A0A060W7Y9_ONCMY Loading...

REST corepressor 1

AlphaFold DB , UniProt , Accession A0A060W7Y9, Species ONCMY (Oncorhynchus mykiss, Rainbow trout), Gene rcor1, Length 462 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
1M30Very low30.6Very low220 Ų220137.9 Ų137.9100%1.08480%0.797SS**  0120.50-73.1129.1174.200106.8
2M29.8Very low30.3Very low156 Ų156143.8 Ų143.877%0.76881%0.807SS**  74.513066-67.3148.6143.900110.8
3E30.5Very low30.3Very low129 Ų129152 Ų15260%0.60382%0.817SS**  cis-161.7167.32.5-124.7174.3140.200113.6
4K35.8Very low30.1Very low172 Ų172159.6 Ų159.675%0.74883%0.828SS**  trans21.5156.1135.7-74.2174.3-163157.80121.6
5S32.3Very low29.9Very low107 Ų107154.1 Ų154.175%0.74883%0.827SS**  cis-178.8158.6-1.845.50000114.2
6G31.8Very low29.7Very low76 Ų76159.7 Ų159.778%0.78483%0.832SS**  trans86.4157.6145.900000117.5
7S31.8Very low29.6Very low115 Ų115159.5 Ų159.580%0.80483%0.833SS**  cis-161.4158.4-14.339.40000107
8E26.5Very low29.7Very low174 Ų174157.9 Ų157.981%0.81383%0.831SS**  -158.2147.156.2-74.7179.591.700109.4
9M31.2Very low29.7Very low187 Ų187157.1 Ų157.192%0.92183%0.833SS**  53.9138.782.7-67.7-169.7169.800115.8
10S29.2Very low29.6Very low111 Ų111156.4 Ų156.478%0.77683%0.829SS**  cis-151.2140.610.8-173.60000109.5
11G27.7Very low29.5Very low70 Ų70156.3 Ų156.372%0.72283%0.829SS**  103.5144.681.500000111.5
12K27.6Very low30.2Very low209 Ų209151.2 Ų151.291%0.90981%0.813SS**  cis-149.4160.79-78.4167.8175.2163.30111.4
13R29.8Very low30.3Very low250 Ų250151.5 Ų151.594%0.94382%0.817SS**  trans-117.8147.2167.3-88.9-178.3165.2-166.1-2.9111.6
14R27.6Very low30.3Very low258 Ų258155.3 Ų155.397%0.97483%0.832SS**  trans-151.9148.7152.2-70.2-172.6173.7173.4-4.1106.4
15G27.1Very low30.1Very low78 Ų78151.8 Ų151.880%0.80483%0.829SS**  cis141.9113.9100000109.1
16R27.1Very low30Very low243 Ų243154.7 Ų154.792%0.91784%0.835SS**  trans-126.7126.6-178.6178.8-179.8-77.5-172.6-3.7109.8
17N27.3Very low29.8Very low157 Ų157155.4 Ų155.484%0.8483%0.834SS**  trans-102161.7177.6-88.326.1000112.2
18T31.5Very low29.8Very low130 Ų130156.3 Ų156.380%0.79883%0.834SS**  trans-115148.5172.145.90000110.8
19V29.3Very low29.9Very low143 Ų143156.3 Ų156.387%0.86784%0.84SS**  trans-149.4150.4167.7-170.50000108.5
20N27.6Very low29.7Very low142 Ų142150.6 Ų150.676%0.75983%0.829SS**  trans-113.5147-169.8-61.5-14.3000114.4
21N28.6Very low29.7Very low156 Ų156152.4 Ų152.483%0.83483%0.83SS**  trans61.6175.3148-116.112.2000118.6
22P44.3Very low29.9Very low113 Ų113154.8 Ų154.873%0.73484%0.835SS**  cis-130.4-175-6.341.6-24.6000116.1
23N32.6Very low30.2Very low162 Ų162151.5 Ų151.587%0.86683%0.828SS**  trans-43.6146.8172.9-83.3-15.1000116.6
24K30.8Very low30.2Very low208 Ų208146.2 Ų146.290%0.90482%0.818SS**  trans-152.5133141.4-157.7174-174.6-178.50112.5
25S31Very low30.3Very low99 Ų99138.3 Ų138.369%0.69280%0.802SS**  trans-113.6150.6167.752.70000110
26L28.9Very low30.5Very low167 Ų167144.7 Ų144.787%0.87480%0.802SS**  trans-179156.4131-141.267.3000113.5
27A28Very low31Very low91 Ų91140.3 Ų140.375%0.75279%0.792SS**  trans67.7110.5144.800000121
28T31.7Very low31.7Very low134 Ų134141.4 Ų141.482%0.82279%0.792SS**  trans-89.5122.2155.848.50000111.5
29N29.6Very low31.7Very low175 Ų175138.7 Ų138.794%0.93679%0.79SS**  trans178.2148.8150.6-105.7-8.2000109.3
30G26.6Very low32.1Very low66 Ų66137.3 Ų137.368%0.6879%0.787SS**  cis-176.7159.4-5.300000112.4
31N30.3Very low33.1Very low150 Ų150136.4 Ų136.480%0.80279%0.791SS**  trans-6.9129.6171.5179.349.3000120.1
32S30.5Very low33.5Very low119 Ų119132.6 Ų132.683%0.83279%0.79SS**  trans-155.8153.3140.6-83.10000111.9
33N33.8Very low33.1Very low141 Ų141133 Ų13375%0.75480%0.795SS**  trans-97.2-174-168.1-168.822.4000112.9
34N30.3Very low34.1Very low139 Ų139130.8 Ų130.874%0.74379%0.792SS**  trans83.7151.4168.4-60-3.9000115
35S30.3Very low34.5Very low91 Ų91126.4 Ų126.464%0.63679%0.788SS**  cis-174.7152.2-9.9161.10000109.7
36W30.3Very low35.6Very low213 Ų213128.5 Ų128.581%0.80779%0.791SS**  trans10.4140.3146.3-57.480.3000119
37E38Very low36.3Very low151 Ų151127.2 Ų127.271%0.70679%0.785SS**  cis-168.5-147.90.2-152175.4-167.600109
38E40.9Very low37.1Very low180 Ų180130.1 Ų130.184%0.84178%0.783SS**  trans-19.1157.8174-52-167.7122.900122.3
39G32.6Very low37.5Very low73 Ų73131.1 Ų131.175%0.75378%0.778SS**  trans158.588.8151.300000120.1
40S38.1Very low38.5Very low114 Ų114127 Ų12780%0.79778%0.777SS**  trans39.8102.8144.6-580000122.5
41S47.5Very low39.5Very low122 Ų122129 Ų12985%0.85378%0.78SS**  20.9132.3127.1620000121.5
42G37.3Very low40.9Very low77 Ų77125.9 Ų125.979%0.79478%0.784SS**  trans-164.1125.1161.600000115.6
43S35.2Very low42.6Very low122 Ų122122.2 Ų122.285%0.85377%0.765SS**  trans69.4114.6168.3-151.20000119.2
44S54.3Low44.3Very low115 Ų115123.9 Ų123.980%0.80477%0.771SS**  trans-93.5134.4155177.60000108.7
45S40.1Very low46.6Very low116 Ų116126.1 Ų126.181%0.81177%0.769SS**  trans-151.483.4165.5-1690000109
46D53.7Low48.9Very low143 Ų143127.3 Ų127.377%0.76577%0.772SS**  trans-77.4120.7160.4-168.126.1000107.4
47D43.4Very low51.3Low140 Ų140118.1 Ų118.175%0.74974%0.743SS**  trans179.9158134.4-112.3-47.8000114.1
