CD1 4.38Å; F238-I241 PolarHBondContact O-N 3.4Å; F238-F242 HydrophobicContact CB-CD2 3.79Å; F238-F242 HydrophobicContact CB-CE2 3.89Å; F238-F242 AromaticContact CD1-CD2 3.88Å; F238-F242 HydrophobicContact CD1-CD2 3.88Å; F238-F242 AromaticContact CD1-CE2 3.27Å; F238-F242 HydrophobicContact CD1-CE2 3.27Å; F238-F242 HydrophobicContact CD1-CZ 4.11Å; F238-F242 AromaticContact CE1-CE2 3.86Å; F238-F242 HydrophobicContact CE1-CE2 3.86Å; F238-F242 HydrophobicContact CE1-CZ 4.31Å; F238-F242 HydrophobicContact CG-CD2 4.1Å; F238-F242 AromaticContact CG-CE2 3.68Å; F238-F242 HydrophobicContact CG-CE2 3.68Å; F238-F242 WeakPolarHBondContact O-CB 3.48Å; F238-F242 WeakPolarHBondContact O-CD2 3.39Å; F238-F242 PolarHBondContact O-N 3.3Å
239M77.4Confident69.7Low120 Ų12075.5 Ų75.559%0.59138%0.377SS*.Hα-helixtrans-56.7-46.6175.7-164.766.9165.800110.2R235 D236 M243R235-M239 PolarHBondContact O-N 3.19Å; D236-M239 WeakPolarHBondContact O-CB 3.43Å; D236-M239 PolarHBondContact O-N 3.32Å; M239-M243 WeakPolarHBondContact O-CB 3.44Å; M239-M243 VanDerWaalsContact O-CG 3.27Å; M239-M243 WeakPolarHBondContact O-CG 3.32Å; M239-M243 PolarHBondContact O-N 3.41Å
240D68.7Low68Low82 Ų8275.8 Ų75.844%0.43939%0.389SS..Hα-helixtrans-67.8-42.4178-64.5-20.9000111.7D236 L237 F238 F242 L244D236-D240 PolarHBondContact O-N 3.41Å; L237-D240 PolarHBondContact O-N 3.24Å; F238-D240 VanDerWaalsContact C-N 3.26Å; F238-D240 PolarHBondContact O-N 3.44Å; D240-F242 PolarHBondContact O-N 3.36Å; D240-L244 WeakPolarHBondContact O-CD1 3.5Å
241I69.1Low66.6Low0 Ų078.3 Ų78.30%040%0.403CS..Hα-helixtrans-66.1-37.4179.7-71.6169.6000113.1H146 F149 Q150 L237 F238H146-I241 PolarHBondContact NE2-O 2.9Å; H146-I241 VanDerWaalsContact NE2-O 3.15Å; F149-I241 HydrophobicContact CD1-CD1 4.15Å; F149-I241 HydrophobicContact CE1-CD1 3.39Å; F149-I241 HydrophobicContact CE1-CG1 4.05Å; F149-I241 HydrophobicContact CZ-CD1 4.12Å; Q150-I241 HydrophobicContact CG-CG2 3.33Å; Q150-I241 PolarHBondContact NE2-O 3.33Å; L237-I241 HydrophobicContact CD1-CD1 4.03Å; L237-I241 HydrophobicContact CD1-CG1 4.42Å; L237-I241 HydrophobicContact CD2-CD1 4.15Å; L237-I241 HydrophobicContact CG-CD1 3.62Å; L237-I241 HydrophobicContact CG-CG1 4.39Å; L237-I241 WeakPolarHBondContact O-CB 3.4Å; L237-I241 WeakPolarHBondContact O-CD1 3.38Å; L237-I241 WeakPolarHBondContact O-CG1 2.92Å; L237-I241 PolarHBondContact O-N 3.4Å; F238-I241 HydrophobicContact CD1-CD1 4.38Å; F238-I241 PolarHBondContact O-N 3.4Å
242F63.6Low65.2Low92 Ų9278.6 Ų78.640%0.40440%0.404SS..Hα-helixtrans-88.2-29.2-176.1-75-67000113.1F238 D240 L244 V245F238-F242 HydrophobicContact CB-CD2 3.79Å; F238-F242 HydrophobicContact CB-CE2 3.89Å; F238-F242 AromaticContact CD1-CD2 3.88Å; F238-F242 HydrophobicContact CD1-CD2 3.88Å; F238-F242 AromaticContact CD1-CE2 3.27Å; F238-F242 HydrophobicContact CD1-CE2 3.27Å; F238-F242 HydrophobicContact CD1-CZ 4.11Å; F238-F242 AromaticContact CE1-CE2 3.86Å; F238-F242 HydrophobicContact CE1-CE2 3.86Å; F238-F242 HydrophobicContact CE1-CZ 4.31Å; F238-F242 HydrophobicContact CG-CD2 4.1Å; F238-F242 AromaticContact CG-CE2 3.68Å; F238-F242 HydrophobicContact CG-CE2 3.68Å; F238-F242 WeakPolarHBondContact O-CB 3.48Å; F238-F242 WeakPolarHBondContact O-CD2 3.39Å; F238-F242 PolarHBondContact O-N 3.3Å; D240-F242 PolarHBondContact O-N 3.36Å; F242-L244 PolarHBondContact O-N 3.11Å; F242-V245 HydrophobicContact CD1-CG2 4.25Å; F242-V245 WeakPolarHBondContact O-CB 3.35Å; F242-V245 PolarHBondContact O-N 3.1Å; F242-V245 VanDerWaalsContact O-N 3.09Å