48E45.1Very low53.4Low151 Ų151116.2 Ų116.271%0.70674%0.742SS**  trans61.9122.9161.1-71.4-159.1113.400122.9
49H40.3Very low55.3Low155 Ų155114.1 Ų114.172%0.71873%0.732SS**  trans65.495.6152.2-55.4-41.2000121.6S51H49-S51 VanDerWaalsContact C-N 3.29Å; H49-S51 PolarHBondContact O-N 3.43Å
50G49.3Very low57.7Low88 Ų88116.4 Ų116.491%0.90772%0.719SS**  77.7-2.6100.600000118.5G52G50-G52 PolarHBondContact O-N 3.46Å; G50-G52 VanDerWaalsContact O-N 3.1Å
51S48.9Very low59.9Low108 Ų108116.8 Ų116.876%0.75571%0.708SS**  trans-73.2101.9174.2-173.40000111.3H49 G53H49-S51 VanDerWaalsContact C-N 3.29Å; H49-S51 PolarHBondContact O-N 3.43Å; S51-G53 PolarHBondContact O-N 3.39Å
52G58Low61.5Low85 Ų85115.2 Ų115.288%0.87670%0.703SS**  trans-69.930.9166.700000113.9G50G50-G52 PolarHBondContact O-N 3.46Å; G50-G52 VanDerWaalsContact O-N 3.1Å
53G66.9Low63.7Low43 Ų43119.1 Ų119.144%0.44371%0.705SS.*  trans-65.6137.9178.200000111.7S51 R55S51-G53 PolarHBondContact O-N 3.39Å; G53-R55 PolarHBondContact O-N 3.33Å
54M69.5Low66Low176 Ų176119.5 Ų119.587%0.86770%0.701SS**  trans-61.4118.9175.1-69.2147.66400109.2V56M54-V56 PolarHBondContact O-N 2.76Å; M54-V56 VanDerWaalsContact O-N 3.09Å
55R79.1Confident67.4Low186 Ų186119.2 Ų119.270%0.70270%0.697SS**  trans-73.1102.2-179.3-64.4-178.2-178.3-113.3-0.8109.1G53 Y60G53-R55 PolarHBondContact O-N 3.33Å; R55-Y60 HydrophobicContact CB-CD1 3.93Å; R55-Y60 HydrophobicContact CB-CD2 3.91Å; R55-Y60 HydrophobicContact CB-CE1 4.25Å; R55-Y60 HydrophobicContact CB-CE2 4.23Å; R55-Y60 HydrophobicContact CB-CG 3.74Å; R55-Y60 WeakPolarHBondContact O-CB 3.45Å
56V78.3Confident69.6Low116 Ų116121.3 Ų121.370%0.70370%0.699SS**  trans-109.9129.7-180179.70000109.4M54M54-V56 PolarHBondContact O-N 2.76Å; M54-V56 VanDerWaalsContact O-N 3.09Å
57G81.4Confident71.1Confident19 Ų19123.3 Ų123.320%0.19670%0.697CS.*SBendtrans159.6160.6-178.800000109.8Q59 Y60 Q61G57-Q59 VanDerWaalsContact CA-OE1 3.27Å; G57-Q59 PolarHBondContact O-N 3.07Å; G57-Y60 CarbonylContact O-C 3.55Å; G57-Y60 PolarHBondContact O-N 2.97Å; G57-Q61 WeakPolarHBondContact O-CG 3.27Å; G57-Q61 PolarHBondContact O-N 2.78Å
58T80.8Confident73.2Confident112 Ų112119.9 Ų119.969%0.68768%0.679SS**G310 helixtrans-62.1-33-179.647.80000112.2Y60 Q61T58-Y60 PolarHBondContact O-N 3.34Å; T58-Q61 PolarHBondContact O-N 2.75Å
59Q81.6Confident75.3Confident136 Ų136116.6 Ų116.664%0.63667%0.67SS**G310 helixtrans-71.4-5173.477.7-78.541.200114.5G57G57-Q59 VanDerWaalsContact CA-OE1 3.27Å; G57-Q59 PolarHBondContact O-N 3.07Å
60Y83.5Confident77.4Confident120 Ų120116.8 Ų116.847%0.47167%0.671SS.*G310 helixtrans-120.44.5176.9-59-62000112.9R55 G57 T58R55-Y60 HydrophobicContact CB-CD1 3.93Å; R55-Y60 HydrophobicContact CB-CD2 3.91Å; R55-Y60 HydrophobicContact CB-CE1 4.25Å; R55-Y60 HydrophobicContact CB-CE2 4.23Å; R55-Y60 HydrophobicContact CB-CG 3.74Å; R55-Y60 WeakPolarHBondContact O-CB 3.45Å; G57-Y60 CarbonylContact O-C 3.55Å; G57-Y60 PolarHBondContact O-N 2.97Å; T58-Y60 PolarHBondContact O-N 3.34Å
61Q83Confident79Confident122 Ų122118.1 Ų118.157%0.5766%0.657SS**SBendtrans-107.1150.8174.6-71.1171.75.800109.3G57 T58 L63G57-Q61 WeakPolarHBondContact O-CG 3.27Å; G57-Q61 PolarHBondContact O-N 2.78Å; T58-Q61 PolarHBondContact O-N 2.75Å; Q61-L63 PolarHBondContact O-N 3.03Å
62A81.7Confident80.6Confident90 Ų90114.2 Ų114.274%0.74463%0.631SS**  trans-69.9125.6171.600000109.1V64A62-V64 PolarHBondContact O-N 2.88Å
63L83.6Confident81.7Confident159 Ų159115.6 Ų115.683%0.83261%0.613SS**  trans-67.9104.3164.7-64.9178.1000107.5Q61 P65Q61-L63 PolarHBondContact O-N 3.03Å; L63-P65 WeakPolarHBondContact O-CD 3.29Å
64V83.5Confident82.3Confident129 Ų129116.1 Ų116.178%0.78261%0.613SS**PPolyproline II helixtrans-75.3119.3172.9-177.70000107.3A62A62-V64 PolarHBondContact O-N 2.88Å
65P83.1Confident82.5Confident110 Ų110109.8 Ų109.871%0.71459%0.589SS**PPolyproline II helixtrans-64.9154.7174.4-19.333.2000111.2L63L63-P65 WeakPolarHBondContact O-CD 3.29Å
66D86.8Confident82.1Confident159 Ų159107.7 Ų107.785%0.8559%0.587SS**PPolyproline II helixtrans-59.8156.3169.4-69.8-58.6000111.6D68D66-D68 PolarHBondContact O-N 3.14Å; D66-D68 VanDerWaalsContact O-N 3.13Å
67Y85.4Confident82Confident186 Ų186108.5 Ų108.573%0.72958%0.583SS**  trans-67.9111.1-176.6177-94.1000111.8P69 A72Y67-P69 HydrophobicContact CE1-CB 4.03Å; Y67-A72 HydrophobicContact CE2-CB 3.96Å; Y67-A72 WeakPolarHBondContact OH-CB 3.47Å
68D88Confident81.7Confident68 Ų68115.7 Ų115.736%0.36460%0.604SS.*  trans-96.6115.8174.2-176.7-37.9000110.3D66 E70 I71 A72D66-D68 PolarHBondContact O-N 3.14Å; D66-D68 VanDerWaalsContact O-N 3.13Å; D68-E70 WeakPolarHBondContact OD1-CA 3.4Å; D68-E70 WeakPolarHBondContact OD1-CB 3.4Å; D68-E70 PolarHBondContact OD1-N 3.05Å; D68-I71 HydrophobicContact CB-CB 4Å; D68-I71 HydrophobicContact CB-CD1 3.92Å; D68-I71 HydrophobicContact CB-CG1 4.05Å; D68-I71 PolarHBondContact OD1-N 3.28Å; D68-I71 WeakPolarHBondContact OD2-CD1 3.48Å; D68-A72 WeakPolarHBondContact O-CB 3.26Å; D68-A72 PolarHBondContact O-N 2.79Å
69P87.8Confident80.6Confident82 Ų82118.4 Ų118.453%0.53261%0.614SS.*Hα-helixtrans-72.6-23.9-178.730.1-35.1000113.7Y67 K73Y67-P69 HydrophobicContact CE1-CB 4.03Å; P69-K73 WeakPolarHBondContact O-CB 3.5Å; P69-K73 PolarHBondContact O-N 2.92Å; P69-K73 VanDerWaalsContact O-N 3.08Å
70E85.4Confident79.7Confident158 Ų158119.3 Ų119.374%0.73862%0.624SS**Hα-helixtrans-76.6-41.7176.3-62.2-163.9166.800110.5D68 A72 K73 A74D68-E70 WeakPolarHBondContact OD1-CA 3.4Å; D68-E70 WeakPolarHBondContact OD1-CB 3.4Å; D68-E70 PolarHBondContact OD1-N 3.05Å; E70-A72 VanDerWaalsContact C-N 3.34Å; E70-K73 PolarHBondContact O-N 2.95Å; E70-A74 VanDerWaalsContact O-CB 3.25Å; E70-A74 WeakPolarHBondContact O-CB 3.49Å; E70-A74 PolarHBondContact O-N 3.04Å
71I83.9Confident79Confident117 Ų117119.4 Ų119.460%0.663%0.632SS**Hα-helixtrans-64.4-39.3173.3-64.7176.6000111D68 A74 A75D68-I71 HydrophobicContact CB-CB 4Å; D68-I71 HydrophobicContact CB-CD1 3.92Å; D68-I71 HydrophobicContact CB-CG1 4.05Å; D68-I71 PolarHBondContact OD1-N 3.28Å; D68-I71 WeakPolarHBondContact OD2-CD1 3.48Å; I71-A74 PolarHBondContact O-N 3.33Å; I71-A75 PolarHBondContact O-N 2.85Å
72A80.6Confident78.4Confident26 Ų26117.1 Ų117.122%0.21564%0.641CS.*Hα-helixtrans-60.4-51.4174.300000111.5Y67 D68 E70 A74 A75 E76Y67-A72 HydrophobicContact CE2-CB 3.96Å; Y67-A72 WeakPolarHBondContact OH-CB 3.47Å; D68-A72 WeakPolarHBondContact O-CB 3.26Å; D68-A72 PolarHBondContact O-N 2.79Å; E70-A72 VanDerWaalsContact C-N 3.34Å; A72-A74 PolarHBondContact O-N 3.16Å; A72-A75 WeakPolarHBondContact O-CA 3.2Å; A72-A75 WeakPolarHBondContact O-CB 3.36Å; A72-A75 PolarHBondContact O-N 3.19Å; A72-E76 PolarHBondContact O-N 3.44Å; A72-E76 VanDerWaalsContact O-N 3.11Å
73K82.1Confident78.3Confident113 Ų113120.6 Ų120.649%0.49164%0.644SS.*Hα-helixtrans-61.1-41.2177.4-173.1172.8179-69.70112.5P69 E70 A75 E76 E77P69-K73 WeakPolarHBondContact O-CB 3.5Å; P69-K73 PolarHBondContact O-N 2.92Å; P69-K73 VanDerWaalsContact O-N 3.08Å; E70-K73 PolarHBondContact O-N 2.95Å; K73-A75 PolarHBondContact O-N 3.33Å; K73-E76 PolarHBondContact O-N 2.98Å; K73-E76 VanDerWaalsContact O-N 3.15Å; K73-E77 IonicContact NZ-OE1 2.6Å; K73-E77 PolarHBondContact NZ-OE1 3.08Å; K73-E77 IonicContact NZ-OE2 3.76Å; K73-E77 WeakPolarHBondContact O-CG 3.37Å; K73-E77 PolarHBondContact O-N 2.91Å
74A79.5Confident78.2Confident55 Ų55117.8 Ų117.846%0.45563%0.629SS.*Hα-helixtrans-70.3-10.4175.200000114.2E70 I71 A72 R78E70-A74 VanDerWaalsContact O-CB 3.25Å; E70-A74 WeakPolarHBondContact O-CB 3.49Å; E70-A74 PolarHBondContact O-N 3.04Å; I71-A74 PolarHBondContact O-N 3.33Å; A72-A74 PolarHBondContact O-N 3.16Å; A74-R78 WeakPolarHBondContact O-CG 3.36Å
75A72.8Confident78.2Confident43 Ų43115 Ų11536%0.35561%0.612SS.*Hα-helixtrans-89.2-34.3168.200000112.1I71 A72 K73I71-A75 PolarHBondContact O-N 2.85Å; A72-A75 WeakPolarHBondContact O-CA 3.2Å; A72-A75 WeakPolarHBondContact O-CB 3.36Å; A72-A75 PolarHBondContact O-N 3.19Å; K73-A75 PolarHBondContact O-N 3.33Å
76E72.4Confident78.5Confident142 Ų142112.6 Ų112.666%0.66459%0.589SS**Hα-helixtrans-67.8-35172.4-66.6-179.1165.300112.2A72 K73 R78A72-E76 PolarHBondContact O-N 3.44Å; A72-E76 VanDerWaalsContact O-N 3.11Å; K73-E76 PolarHBondContact O-N 2.98Å; K73-E76 VanDerWaalsContact O-N 3.15Å; E76-R78 PolarHBondContact O-N 2.95Å; E76-R78 VanDerWaalsContact O-N 3.14Å
77E75.1Confident78.7Confident132 Ų132109 Ų10962%0.61757%0.569SS**THydrogen-bonded Turntrans-78.817.7-179.9-69.7178171.800114.8K73K73-E77 IonicContact NZ-OE1 2.6Å; K73-E77 PolarHBondContact NZ-OE1 3.08Å; K73-E77 IonicContact NZ-OE2 3.76Å; K73-E77 WeakPolarHBondContact O-CG 3.37Å; K73-E77 PolarHBondContact O-N 2.91Å
78R76.1Confident78.8Confident171 Ų171105.3 Ų105.365%0.64557%0.568SS**  trans-89.5131.4-176.4-71.9-179171-178.6-4.4113.5A74 E76 N80 L81A74-R78 WeakPolarHBondContact O-CG 3.36Å; E76-R78 PolarHBondContact O-N 2.95Å; E76-R78 VanDerWaalsContact O-N 3.14Å; R78-N80 PolarHBondContact O-N 3.43Å; R78-L81 WeakPolarHBondContact O-CG 3.43Å; R78-L81 PolarHBondContact O-N 3.03Å
79D57.3Low78.5Confident168 Ų168103.5 Ų103.590%0.89856%0.56SS**THydrogen-bonded Turntrans-53.8-20.9175-62.9-43.4000115.2
80N61.3Low78.2Confident156 Ų156105.7 Ų105.783%0.83458%0.575SS**THydrogen-bonded Turntrans-113.446.7-178.7-66.8-60000112.3R78 G82R78-N80 PolarHBondContact O-N 3.43Å; N80-G82 PolarHBondContact O-N 3.04Å
81L70.8Confident78Confident122 Ų122105.4 Ų105.464%0.63958%0.578SS**PPolyproline II helixtrans-55.9134.4167.1-77.9168.4000110.6R78R78-L81 WeakPolarHBondContact O-CG 3.43Å; R78-L81 PolarHBondContact O-N 3.03Å
82G70.4Confident78Confident74 Ų74101.6 Ų101.676%0.76356%0.559SS**PPolyproline II helixtrans-66.7133.8174.600000111N80 L84N80-G82 PolarHBondContact O-N 3.04Å; G82-L84 PolarHBondContact O-N 2.96Å
83M78.1Confident78.4Confident163 Ų163103.1 Ų103.180%0.80357%0.572SS**PPolyproline II helixtrans-63.3120.1177.3-176.6172.169.700110.4V85M83-V85 HydrophobicContact CE-CG1 3.84Å; M83-V85 HydrophobicContact CG-CG1 4.46Å; M83-V85 PolarHBondContact O-N 2.99Å; M83-V85 VanDerWaalsContact O-N 3.11Å