243M61.9Low63.6Low124 Ų12481.5 Ų81.561%0.61142%0.42SS*.Hα-helixtrans-62.1-27.4169.8-75.4-159.3-53.900112.3M239 V245M239-M243 WeakPolarHBondContact O-CB 3.44Å; M239-M243 VanDerWaalsContact O-CG 3.27Å; M239-M243 WeakPolarHBondContact O-CG 3.32Å; M239-M243 PolarHBondContact O-N 3.41Å; M243-V245 VanDerWaalsContact C-N 3.27Å; M243-V245 PolarHBondContact O-N 2.9Å
244L55.5Low62.5Low52 Ų5283.4 Ų83.427%0.27243%0.429SS..THydrogen-bonded Turntrans-75.9-5.2175.4-79158.8000114.5D240 F242D240-L244 WeakPolarHBondContact O-CD1 3.5Å; F242-L244 PolarHBondContact O-N 3.11Å
245V54.8Low61.3Low64 Ų6489.4 Ų89.439%0.38846%0.46SS..THydrogen-bonded Turntrans-81.9-25-174.8175.80000113F242 M243 E247F242-V245 HydrophobicContact CD1-CG2 4.25Å; F242-V245 WeakPolarHBondContact O-CB 3.35Å; F242-V245 PolarHBondContact O-N 3.1Å; F242-V245 VanDerWaalsContact O-N 3.09Å; M243-V245 VanDerWaalsContact C-N 3.27Å; M243-V245 PolarHBondContact O-N 2.9Å; V245-E247 VanDerWaalsContact C-N 3.27Å; V245-E247 PolarHBondContact O-N 2.9Å
246E49.5Very low60Low192 Ų19288.1 Ų88.190%0.89746%0.46SS*.THydrogen-bonded Turntrans-71.1-18.7-173.5-70.3-155.1153.500114.1
247E51Low59.2Low166 Ų16685.8 Ų85.878%0.77645%0.448SS*.THydrogen-bonded Turntrans-94.9-8.8-173.8-151.6169.7-158.600114.8V245V245-E247 VanDerWaalsContact C-N 3.27Å; V245-E247 PolarHBondContact O-N 2.9Å
248Q48.5Very low58.4Low43 Ų4386.7 Ų86.720%0.20145%0.454CS..SBendtrans-124.38.2-166.1-61.3-174.217.100115.6H142 I252H142-Q248 PolarHBondContact ND1-OE1 3.29Å; Q248-I252 HydrophobicContact CB-CD1 4.47Å; Q248-I252 WeakPolarHBondContact O-CD1 3.37Å
249G49.8Very low58Low56 Ų5689.7 Ų89.758%0.57747%0.473SS*.SBendtrans-79-30.9-164.500000117.9
250A48.3Very low57.5Low82 Ų8287.8 Ų87.868%0.67846%0.463SS*.SBendtrans-89.9-26.5-163.500000115.5
251D50.4Low57.4Low79 Ų7987.6 Ų87.642%0.42246%0.456SS..SBendtrans-104.90.5-162.8-85.323.5000115.2R261D251-R261 IonicContact OD1-NH2 2.69Å; D251-R261 IonicContact OD2-CZ 3.49Å; D251-R261 VanDerWaalsContact OD2-CZ 3.29Å; D251-R261 IonicContact OD2-NH1 2.64Å; D251-R261 PolarHBondContact OD2-NH1 3.45Å; D251-R261 IonicContact OD2-NH2 3.48Å; D251-R261 PolarHBondContact OD2-NH2 2.97Å
252I53.4Low57.3Low36 Ų3690.3 Ų90.319%0.18547%0.473CS..SBendtrans-97.5-21.1-166.8-52.5-171.7000112.9A143 Q248A143-I252 HydrophobicContact CB-CD1 3.02Å; A143-I252 HydrophobicContact CB-CG1 4.43Å; A143-I252 HydrophobicContact CB-CG2 4.49Å; Q248-I252 HydrophobicContact CB-CD1 4.47Å; Q248-I252 WeakPolarHBondContact O-CD1 3.37Å
253E51.1Low57.6Low180 Ų18092.3 Ų92.384%0.84148%0.483SS*.SBendtrans-88.9-17.7-179.1-112.3175.3-172.700114.2I255E253-I255 PolarHBondContact O-N 3.14Å