84L83Confident78.7Confident100 Ų100105.2 Ų105.252%0.52458%0.583SS.*  trans-72.4103178.2-179.162.2000110.3G82 W86 L87 F120G82-L84 PolarHBondContact O-N 2.96Å; L84-W86 WeakPolarHBondContact CD1-O 3.4Å; L84-L87 HydrophobicContact CD1-CD2 3.98Å; L84-L87 HydrophobicContact CD1-CG 4.09Å; L84-L87 HydrophobicContact CD2-CD1 3.95Å; L84-L87 HydrophobicContact CD2-CD2 4.45Å; L84-L87 HydrophobicContact CD2-CG 4.01Å; L84-L87 HydrophobicContact CG-CG 4.38Å; L84-F120 HydrophobicContact CD2-CE1 4.22Å; L84-F120 HydrophobicContact CD2-CZ 3.78Å; L84-F120 HydrophobicContact CG-CE1 3.97Å; L84-F120 HydrophobicContact CG-CZ 3.96Å; L84-F120 VanDerWaalsContact O-CE1 3.32Å; L84-F120 WeakPolarHBondContact O-CE1 3.4Å
85V82.3Confident79.3Confident70 Ų70106.1 Ų106.142%0.42459%0.591SS.*  trans-93.8-18.2-178.3-67.60000114.3M83 G117M83-V85 HydrophobicContact CE-CG1 3.84Å; M83-V85 HydrophobicContact CG-CG1 4.46Å; M83-V85 PolarHBondContact O-N 2.99Å; M83-V85 VanDerWaalsContact O-N 3.11Å; V85-G117 VanDerWaalsContact O-CA 3.29Å; V85-G117 WeakPolarHBondContact O-CA 3.34Å
86W90.6Very high80.2Confident60 Ų60110.1 Ų110.123%0.22760%0.6CS.*  trans-155.6143.2178.4177.9-113.1000111.9L84 L92 L97 L116 L119 F120 H124L84-W86 WeakPolarHBondContact CD1-O 3.4Å; W86-L92 HydrophobicContact CH2-CD2 4.48Å; W86-L97 HydrophobicContact CH2-CD1 3.98Å; W86-L97 HydrophobicContact CH2-CD2 4.21Å; W86-L97 HydrophobicContact CZ2-CD1 4.49Å; W86-L97 HydrophobicContact CZ2-CD2 3.95Å; W86-L116 HydrophobicContact CB-CB 4.46Å; W86-L116 HydrophobicContact CD2-CB 4.04Å; W86-L116 HydrophobicContact CD2-CD1 4.45Å; W86-L116 HydrophobicContact CD2-CD2 3.91Å; W86-L116 HydrophobicContact CD2-CG 4.35Å; W86-L116 HydrophobicContact CE3-CB 3.77Å; W86-L116 HydrophobicContact CE3-CD2 3.83Å; W86-L116 HydrophobicContact CE3-CG 4.35Å; W86-L116 VanDerWaalsContact CE3-O 3.32Å; W86-L116 HydrophobicContact CG-CB 4.34Å; W86-L116 HydrophobicContact CG-CD1 4.42Å; W86-L116 HydrophobicContact CH2-CD2 3.76Å; W86-L116 HydrophobicContact CZ2-CD2 3.82Å; W86-L116 HydrophobicContact CZ3-CB 4.35Å; W86-L116 HydrophobicContact CZ3-CD2 3.77Å; W86-L119 HydrophobicContact CH2-CD2 4.1Å; W86-L119 HydrophobicContact CZ3-CB 4.25Å; W86-L119 HydrophobicContact CZ3-CD2 4.09Å; W86-L119 HydrophobicContact CZ3-CG 4.22Å; W86-F120 HydrophobicContact CE3-CB 4.01Å; W86-F120 HydrophobicContact CZ3-CB 4.5Å; W86-H124 AromaticContact CH2-CD2 3.58Å; W86-H124 AromaticContact CH2-NE2 3.79Å; W86-H124 AromaticContact CZ3-CD2 3.61Å; W86-H124 AromaticContact CZ3-NE2 3.65Å
87L89.3Confident81.1Confident84 Ų84104.9 Ų104.944%0.4458%0.576SS.*  trans-131.8139.6158.9-72178.5000108.5L84 F120 H124L84-L87 HydrophobicContact CD1-CD2 3.98Å; L84-L87 HydrophobicContact CD1-CG 4.09Å; L84-L87 HydrophobicContact CD2-CD1 3.95Å; L84-L87 HydrophobicContact CD2-CD2 4.45Å; L84-L87 HydrophobicContact CD2-CG 4.01Å; L84-L87 HydrophobicContact CG-CG 4.38Å; L87-F120 HydrophobicContact CB-CD2 4.37Å; L87-F120 HydrophobicContact CB-CE2 3.91Å; L87-F120 HydrophobicContact CD1-CE2 4.08Å; L87-F120 HydrophobicContact CD1-CZ 4.31Å; L87-F120 HydrophobicContact CG-CE2 4.01Å; L87-F120 HydrophobicContact CG-CZ 4.31Å; L87-H124 PolarHBondContact O-CE1 3.3Å; L87-H124 PolarHBondContact O-NE2 3.05Å
88P87.4Confident82Confident107 Ų107103.2 Ų103.270%0.69557%0.572SS**  trans-60.8142.5167.8-21.433.5000111.6
89S83.6Confident82.9Confident30 Ų30101 Ų10121%0.2157%0.569CS.*  trans-112.2127.1174.4179.40000110.7N91 L92 H124S89-N91 PolarHBondContact O-N 2.9Å; S89-L92 PolarHBondContact O-N 3.27Å; S89-H124 VanDerWaalsContact CB-CG 3.46Å
90P81.3Confident84.7Confident128 Ų12893.2 Ų93.283%0.83153%0.527SS*.THydrogen-bonded Turntrans-69-14.1-179.230.2-36.4000113.2
91N80.6Confident86.2Confident153 Ų15386.8 Ų86.882%0.81849%0.492SS*.THydrogen-bonded Turntrans-93.41-178.6-62.7-26.9000112.9S89S89-N91 PolarHBondContact O-N 2.9Å
92L84.2Confident87.3Confident37 Ų3782.8 Ų82.819%0.19448%0.477CS..SBendtrans-108.5118.5-176.7-168.368.2000110.8W86 S89 L97 L119 I126W86-L92 HydrophobicContact CH2-CD2 4.48Å; S89-L92 PolarHBondContact O-N 3.27Å; L92-L97 HydrophobicContact CD2-CB 4.08Å; L92-L97 HydrophobicContact CD2-CD1 4Å; L92-L97 HydrophobicContact CD2-CD2 4.47Å; L92-L97 HydrophobicContact CD2-CG 4.42Å; L92-L119 HydrophobicContact CD2-CD2 3.92Å; L92-I126 HydrophobicContact CD1-CD1 3.85Å; L92-I126 HydrophobicContact CD1-CG1 4.22Å
93A89.1Confident88.4Confident58 Ų5881.1 Ų81.148%0.47945%0.45SS..  trans-71.9129.6176.200000111.1A95 K96 L97A93-A95 VanDerWaalsContact C-N 3.34Å; A93-A95 PolarHBondContact O-N 2.71Å; A93-K96 HydrophobicContact CB-CG 4.46Å; A93-K96 WeakPolarHBondContact O-CB 3.49Å; A93-K96 PolarHBondContact O-N 2.67Å; A93-L97 PolarHBondContact O-N 3.49Å
94E87.5Confident89Confident156 Ų15673.3 Ų73.373%0.72941%0.412SS*.Hα-helixtrans-50.7-47.3-175.7-168.1169.9-151.600112.9K96 L97 D98E94-K96 PolarHBondContact O-N 3.02Å; E94-K96 VanDerWaalsContact O-N 3.15Å; E94-L97 WeakPolarHBondContact O-CA 3.45Å; E94-L97 VanDerWaalsContact O-CB 3.3Å; E94-L97 WeakPolarHBondContact O-CB 3.45Å; E94-L97 PolarHBondContact O-N 3.36Å; E94-D98 PolarHBondContact O-N 2.93Å
95A92.1Very high89.2Confident75 Ų7575.2 Ų75.262%0.6242%0.416SS*.Hα-helixtrans-59.8-28.4177.500000114.6A93 E99A93-A95 VanDerWaalsContact C-N 3.34Å; A93-A95 PolarHBondContact O-N 2.71Å; A95-E99 PolarHBondContact O-N 2.98Å
96K91.9Very high89.6Confident127 Ų12779.7 Ų79.755%0.55243%0.432SS*.Hα-helixtrans-79.4-28.8174.2-66.6-169.6174-169.30112.2A93 E94 Y100 I126A93-K96 HydrophobicContact CB-CG 4.46Å; A93-K96 WeakPolarHBondContact O-CB 3.49Å; A93-K96 PolarHBondContact O-N 2.67Å; E94-K96 PolarHBondContact O-N 3.02Å; E94-K96 VanDerWaalsContact O-N 3.15Å; K96-Y100 WeakPolarHBondContact O-CB 3.4Å; K96-Y100 PolarHBondContact O-N 3.39Å; K96-Y100 VanDerWaalsContact O-N 3.07Å; K96-I126 HydrophobicContact CB-CD1 3.8Å; K96-I126 WeakPolarHBondContact O-CD1 3.47Å
97L92Very high89.4Confident31 Ų3184 Ų8416%0.16245%0.452CS..Hα-helixtrans-68.7-43.8172.7178.660000110.3W86 L92 A93 E94 Y100 I101 L116 L119W86-L97 HydrophobicContact CH2-CD1 3.98Å; W86-L97 HydrophobicContact CH2-CD2 4.21Å; W86-L97 HydrophobicContact CZ2-CD1 4.49Å; W86-L97 HydrophobicContact CZ2-CD2 3.95Å; L92-L97 HydrophobicContact CD2-CB 4.08Å; L92-L97 HydrophobicContact CD2-CD1 4Å; L92-L97 HydrophobicContact CD2-CD2 4.47Å; L92-L97 HydrophobicContact CD2-CG 4.42Å; A93-L97 PolarHBondContact O-N 3.49Å; E94-L97 WeakPolarHBondContact O-CA 3.45Å; E94-L97 VanDerWaalsContact O-CB 3.3Å; E94-L97 WeakPolarHBondContact O-CB 3.45Å; E94-L97 PolarHBondContact O-N 3.36Å; L97-Y100 HydrophobicContact CD1-CD1 4.44Å; L97-Y100 PolarHBondContact O-N 2.9Å; L97-I101 HydrophobicContact CD1-CD1 4.04Å; L97-I101 HydrophobicContact CD1-CG1 4.33Å; L97-I101 HydrophobicContact CG-CD1 3.93Å; L97-I101 VanDerWaalsContact O-CG1 3.28Å; L97-I101 WeakPolarHBondContact O-CG1 3.35Å; L97-I101 PolarHBondContact O-N 3.47Å; L97-L116 HydrophobicContact CD1-CD2 3.83Å; L97-L116 HydrophobicContact CD2-CD2 4.44Å; L97-L119 HydrophobicContact CD1-CD2 3.41Å; L97-L119 VanDerWaalsContact CD1-CD2 3.41Å
98D93.2Very high89.1Confident98 Ų9882 Ų8252%0.52444%0.441SS..Hα-helixtrans-60.5-46.9174.6-71.9-31.6000112.2E94 Y100 I101 A102E94-D98 PolarHBondContact O-N 2.93Å; D98-Y100 VanDerWaalsContact C-N 3.35Å; D98-Y100 PolarHBondContact O-N 3.17Å; D98-I101 PolarHBondContact O-N 3.14Å; D98-A102 WeakPolarHBondContact O-CB 3.48Å; D98-A102 PolarHBondContact O-N 2.97Å
99E94.7Very high88.8Confident125 Ų12579.8 Ų79.858%0.58444%0.437SS*.Hα-helixtrans-58.8-44.6175.8-177.1177.7-163.700111.8A95 A102 I103A95-E99 PolarHBondContact O-N 2.98Å; E99-A102 PolarHBondContact O-N 2.7Å; E99-I103 HydrophobicContact CG-CD1 4.04Å; E99-I103 VanDerWaalsContact O-CG1 3.3Å; E99-I103 WeakPolarHBondContact O-CG1 3.26Å; E99-I103 PolarHBondContact O-N 2.74Å
100Y94.8Very high88.9Confident3 Ų378.7 Ų78.71%0.01243%0.428CS..Hα-helixtrans-62.6-44.5175.5165.1-93000112.6K96 L97 D98 A102 I103 A104 A115 L119 I126 S129 L130 L133K96-Y100 WeakPolarHBondContact O-CB 3.4Å; K96-Y100 PolarHBondContact O-N 3.39Å; K96-Y100 VanDerWaalsContact O-N 3.07Å; L97-Y100 HydrophobicContact CD1-CD1 4.44Å; L97-Y100 PolarHBondContact O-N 2.9Å; D98-Y100 VanDerWaalsContact C-N 3.35Å; D98-Y100 PolarHBondContact O-N 3.17Å; Y100-A102 VanDerWaalsContact C-N 3.34Å; Y100-A102 PolarHBondContact O-N 3.39Å; Y100-I103 PolarHBondContact O-N 3.31Å; Y100-A104 WeakPolarHBondContact O-CB 3.49Å; Y100-A104 PolarHBondContact O-N 3.44Å; Y100-A115 HydrophobicContact CE1-CB 4.11Å; Y100-A115 VanDerWaalsContact CE1-O 3.26Å; Y100-A115 WeakPolarHBondContact CE1-O 3.38Å; Y100-A115 PolarHBondContact OH-O 3.46Å; Y100-L119 HydrophobicContact CD1-CB 4.43Å; Y100-L119 HydrophobicContact CD1-CD2 3.8Å; Y100-L119 HydrophobicContact CE1-CB 3.69Å; Y100-L119 HydrophobicContact CE1-CD2 3.89Å; Y100-L119 HydrophobicContact CE1-CG 4.26Å; Y100-L119 HydrophobicContact CG-CD2 4.43Å; Y100-I126 HydrophobicContact CD2-CG2 4.15Å; Y100-I126 HydrophobicContact CG-CG1 4.46Å; Y100-S129 PolarHBondContact OH-OG 3Å; Y100-L130 HydrophobicContact CD2-CD2 3.59Å; Y100-L130 HydrophobicContact CD2-CG 3.91Å; Y100-L130 HydrophobicContact CE2-CD2 3.9Å; Y100-L130 HydrophobicContact CE2-CG 4.24Å; Y100-L133 HydrophobicContact CE2-CD1 4.2Å
101I93.5Very high89Confident21 Ų2176.2 Ų76.211%0.10841%0.408CS..Hα-helixtrans-64.1-40.7177.9-68.7165.3000110.6L97 D98 A104 K105 M112 L116L97-I101 HydrophobicContact CD1-CD1 4.04Å; L97-I101 HydrophobicContact CD1-CG1 4.33Å; L97-I101 HydrophobicContact CG-CD1 3.93Å; L97-I101 VanDerWaalsContact O-CG1 3.28Å; L97-I101 WeakPolarHBondContact O-CG1 3.35Å; L97-I101 PolarHBondContact O-N 3.47Å; D98-I101 PolarHBondContact O-N 3.14Å; I101-A104 PolarHBondContact O-N 2.99Å; I101-K105 VanDerWaalsContact O-CB 3.28Å; I101-K105 WeakPolarHBondContact O-CB 3.17Å; I101-K105 PolarHBondContact O-N 3.35Å; I101-M112 HydrophobicContact CG2-CE 4.2Å; I101-M112 HydrophobicContact CG2-CG 4.42Å; I101-L116 HydrophobicContact CD1-CD2 4Å; I101-L116 HydrophobicContact CD1-CG 4.49Å
102A94.1Very high89.3Confident39 Ų3974.6 Ų74.632%0.32240%0.397SS..Hα-helixtrans-60.6-48174.700000111.3D98 E99 Y100 A104 K105 E106D98-A102 WeakPolarHBondContact O-CB 3.48Å; D98-A102 PolarHBondContact O-N 2.97Å; E99-A102 PolarHBondContact O-N 2.7Å; Y100-A102 VanDerWaalsContact C-N 3.34Å; Y100-A102 PolarHBondContact O-N 3.39Å; A102-A104 PolarHBondContact O-N 2.73Å; A102-K105 PolarHBondContact O-N 3.4Å; A102-E106 VanDerWaalsContact O-CB 3.31Å; A102-E106 WeakPolarHBondContact O-CB 3.31Å; A102-E106 WeakPolarHBondContact O-CG 3.2Å; A102-E106 PolarHBondContact O-N 3.38Å