254H57.1Low57.9Low99 Ų9991.7 Ų91.746%0.45848%0.482SS..  trans-91.585.7179.7-75.2-87000111.3Q256 T257 N258H254-Q256 PolarHBondContact O-N 3.06Å; H254-T257 WeakPolarHBondContact CB-OG1 3.37Å; H254-T257 PolarHBondContact O-N 3.05Å; H254-N258 PolarHBondContact O-N 3.38Å
255I58Low58.7Low135 Ų13595.4 Ų95.469%0.69249%0.494SS*.Hα-helixtrans-46.7-41.6159.2-65.6174.3000109E253 N258 V259E253-I255 PolarHBondContact O-N 3.14Å; I255-N258 PolarHBondContact O-N 3.31Å; I255-V259 HydrophobicContact CG2-CG2 4.14Å; I255-V259 WeakPolarHBondContact O-CB 3.48Å; I255-V259 VanDerWaalsContact O-CG2 3.22Å; I255-V259 WeakPolarHBondContact O-CG2 3.49Å; I255-V259 PolarHBondContact O-N 3.03Å
256Q54.3Low59.7Low120 Ų12096.2 Ų96.256%0.56150%0.499SS*.Hα-helixtrans-53.5-53.5173.9179174.1-6.900112.7H254 N258 V259 E260H254-Q256 PolarHBondContact O-N 3.06Å; Q256-N258 VanDerWaalsContact C-N 3.3Å; Q256-N258 PolarHBondContact O-N 3.02Å; Q256-V259 CarbonylContact O-C 3.55Å; Q256-V259 PolarHBondContact O-N 3.01Å; Q256-V259 VanDerWaalsContact O-N 3.12Å; Q256-E260 HydrophobicContact CG-CG 4.24Å; Q256-E260 WeakPolarHBondContact CG-OE1 3.36Å; Q256-E260 PolarHBondContact NE2-OE1 3.43Å; Q256-E260 WeakPolarHBondContact O-CB 3.02Å; Q256-E260 VanDerWaalsContact O-CG 3.28Å; Q256-E260 WeakPolarHBondContact O-CG 3.46Å; Q256-E260 PolarHBondContact O-N 3.38Å
257T63.6Low60.8Low32 Ų3289.6 Ų89.620%0.19648%0.477CS..Hα-helixtrans-64-35.2-179.7-580000112.1H254 R261H254-T257 WeakPolarHBondContact CB-OG1 3.37Å; H254-T257 PolarHBondContact O-N 3.05Å; T257-R261 VanDerWaalsContact CG2-CZ 3.48Å; T257-R261 WeakPolarHBondContact O-CB 3.41Å; T257-R261 WeakPolarHBondContact O-CG 3.27Å; T257-R261 PolarHBondContact O-N 2.93Å
258N64.8Low61.9Low45 Ų4584.3 Ų84.324%0.24146%0.462CS..Hα-helixtrans-69.5-35.9174.3-76.2-29000112.6R136 H254 I255 Q256 T262R136-N258 PolarHBondContact NH1-O 2.97Å; H254-N258 PolarHBondContact O-N 3.38Å; I255-N258 PolarHBondContact O-N 3.31Å; Q256-N258 VanDerWaalsContact C-N 3.3Å; Q256-N258 PolarHBondContact O-N 3.02Å; N258-T262 WeakPolarHBondContact O-CB 3.46Å; N258-T262 PolarHBondContact O-N 3.43Å; N258-T262 PolarHBondContact O-OG1 3.22Å
259V67.9Low63Low84 Ų8485 Ų8551%0.50947%0.469SS..Hα-helixtrans-69.3-48174.2170.40000110.7I255 Q256 R261 T262 Q263I255-V259 HydrophobicContact CG2-CG2 4.14Å; I255-V259 WeakPolarHBondContact O-CB 3.48Å; I255-V259 VanDerWaalsContact O-CG2 3.22Å; I255-V259 WeakPolarHBondContact O-CG2 3.49Å; I255-V259 PolarHBondContact O-N 3.03Å; Q256-V259 CarbonylContact O-C 3.55Å; Q256-V259 PolarHBondContact O-N 3.01Å; Q256-V259 VanDerWaalsContact O-N 3.12Å; V259-R261 PolarHBondContact O-N 3.18Å; V259-T262 WeakPolarHBondContact O-CB 3.35Å; V259-T262 PolarHBondContact O-N 3.09Å; V259-Q263 PolarHBondContact O-N 2.7Å