103I92.9Very high89.5Confident38 Ų3879.8 Ų79.820%0.19542%0.42CS..Hα-helixtrans-60.4-47177.3-69.8165.3000111.6E99 Y100 K105 K107 L130E99-I103 HydrophobicContact CG-CD1 4.04Å; E99-I103 VanDerWaalsContact O-CG1 3.3Å; E99-I103 WeakPolarHBondContact O-CG1 3.26Å; E99-I103 PolarHBondContact O-N 2.74Å; Y100-I103 PolarHBondContact O-N 3.31Å; I103-K105 VanDerWaalsContact C-N 3.33Å; I103-K105 PolarHBondContact O-N 3.41Å; I103-K107 HydrophobicContact CG2-CD 4.2Å; I103-K107 WeakPolarHBondContact O-CB 3.46Å; I103-K107 PolarHBondContact O-N 3.48Å; I103-L130 HydrophobicContact CB-CD2 4.23Å; I103-L130 HydrophobicContact CG2-CD2 3.59Å
104A91Very high89.5Confident0 Ų080.8 Ų80.80%042%0.415CS..Hα-helixtrans-61.7-40.6179.900000112.4Y100 I101 A102 H108 G109 Y110 A115 L133Y100-A104 WeakPolarHBondContact O-CB 3.49Å; Y100-A104 PolarHBondContact O-N 3.44Å; I101-A104 PolarHBondContact O-N 2.99Å; A102-A104 PolarHBondContact O-N 2.73Å; A104-H108 CarbonylContact O-C 3.37Å; A104-H108 WeakPolarHBondContact O-CA 3.26Å; A104-H108 WeakPolarHBondContact O-CB 3.26Å; A104-H108 PolarHBondContact O-N 3.43Å; A104-G109 PolarHBondContact O-N 3.48Å; A104-Y110 HydrophobicContact CB-CG 4.47Å; A104-Y110 PolarHBondContact O-N 3.05Å; A104-Y110 VanDerWaalsContact O-N 3.08Å; A104-A115 HydrophobicContact CB-CB 3.72Å; A104-L133 HydrophobicContact CB-CD1 3.72Å; A104-L133 HydrophobicContact CB-CD2 3.97Å
105K88.2Confident89.6Confident140 Ų14073.4 Ų73.461%0.60938%0.381SS*.Hα-helixtrans-72.3-50.4178.3-175.9-175.6175.4-168.90112.6I101 A102 I103 G109 Y110I101-K105 VanDerWaalsContact O-CB 3.28Å; I101-K105 WeakPolarHBondContact O-CB 3.17Å; I101-K105 PolarHBondContact O-N 3.35Å; A102-K105 PolarHBondContact O-N 3.4Å; I103-K105 VanDerWaalsContact C-N 3.33Å; I103-K105 PolarHBondContact O-N 3.41Å; K105-G109 WeakPolarHBondContact O-CA 3.43Å; K105-G109 PolarHBondContact O-N 3.25Å; K105-G109 VanDerWaalsContact O-N 3.12Å; K105-Y110 WeakPolarHBondContact CA-O 3.27Å
106E88.7Confident89.6Confident163 Ų16371.2 Ų71.276%0.76236%0.358SS*.Hα-helixtrans-79.7-32.7-169.9-67.1-178.6176.700113.6A102A102-E106 VanDerWaalsContact O-CB 3.31Å; A102-E106 WeakPolarHBondContact O-CB 3.31Å; A102-E106 WeakPolarHBondContact O-CG 3.2Å; A102-E106 PolarHBondContact O-N 3.38Å
107K86.5Confident89.6Confident150 Ų15066.1 Ų66.165%0.65234%0.342SS*.Hα-helixtrans-99.5-24.3-178.7-57.7-172.1-169.3170.60114I103I103-K107 HydrophobicContact CG2-CD 4.2Å; I103-K107 WeakPolarHBondContact O-CB 3.46Å; I103-K107 PolarHBondContact O-N 3.48Å
108H83.5Confident89.5Confident44 Ų4466 Ų6620%0.20434%0.341CS..Hα-helixtrans-127.11.4-172.7-53.4-78.3000113.9A104 Y110 L133A104-H108 CarbonylContact O-C 3.37Å; A104-H108 WeakPolarHBondContact O-CA 3.26Å; A104-H108 WeakPolarHBondContact O-CB 3.26Å; A104-H108 PolarHBondContact O-N 3.43Å; H108-Y110 VanDerWaalsContact C-N 3.26Å; H108-Y110 HydrophobicContact CB-CD2 3.57Å; H108-Y110 HydrophobicContact CB-CE2 3.7Å; H108-Y110 WeakPolarHBondContact O-CD2 3.43Å; H108-Y110 PolarHBondContact O-N 3.19Å; H108-L133 HydrophobicContact CB-CB 4.41Å
109G80.7Confident89.5Confident59 Ų5961.4 Ų61.461%0.60832%0.316SS*.  trans70.713.4174.400000115.6A104 K105A104-G109 PolarHBondContact O-N 3.48Å; K105-G109 WeakPolarHBondContact O-CA 3.43Å; K105-G109 PolarHBondContact O-N 3.25Å; K105-G109 VanDerWaalsContact O-N 3.12Å
110Y85.6Confident89.4Confident7 Ų758.1 Ų58.13%0.02730%0.3CS..  trans-69.9139.9-179.4-78.2-118.2000111.3A104 K105 H108 Q114 M118 L133 F136 T137A104-Y110 HydrophobicContact CB-CG 4.47Å; A104-Y110 PolarHBondContact O-N 3.05Å; A104-Y110 VanDerWaalsContact O-N 3.08Å; K105-Y110 WeakPolarHBondContact CA-O 3.27Å; H108-Y110 VanDerWaalsContact C-N 3.26Å; H108-Y110 HydrophobicContact CB-CD2 3.57Å; H108-Y110 HydrophobicContact CB-CE2 3.7Å; H108-Y110 WeakPolarHBondContact O-CD2 3.43Å; H108-Y110 PolarHBondContact O-N 3.19Å; Y110-Q114 HydrophobicContact CD1-CB 3.73Å; Y110-Q114 HydrophobicContact CG-CB 4.49Å; Y110-M118 HydrophobicContact CE1-CE 4Å; Y110-L133 HydrophobicContact CD1-CD2 3.87Å; Y110-L133 HydrophobicContact CD2-CD2 3.86Å; Y110-L133 HydrophobicContact CE1-CD2 3.61Å; Y110-L133 HydrophobicContact CE2-CB 4.32Å; Y110-L133 HydrophobicContact CE2-CD2 3.57Å; Y110-L133 HydrophobicContact CG-CD2 4.01Å; Y110-L133 VanDerWaalsContact CZ-CD2 3.44Å; Y110-L133 PolarHBondContact OH-O 2.86Å; Y110-F136 WeakPolarHBondContact OH-CB 3.38Å; Y110-F136 PolarHBondContact OH-O 3.03Å; Y110-T137 PolarHBondContact OH-N 3.01Å
111N84.6Confident89.2Confident77 Ų7767.9 Ų67.941%0.41234%0.337SS..  trans-73.7164.2162.888.137.4000110.6E113 Q114 A115N111-E113 PolarHBondContact O-N 3.03Å; N111-E113 WeakPolarHBondContact OD1-CA 3.47Å; N111-E113 WeakPolarHBondContact OD1-CB 3.36Å; N111-E113 PolarHBondContact OD1-N 2.92Å; N111-Q114 VanDerWaalsContact CG-OE1 3.24Å; N111-Q114 PolarHBondContact ND2-OE1 3.31Å; N111-Q114 PolarHBondContact O-N 2.98Å; N111-Q114 PolarHBondContact OD1-N 3.26Å; N111-A115 PolarHBondContact O-N 3.35Å