260E66.1Low64.5Low80 Ų8086.3 Ų86.337%0.37446%0.463SS..Hα-helixtrans-55.3-51.2176.3-74.9169176.900111Q256 T262 Q263 D264Q256-E260 HydrophobicContact CG-CG 4.24Å; Q256-E260 WeakPolarHBondContact CG-OE1 3.36Å; Q256-E260 PolarHBondContact NE2-OE1 3.43Å; Q256-E260 WeakPolarHBondContact O-CB 3.02Å; Q256-E260 VanDerWaalsContact O-CG 3.28Å; Q256-E260 WeakPolarHBondContact O-CG 3.46Å; Q256-E260 PolarHBondContact O-N 3.38Å; E260-T262 PolarHBondContact O-N 3.45Å; E260-Q263 WeakPolarHBondContact O-CB 3.37Å; E260-Q263 PolarHBondContact O-N 3.14Å; E260-Q263 VanDerWaalsContact O-N 3.09Å; E260-D264 PolarHBondContact O-N 3.24Å
261R66.4Low66Low79 Ų7987.6 Ų87.630%0.29846%0.455SS..Hα-helixtrans-60.7-31.1176.8-72.4171.9179.9160.1-4.8113.3D251 T257 V259 Y265D251-R261 IonicContact OD1-NH2 2.69Å; D251-R261 IonicContact OD2-CZ 3.49Å; D251-R261 VanDerWaalsContact OD2-CZ 3.29Å; D251-R261 IonicContact OD2-NH1 2.64Å; D251-R261 PolarHBondContact OD2-NH1 3.45Å; D251-R261 IonicContact OD2-NH2 3.48Å; D251-R261 PolarHBondContact OD2-NH2 2.97Å; T257-R261 VanDerWaalsContact CG2-CZ 3.48Å; T257-R261 WeakPolarHBondContact O-CB 3.41Å; T257-R261 WeakPolarHBondContact O-CG 3.27Å; T257-R261 PolarHBondContact O-N 2.93Å; V259-R261 PolarHBondContact O-N 3.18Å; R261-Y265 PolarHBondContact O-N 2.92Å
262T68.3Low67.4Low57 Ų5791.2 Ų91.235%0.3547%0.466SS..Hα-helixtrans-75.7-38.7176.8-55.90000111.1R136 N258 V259 E260 D264 Y265 V266R136-T262 PolarHBondContact NH1-OG1 3.16Å; R136-T262 PolarHBondContact NH2-OG1 3.32Å; N258-T262 WeakPolarHBondContact O-CB 3.46Å; N258-T262 PolarHBondContact O-N 3.43Å; N258-T262 PolarHBondContact O-OG1 3.22Å; V259-T262 WeakPolarHBondContact O-CB 3.35Å; V259-T262 PolarHBondContact O-N 3.09Å; E260-T262 PolarHBondContact O-N 3.45Å; T262-D264 VanDerWaalsContact C-N 3.32Å; T262-D264 PolarHBondContact O-N 2.73Å; T262-Y265 PolarHBondContact O-N 2.64Å; T262-V266 WeakPolarHBondContact O-CG2 3.38Å; T262-V266 PolarHBondContact O-N 3.41Å
263Q69.1Low68.8Low133 Ų13396.1 Ų96.162%0.62149%0.487SS*.Hα-helixtrans-59.7-43.2173.6-173.5174.6300111.2V259 E260 Y265 V266 A267V259-Q263 PolarHBondContact O-N 2.7Å; E260-Q263 WeakPolarHBondContact O-CB 3.37Å; E260-Q263 PolarHBondContact O-N 3.14Å; E260-Q263 VanDerWaalsContact O-N 3.09Å; Q263-Y265 PolarHBondContact O-N 3.46Å; Q263-V266 PolarHBondContact O-N 3.28Å; Q263-A267 WeakPolarHBondContact O-CB 3.49Å; Q263-A267 PolarHBondContact O-N 3.23Å
264D69Low70.4Confident111 Ų11192.7 Ų92.759%0.59447%0.469SS*.Hα-helixtrans-60.7-42.8176.1-68.1-22.9000112.3E260 T262 A267 A268E260-D264 PolarHBondContact O-N 3.24Å; T262-D264 VanDerWaalsContact C-N 3.32Å; T262-D264 PolarHBondContact O-N 2.73Å; D264-A267 PolarHBondContact O-N 2.8Å; D264-A268 WeakPolarHBondContact O-CB 3.44Å; D264-A268 PolarHBondContact O-N 3.49Å
265Y71.9Confident71.6Confident131 Ų13189.9 Ų89.951%0.51446%0.463SS..Hα-helixtrans-64.2-42.1176.9-114.2-87.3000112.7N131 R261 T262 Q263 T269N131-Y265 HydrophobicContact CB-CE2 3.9Å; R261-Y265 PolarHBondContact O-N 2.92Å; T262-Y265 PolarHBondContact O-N 2.64Å; Q263-Y265 PolarHBondContact O-N 3.46Å; Y265-T269 WeakPolarHBondContact O-CB 3.28Å; Y265-T269 PolarHBondContact O-N 3.03Å; Y265-T269 PolarHBondContact O-OG1 3.27Å
266V76.4Confident72.7Confident80 Ų8086 Ų8649%0.48545%0.451SS..Hα-helixtrans-66-42177172.70000110.4T262 Q263 T269 N270T262-V266 WeakPolarHBondContact O-CG2 3.38Å; T262-V266 PolarHBondContact O-N 3.41Å; Q263-V266 PolarHBondContact O-N 3.28Å; V266-T269 PolarHBondContact O-N 2.9Å; V266-N270 WeakPolarHBondContact O-CB 2.77Å; V266-N270 PolarHBondContact O-N 2.83Å
267A70.8Confident74.2Confident54 Ų5483.1 Ų83.145%0.44645%0.448SS..Hα-helixtrans-59.9-49.1176.200000111.7Q263 D264 T269 N270 E271Q263-A267 WeakPolarHBondContact O-CB 3.49Å; Q263-A267 PolarHBondContact O-N 3.23Å; D264-A267 PolarHBondContact O-N 2.8Å; A267-T269 VanDerWaalsContact C-N 3.3Å; A267-T269 PolarHBondContact O-N 3.43Å; A267-N270 PolarHBondContact O-N 3.34Å; A267-E271 PolarHBondContact O-N 3.1Å; A267-E271 VanDerWaalsContact O-N 3.09Å
268A74.3Confident75Confident55 Ų5590.1 Ų90.146%0.45547%0.471SS..Hα-helixtrans-61.9-37.3176.900000112.6D264 K272D264-A268 WeakPolarHBondContact O-CB 3.44Å; D264-A268 PolarHBondContact O-N 3.49Å; A268-K272 PolarHBondContact O-N 3.04Å
269T73.3Confident75.8Confident56 Ų5696.6 Ų96.634%0.34449%0.493SS..Hα-helixtrans-71.4-39.8178.3-56.20000111.6Y265 V266 A267 E271 K272 F273Y265-T269 WeakPolarHBondContact O-CB 3.28Å; Y265-T269 PolarHBondContact O-N 3.03Å; Y265-T269 PolarHBondContact O-OG1 3.27Å; V266-T269 PolarHBondContact O-N 2.9Å; A267-T269 VanDerWaalsContact C-N 3.3Å; A267-T269 PolarHBondContact O-N 3.43Å; T269-E271 VanDerWaalsContact C-N 3.32Å; T269-E271 PolarHBondContact O-N 3.24Å; T269-K272 WeakPolarHBondContact O-CB 3.03Å; T269-K272 PolarHBondContact O-N 3.13Å; T269-K272 VanDerWaalsContact O-N 3.13Å; T269-F273 HydrophobicContact CG2-CD2 3.79Å; T269-F273 HydrophobicContact CG2-CE2 3.49Å; T269-F273 VanDerWaalsContact CG2-CE2 3.49Å; T269-F273 HydrophobicContact CG2-CZ 4.45Å; T269-F273 VanDerWaalsContact O-CD2 3.32Å; T269-F273 WeakPolarHBondContact O-CD2 3.45Å; T269-F273 PolarHBondContact O-N 3.01Å
270N79.9Confident76.2Confident85 Ų8599.6 Ų99.646%0.45550%0.499SS..Hα-helixtrans-60.2-40.4173.8-93.9-22.4000112.1V266 A267 K272 F273 K274V266-N270 WeakPolarHBondContact O-CB 2.77Å; V266-N270 PolarHBondContact O-N 2.83Å; A267-N270 PolarHBondContact O-N 3.34Å; N270-K272 VanDerWaalsContact C-N 3.34Å; N270-K272 PolarHBondContact O-N 3.1Å; N270-F273 PolarHBondContact O-N 2.92Å; N270-K274 WeakPolarHBondContact O-CG 3.26Å; N270-K274 PolarHBondContact O-N 2.91Å
271E80.8Confident76.6Confident108 Ų108104.4 Ų104.451%0.50552%0.519SS..Hα-helixtrans-61.5-41.4173.5-75.4-58128.400112.1A267 T269 K274 A275A267-E271 PolarHBondContact O-N 3.1Å; A267-E271 VanDerWaalsContact O-N 3.09Å; T269-E271 VanDerWaalsContact C-N 3.32Å; T269-E271 PolarHBondContact O-N 3.24Å; E271-K274 PolarHBondContact O-N 3.26Å; E271-K274 IonicContact OE1-NZ 3.69Å; E271-K274 PolarHBondContact OE1-NZ 2.93Å; E271-A275 WeakPolarHBondContact O-CB 3.46Å; E271-A275 PolarHBondContact O-N 3.42Å
272K78.9Confident76.8Confident155 Ų155107.9 Ų107.967%0.67454%0.536SS*.Hα-helixtrans-63.6-40.4173.7-69178.4-178176.90112.3A268 T269 N270 A275 A276A268-K272 PolarHBondContact O-N 3.04Å; T269-K272 WeakPolarHBondContact O-CB 3.03Å; T269-K272 PolarHBondContact O-N 3.13Å; T269-K272 VanDerWaalsContact O-N 3.13Å; N270-K272 VanDerWaalsContact C-N 3.34Å; N270-K272 PolarHBondContact O-N 3.1Å; K272-A275 PolarHBondContact O-N 3.44Å; K272-A276 WeakPolarHBondContact O-CB 3.24Å; K272-A276 PolarHBondContact O-N 3.14Å