112M87.2Confident89.2Confident119 Ų11968.4 Ų68.459%0.58634%0.339SS*.Hα-helixtrans-60.1-41.9-175.6-179.2176.9-83.900113.1I101 A115 L116I101-M112 HydrophobicContact CG2-CE 4.2Å; I101-M112 HydrophobicContact CG2-CG 4.42Å; M112-A115 PolarHBondContact O-N 3.39Å; M112-L116 HydrophobicContact CG-CD1 4.16Å; M112-L116 WeakPolarHBondContact O-CB 3.35Å; M112-L116 VanDerWaalsContact O-CG 3.25Å; M112-L116 WeakPolarHBondContact O-CG 3.38Å; M112-L116 PolarHBondContact O-N 3.42Å
113E88.6Confident89.1Confident146 Ų14675.3 Ų75.368%0.68236%0.362SS*.Hα-helixtrans-68.4-37.1179.3-60.3-179.9166.400111.7N111 G117N111-E113 PolarHBondContact O-N 3.03Å; N111-E113 WeakPolarHBondContact OD1-CA 3.47Å; N111-E113 WeakPolarHBondContact OD1-CB 3.36Å; N111-E113 PolarHBondContact OD1-N 2.92Å; E113-G117 PolarHBondContact O-N 3.34Å
114Q87.8Confident89.1Confident79 Ų7975.1 Ų75.137%0.36936%0.36SS..Hα-helixtrans-66.4-42.2174.3-67.5169.1-4500111.6Y110 N111 G117 M118Y110-Q114 HydrophobicContact CD1-CB 3.73Å; Y110-Q114 HydrophobicContact CG-CB 4.49Å; N111-Q114 VanDerWaalsContact CG-OE1 3.24Å; N111-Q114 PolarHBondContact ND2-OE1 3.31Å; N111-Q114 PolarHBondContact O-N 2.98Å; N111-Q114 PolarHBondContact OD1-N 3.26Å; Q114-G117 PolarHBondContact O-N 3.13Å; Q114-M118 WeakPolarHBondContact O-CB 3.35Å; Q114-M118 PolarHBondContact O-N 2.91Å
115A91.1Very high89.1Confident1 Ų177.8 Ų77.81%0.00837%0.374CS..Hα-helixtrans-63.6-45.3176.800000111.3Y100 A104 N111 M112 M118 L119Y100-A115 HydrophobicContact CE1-CB 4.11Å; Y100-A115 VanDerWaalsContact CE1-O 3.26Å; Y100-A115 WeakPolarHBondContact CE1-O 3.38Å; Y100-A115 PolarHBondContact OH-O 3.46Å; A104-A115 HydrophobicContact CB-CB 3.72Å; N111-A115 PolarHBondContact O-N 3.35Å; M112-A115 PolarHBondContact O-N 3.39Å; A115-M118 PolarHBondContact O-N 3.34Å; A115-L119 WeakPolarHBondContact O-CB 3.37Å; A115-L119 PolarHBondContact O-N 3.48Å
116L91.8Very high89.3Confident28 Ų2872.8 Ų72.815%0.14735%0.354CS..Hα-helixtrans-62.3-43.9174.1-70.8176.7000111.9W86 L97 I101 M112 M118 L119 F120W86-L116 HydrophobicContact CB-CB 4.46Å; W86-L116 HydrophobicContact CD2-CB 4.04Å; W86-L116 HydrophobicContact CD2-CD1 4.45Å; W86-L116 HydrophobicContact CD2-CD2 3.91Å; W86-L116 HydrophobicContact CD2-CG 4.35Å; W86-L116 HydrophobicContact CE3-CB 3.77Å; W86-L116 HydrophobicContact CE3-CD2 3.83Å; W86-L116 HydrophobicContact CE3-CG 4.35Å; W86-L116 VanDerWaalsContact CE3-O 3.32Å; W86-L116 HydrophobicContact CG-CB 4.34Å; W86-L116 HydrophobicContact CG-CD1 4.42Å; W86-L116 HydrophobicContact CH2-CD2 3.76Å; W86-L116 HydrophobicContact CZ2-CD2 3.82Å; W86-L116 HydrophobicContact CZ3-CB 4.35Å; W86-L116 HydrophobicContact CZ3-CD2 3.77Å; L97-L116 HydrophobicContact CD1-CD2 3.83Å; L97-L116 HydrophobicContact CD2-CD2 4.44Å; I101-L116 HydrophobicContact CD1-CD2 4Å; I101-L116 HydrophobicContact CD1-CG 4.49Å; M112-L116 HydrophobicContact CG-CD1 4.16Å; M112-L116 WeakPolarHBondContact O-CB 3.35Å; M112-L116 VanDerWaalsContact O-CG 3.25Å; M112-L116 WeakPolarHBondContact O-CG 3.38Å; M112-L116 PolarHBondContact O-N 3.42Å; L116-M118 PolarHBondContact O-N 3Å; L116-L119 PolarHBondContact O-N 2.8Å; L116-F120 WeakPolarHBondContact O-CB 3.19Å; L116-F120 PolarHBondContact O-N 3Å
117G90.8Very high89.4Confident20 Ų2072.5 Ų72.521%0.20635%0.352CS..Hα-helixtrans-59.9-44.4176.500000113.3V85 E113 Q114 F120 W121V85-G117 VanDerWaalsContact O-CA 3.29Å; V85-G117 WeakPolarHBondContact O-CA 3.34Å; E113-G117 PolarHBondContact O-N 3.34Å; Q114-G117 PolarHBondContact O-N 3.13Å; G117-F120 PolarHBondContact O-N 3.31Å; G117-W121 WeakPolarHBondContact O-CB 3.2Å; G117-W121 PolarHBondContact O-N 3.11Å
118M90.9Very high89.7Confident30 Ų3071.6 Ų71.615%0.14835%0.349CS..Hα-helixtrans-61.8-46.2173.8-164.161.86700110.9Y110 Q114 A115 L116 F120 W121 H122 S129 L133 F136Y110-M118 HydrophobicContact CE1-CE 4Å; Q114-M118 WeakPolarHBondContact O-CB 3.35Å; Q114-M118 PolarHBondContact O-N 2.91Å; A115-M118 PolarHBondContact O-N 3.34Å; L116-M118 PolarHBondContact O-N 3Å; M118-F120 VanDerWaalsContact C-N 3.32Å; M118-F120 PolarHBondContact O-N 2.87Å; M118-W121 WeakPolarHBondContact O-CB 3.33Å; M118-W121 PolarHBondContact O-N 3.2Å; M118-H122 PolarHBondContact O-CD2 3.11Å; M118-H122 PolarHBondContact O-N 2.98Å; M118-S129 WeakPolarHBondContact CG-OG 3.4Å; M118-L133 HydrophobicContact CG-CD2 4.36Å; M118-F136 HydrophobicContact CE-CB 3.52Å; M118-F136 HydrophobicContact CE-CD2 4.08Å; M118-F136 HydrophobicContact CE-CG 3.96Å; M118-F136 HydrophobicContact SD-CD2 4.19Å
119L93.1Very high90.1Very high0 Ų069.5 Ų69.50%034%0.339CS..Hα-helixtrans-64.9-35.6179.5-175.760.5000112.7W86 L92 L97 Y100 A115 L116 H122 K123 H124 I126 S129W86-L119 HydrophobicContact CH2-CD2 4.1Å; W86-L119 HydrophobicContact CZ3-CB 4.25Å; W86-L119 HydrophobicContact CZ3-CD2 4.09Å; W86-L119 HydrophobicContact CZ3-CG 4.22Å; L92-L119 HydrophobicContact CD2-CD2 3.92Å; L97-L119 HydrophobicContact CD1-CD2 3.41Å; L97-L119 VanDerWaalsContact CD1-CD2 3.41Å; Y100-L119 HydrophobicContact CD1-CB 4.43Å; Y100-L119 HydrophobicContact CD1-CD2 3.8Å; Y100-L119 HydrophobicContact CE1-CB 3.69Å; Y100-L119 HydrophobicContact CE1-CD2 3.89Å; Y100-L119 HydrophobicContact CE1-CG 4.26Å; Y100-L119 HydrophobicContact CG-CD2 4.43Å; A115-L119 WeakPolarHBondContact O-CB 3.37Å; A115-L119 PolarHBondContact O-N 3.48Å; L116-L119 PolarHBondContact O-N 2.8Å; L119-H122 PolarHBondContact O-N 2.8Å; L119-K123 PolarHBondContact O-N 3.18Å; L119-H124 WeakPolarHBondContact O-CA 3.25Å; L119-H124 PolarHBondContact O-N 3.43Å; L119-I126 HydrophobicContact CD1-CG1 3.96Å; L119-S129 WeakPolarHBondContact CA-OG 3.4Å; L119-S129 PolarHBondContact N-OG 3.47Å