273F82.9Confident77Confident140 Ų140108.4 Ų108.461%0.61454%0.537SS*.Hα-helixtrans-65.1-42.3175-80.9-59.6000112.4T269 N270 A275 A276 A277T269-F273 HydrophobicContact CG2-CD2 3.79Å; T269-F273 HydrophobicContact CG2-CE2 3.49Å; T269-F273 VanDerWaalsContact CG2-CE2 3.49Å; T269-F273 HydrophobicContact CG2-CZ 4.45Å; T269-F273 VanDerWaalsContact O-CD2 3.32Å; T269-F273 WeakPolarHBondContact O-CD2 3.45Å; T269-F273 PolarHBondContact O-N 3.01Å; N270-F273 PolarHBondContact O-N 2.92Å; F273-A275 VanDerWaalsContact C-N 3.32Å; F273-A275 PolarHBondContact O-N 3.22Å; F273-A276 PolarHBondContact O-N 3.31Å; F273-A277 WeakPolarHBondContact O-CB 3.47Å; F273-A277 PolarHBondContact O-N 3.06Å
274K84.1Confident76.9Confident108 Ų108106.1 Ų106.147%0.4753%0.534SS..Hα-helixtrans-59.3-44.4173.4-72174.8-168.5169.60111N270 E271 A277 R278N270-K274 WeakPolarHBondContact O-CG 3.26Å; N270-K274 PolarHBondContact O-N 2.91Å; E271-K274 PolarHBondContact O-N 3.26Å; E271-K274 IonicContact OE1-NZ 3.69Å; E271-K274 PolarHBondContact OE1-NZ 2.93Å; K274-A277 PolarHBondContact O-N 3.03Å; K274-R278 VanDerWaalsContact O-CG 3.29Å; K274-R278 WeakPolarHBondContact O-CG 3.07Å; K274-R278 PolarHBondContact O-N 3.31Å
275A83.3Confident76.7Confident39 Ų39107 Ų10732%0.32254%0.537SS..Hα-helixtrans-61.8-47.4175.700000111.6E271 K272 F273 A277 R278 Y279E271-A275 WeakPolarHBondContact O-CB 3.46Å; E271-A275 PolarHBondContact O-N 3.42Å; K272-A275 PolarHBondContact O-N 3.44Å; F273-A275 VanDerWaalsContact C-N 3.32Å; F273-A275 PolarHBondContact O-N 3.22Å; A275-A277 VanDerWaalsContact C-N 3.34Å; A275-A277 PolarHBondContact O-N 3.23Å; A275-R278 WeakPolarHBondContact O-CB 3.46Å; A275-R278 PolarHBondContact O-N 3.47Å; A275-R278 VanDerWaalsContact O-N 3.16Å; A275-Y279 WeakPolarHBondContact O-CD2 3.49Å; A275-Y279 PolarHBondContact O-N 3.37Å
276A81.9Confident76.1Confident54 Ų54108.5 Ų108.545%0.44654%0.542SS..Hα-helixtrans-60.5-41.1177.200000112.4K272 F273 Y279 K280K272-A276 WeakPolarHBondContact O-CB 3.24Å; K272-A276 PolarHBondContact O-N 3.14Å; F273-A276 PolarHBondContact O-N 3.31Å; A276-Y279 PolarHBondContact O-N 3.07Å; A276-K280 WeakPolarHBondContact O-CB 3.46Å; A276-K280 PolarHBondContact O-N 2.92Å
277A83.9Confident75.3Confident60 Ų60110.7 Ų110.750%0.49655%0.547SS..Hα-helixtrans-62.6-42.4174.500000111.7F273 K274 A275 K280 K281F273-A277 WeakPolarHBondContact O-CB 3.47Å; F273-A277 PolarHBondContact O-N 3.06Å; K274-A277 PolarHBondContact O-N 3.03Å; A275-A277 VanDerWaalsContact C-N 3.34Å; A275-A277 PolarHBondContact O-N 3.23Å; A277-K280 PolarHBondContact O-N 3.41Å; A277-K281 WeakPolarHBondContact O-CB 3.32Å; A277-K281 PolarHBondContact O-N 3.49Å
278R82.1Confident74.6Confident178 Ų178114.3 Ų114.367%0.67256%0.558SS**Hα-helixtrans-61.4-43.9173.7-72.1172.7-178.8-172.11.3111.6K274 A275 K281 K282K274-R278 VanDerWaalsContact O-CG 3.29Å; K274-R278 WeakPolarHBondContact O-CG 3.07Å; K274-R278 PolarHBondContact O-N 3.31Å; A275-R278 WeakPolarHBondContact O-CB 3.46Å; A275-R278 PolarHBondContact O-N 3.47Å; A275-R278 VanDerWaalsContact O-N 3.16Å; R278-K281 PolarHBondContact O-N 3.38Å; R278-K282 WeakPolarHBondContact O-CB 3.33Å; R278-K282 WeakPolarHBondContact O-CG 3.31Å; R278-K282 PolarHBondContact O-N 3.16Å
279Y80.6Confident73.6Confident181 Ų181114.5 Ų114.571%0.7156%0.555SS**Hα-helixtrans-63.6-41.6175.4-78.6-65.7000112.5A275 A276 K281 K282 N283A275-Y279 WeakPolarHBondContact O-CD2 3.49Å; A275-Y279 PolarHBondContact O-N 3.37Å; A276-Y279 PolarHBondContact O-N 3.07Å; Y279-K281 PolarHBondContact O-N 3.33Å; Y279-K282 CarbonylContact O-C 3.58Å; Y279-K282 PolarHBondContact O-N 3.2Å; Y279-N283 PolarHBondContact O-N 2.94Å; Y279-N283 VanDerWaalsContact O-N 3.09Å
280K76.1Confident72.7Confident148 Ų148116.7 Ų116.764%0.64357%0.572SS**Hα-helixtrans-62.7-40.8175.1-173.5180179.9-178.70112A276 A277 N283A276-K280 WeakPolarHBondContact O-CB 3.46Å; A276-K280 PolarHBondContact O-N 2.92Å; A277-K280 PolarHBondContact O-N 3.41Å; K280-N283 WeakPolarHBondContact O-CB 3.41Å; K280-N283 PolarHBondContact O-N 3.29Å
281K74.3Confident71.5Confident180 Ų180117.9 Ų117.978%0.78359%0.586SS**Hα-helixtrans-68.7-36.2177.1-167.8173.5-178.1176.40111.9A277 R278 Y279 N283A277-K281 WeakPolarHBondContact O-CB 3.32Å; A277-K281 PolarHBondContact O-N 3.49Å; R278-K281 PolarHBondContact O-N 3.38Å; Y279-K281 PolarHBondContact O-N 3.33Å; K281-N283 VanDerWaalsContact C-N 3.31Å; K281-N283 PolarHBondContact O-N 3.36Å
282K71.6Confident70.3Confident153 Ų153117.8 Ų117.867%0.66560%0.596SS**THydrogen-bonded Turntrans-89.416.6177.1-67.3-173.7176.8-173.50113.9R278 Y279 P284R278-K282 WeakPolarHBondContact O-CB 3.33Å; R278-K282 WeakPolarHBondContact O-CG 3.31Å; R278-K282 PolarHBondContact O-N 3.16Å; Y279-K282 CarbonylContact O-C 3.58Å; Y279-K282 PolarHBondContact O-N 3.2Å; K282-P284 WeakPolarHBondContact O-CD 3.24Å; K282-P284 VanDerWaalsContact O-N 3.12Å
283N72.9Confident68.9Low67 Ų67113.7 Ų113.736%0.35859%0.585SS.*  trans-66.7112.4-177.2-171.1-15.7000110Y279 K280 K281 I285 R286 Q287Y279-N283 PolarHBondContact O-N 2.94Å; Y279-N283 VanDerWaalsContact O-N 3.09Å; K280-N283 WeakPolarHBondContact O-CB 3.41Å; K280-N283 PolarHBondContact O-N 3.29Å; K281-N283 VanDerWaalsContact C-N 3.31Å; K281-N283 PolarHBondContact O-N 3.36Å; N283-I285 PolarHBondContact O-N 2.97Å; N283-I285 PolarHBondContact OD1-N 2.72Å; N283-R286 HydrophobicContact CB-CB 4.39Å; N283-R286 WeakPolarHBondContact O-CB 3.43Å; N283-R286 PolarHBondContact O-N 3.3Å; N283-Q287 PolarHBondContact O-N 3.25Å
284P66.2Low67.5Low86 Ų86112 Ų11256%0.55859%0.588SS**Hα-helixtrans-64.1-26.3-170.523.9-33.1000112.7K282 R286 Q287 L288K282-P284 WeakPolarHBondContact O-CD 3.24Å; K282-P284 VanDerWaalsContact O-N 3.12Å; P284-R286 VanDerWaalsContact C-N 3.3Å; P284-R286 PolarHBondContact O-N 3.16Å; P284-Q287 PolarHBondContact O-N 3.1Å; P284-L288 WeakPolarHBondContact O-CB 3.27Å; P284-L288 PolarHBondContact O-N 3.15Å
285I64.6Low66Low130 Ų130112.8 Ų112.867%0.66761%0.605SS**Hα-helixtrans-66.6-34.1175.5-62.3173.4000111N283 C289N283-I285 PolarHBondContact O-N 2.97Å; N283-I285 PolarHBondContact OD1-N 2.72Å; I285-C289 VanDerWaalsContact O-CB 3.24Å; I285-C289 WeakPolarHBondContact O-CB 3.35Å; I285-C289 PolarHBondContact O-N 3.03Å
286R58.8Low64.4Low161 Ų161122.1 Ų122.161%0.60863%0.632SS**Hα-helixtrans-77.3-32.3178.2-149.5177.9-178.7-167.4-1.4111.8N283 P284N283-R286 HydrophobicContact CB-CB 4.39Å; N283-R286 WeakPolarHBondContact O-CB 3.43Å; N283-R286 PolarHBondContact O-N 3.3Å; P284-R286 VanDerWaalsContact C-N 3.3Å; P284-R286 PolarHBondContact O-N 3.16Å
287Q59.4Low62.7Low126 Ų126130.9 Ų130.959%0.58965%0.653SS**Hα-helixtrans-72.8-37.4171.9-82.1176.2-24.600112.5N283 P284N283-Q287 PolarHBondContact O-N 3.25Å; P284-Q287 PolarHBondContact O-N 3.1Å
288L57Low60.7Low131 Ų131132.5 Ų132.569%0.68666%0.66SS**Hα-helixtrans-74.1-34.8179.6-163.670.2000112.4P284 C290 C291P284-L288 WeakPolarHBondContact O-CB 3.27Å; P284-L288 PolarHBondContact O-N 3.15Å; L288-C290 VanDerWaalsContact C-N 3.27Å; L288-C290 PolarHBondContact O-N 3.23Å; L288-C291 PolarHBondContact O-N 3.07Å
289C53.5Low58.7Low58 Ų58129.7 Ų129.739%0.39267%0.666SS.*Hα-helixtrans-72.7-16.7179.6-157.30000113.5I285 C291 C292I285-C289 VanDerWaalsContact O-CB 3.24Å; I285-C289 WeakPolarHBondContact O-CB 3.35Å; I285-C289 PolarHBondContact O-N 3.03Å; C289-C291 PolarHBondContact O-N 3.33Å; C289-C292 PolarHBondContact O-N 2.86Å
290C54.4Low56.5Low103 Ų103133.8 Ų133.870%0.69670%0.695SS**THydrogen-bonded Turntrans-70-21.6175.8-165.70000112.6L288L288-C290 VanDerWaalsContact C-N 3.27Å; L288-C290 PolarHBondContact O-N 3.23Å
291C54.4Low55.5Low110 Ų110133.1 Ų133.174%0.74370%0.698SS**THydrogen-bonded Turntrans-87.8-11.5-179.3-54.70000113.8L288 C289L288-C291 PolarHBondContact O-N 3.07Å; C289-C291 PolarHBondContact O-N 3.33Å
292C55.5Low54.5Low106 Ų106130.6 Ų130.672%0.71669%0.693SS**THydrogen-bonded Turntrans-124.91.3-170.6-57.30000114.9C289C289-C292 PolarHBondContact O-N 2.86Å
293C50Low53.6Low68 Ų68129.4 Ų129.446%0.45970%0.695SS.*SBendtrans-134.9131178.7-800000111.1
294P52.5Low52.4Low104 Ų104133.1 Ų133.168%0.67572%0.715SS**  trans-61.7157.9-179.4-19.730.9000113.1W296P294-W296 PolarHBondContact O-N 3.31Å
295P52.9Low51.6Low125 Ų125136 Ų13681%0.81272%0.724SS**THydrogen-bonded Turntrans-64.61.1-164.4-18.930.2000117
296W48.8Very low50.7Low235 Ų235136.4 Ų136.489%0.8973%0.728SS**THydrogen-bonded Turntrans-113.912-164.5-7284.1000115.3P294P294-W296 PolarHBondContact O-N 3.31Å
297R46.8Very low50.1Low238 Ų238134.6 Ų134.690%0.89874%0.737SS**SBendtrans-134.95.2179.9-91.6-172.5-179.7-94.80.6117.7
298C42.4Very low49.4Very low95 Ų95135.3 Ų135.364%0.64275%0.748SS**SBendtrans-11112.6-175.1-93.50000116.4
299C40.7Very low48.8Very low118 Ų118135.7 Ų135.780%0.79775%0.753SS**  trans-132.780.2173.4-70.40000111.4
300M33.3Very low48.3Very low268 Ų268142.7 Ų142.7100%1.3279%0.786SS**  trans-137.40136.4-91.9-157.8-178.600107.6

Retrieved 300 of 300 residues in 409 ms (Link to these results)