120F93Very high90.6Very high56 Ų5669.1 Ų69.125%0.24632%0.323CS..Hα-helixtrans-66.1-43.2173.4-179.7-119.9000111.7L84 W86 L87 L116 G117 M118 H122 K123 H124L84-F120 HydrophobicContact CD2-CE1 4.22Å; L84-F120 HydrophobicContact CD2-CZ 3.78Å; L84-F120 HydrophobicContact CG-CE1 3.97Å; L84-F120 HydrophobicContact CG-CZ 3.96Å; L84-F120 VanDerWaalsContact O-CE1 3.32Å; L84-F120 WeakPolarHBondContact O-CE1 3.4Å; W86-F120 HydrophobicContact CE3-CB 4.01Å; W86-F120 HydrophobicContact CZ3-CB 4.5Å; L87-F120 HydrophobicContact CB-CD2 4.37Å; L87-F120 HydrophobicContact CB-CE2 3.91Å; L87-F120 HydrophobicContact CD1-CE2 4.08Å; L87-F120 HydrophobicContact CD1-CZ 4.31Å; L87-F120 HydrophobicContact CG-CE2 4.01Å; L87-F120 HydrophobicContact CG-CZ 4.31Å; L116-F120 WeakPolarHBondContact O-CB 3.19Å; L116-F120 PolarHBondContact O-N 3Å; G117-F120 PolarHBondContact O-N 3.31Å; M118-F120 VanDerWaalsContact C-N 3.32Å; M118-F120 PolarHBondContact O-N 2.87Å; F120-H122 VanDerWaalsContact C-N 3.3Å; F120-H122 PolarHBondContact O-N 3.34Å; F120-K123 WeakPolarHBondContact O-CA 3.28Å; F120-K123 PolarHBondContact O-N 2.86Å; F120-H124 AromaticContact CD2-CE1 3.86Å
121W90.7Very high90.9Very high208 Ų20871.9 Ų71.979%0.78835%0.347SS*.Hα-helixtrans-56.4-42.8174.3-171.1-86.8000112G117 M118 K123G117-W121 WeakPolarHBondContact O-CB 3.2Å; G117-W121 PolarHBondContact O-N 3.11Å; M118-W121 WeakPolarHBondContact O-CB 3.33Å; M118-W121 PolarHBondContact O-N 3.2Å; W121-K123 PolarHBondContact O-N 3.38Å
122H92.1Very high91.1Very high32 Ų3270.5 Ų70.515%0.14834%0.34CS..THydrogen-bonded Turntrans-8016.3174.2-66.3-76.7000114.5M118 L119 F120 H124 N125 K128 D132M118-H122 PolarHBondContact O-CD2 3.11Å; M118-H122 PolarHBondContact O-N 2.98Å; L119-H122 PolarHBondContact O-N 2.8Å; F120-H122 VanDerWaalsContact C-N 3.3Å; F120-H122 PolarHBondContact O-N 3.34Å; H122-H124 VanDerWaalsContact C-N 3.3Å; H122-H124 PolarHBondContact O-N 3.49Å; H122-N125 VanDerWaalsContact O-CB 3.28Å; H122-N125 WeakPolarHBondContact O-CB 3.23Å; H122-N125 PolarHBondContact O-N 3.24Å; H122-N125 VanDerWaalsContact O-N 3.11Å; H122-K128 HydrophobicContact CB-CB 4.34Å; H122-D132 IonicContact CE1-OD2 3.19Å; H122-D132 PolarHBondContact CE1-OD2 2.97Å; H122-D132 IonicContact NE2-OD2 3.85Å
123K91.6Very high91Very high184 Ų18464.9 Ų64.980%0.831%0.312SS*.THydrogen-bonded Turntrans53.944.2178.7-55-176.7-178.5-177.10112.7L119 F120 W121 N125L119-K123 PolarHBondContact O-N 3.18Å; F120-K123 WeakPolarHBondContact O-CA 3.28Å; F120-K123 PolarHBondContact O-N 2.86Å; W121-K123 PolarHBondContact O-N 3.38Å; K123-N125 PolarHBondContact O-N 2.86Å
124H93.1Very high90.8Very high35 Ų3561.1 Ų61.116%0.16230%0.3CS..THydrogen-bonded Turntrans63.614.8-178.3-51.193.1000115.6W86 L87 S89 L119 F120 H122 I126W86-H124 AromaticContact CH2-CD2 3.58Å; W86-H124 AromaticContact CH2-NE2 3.79Å; W86-H124 AromaticContact CZ3-CD2 3.61Å; W86-H124 AromaticContact CZ3-NE2 3.65Å; L87-H124 PolarHBondContact O-CE1 3.3Å; L87-H124 PolarHBondContact O-NE2 3.05Å; S89-H124 VanDerWaalsContact CB-CG 3.46Å; L119-H124 WeakPolarHBondContact O-CA 3.25Å; L119-H124 PolarHBondContact O-N 3.43Å; F120-H124 AromaticContact CD2-CE1 3.86Å; H122-H124 VanDerWaalsContact C-N 3.3Å; H122-H124 PolarHBondContact O-N 3.49Å; H124-I126 PolarHBondContact O-N 3.4Å
125N91.5Very high90.3Very high56 Ų5662.8 Ų62.830%0.29931%0.312SS..  trans-80.8101.8172.6-171.9-68.8000110.6H122 K123 E127 K128 S129H122-N125 VanDerWaalsContact O-CB 3.28Å; H122-N125 WeakPolarHBondContact O-CB 3.23Å; H122-N125 PolarHBondContact O-N 3.24Å; H122-N125 VanDerWaalsContact O-N 3.11Å; K123-N125 PolarHBondContact O-N 2.86Å; N125-E127 PolarHBondContact O-N 3.46Å; N125-E127 PolarHBondContact OD1-N 3.11Å; N125-K128 HydrophobicContact CB-CB 4.37Å; N125-K128 HydrophobicContact CB-CD 4.38Å; N125-K128 WeakPolarHBondContact OD1-CB 3.3Å; N125-K128 WeakPolarHBondContact OD1-CG 3.39Å; N125-K128 PolarHBondContact OD1-N 3.03Å; N125-S129 WeakPolarHBondContact O-CB 3.14Å; N125-S129 PolarHBondContact O-N 2.85Å; N125-S129 VanDerWaalsContact O-N 3.11Å
126I92Very high89.5Confident35 Ų3568.4 Ų68.418%0.17934%0.336CS..Hα-helixtrans-55-47.3178.6-72.9176.4000111.7L92 K96 Y100 L119 H124 K128 S129 L130L92-I126 HydrophobicContact CD1-CD1 3.85Å; L92-I126 HydrophobicContact CD1-CG1 4.22Å; K96-I126 HydrophobicContact CB-CD1 3.8Å; K96-I126 WeakPolarHBondContact O-CD1 3.47Å; Y100-I126 HydrophobicContact CD2-CG2 4.15Å; Y100-I126 HydrophobicContact CG-CG1 4.46Å; L119-I126 HydrophobicContact CD1-CG1 3.96Å; H124-I126 PolarHBondContact O-N 3.4Å; I126-K128 PolarHBondContact O-N 3.34Å; I126-S129 PolarHBondContact O-N 2.9Å; I126-L130 HydrophobicContact CG2-CD1 3.63Å; I126-L130 HydrophobicContact CG2-CG 3.98Å; I126-L130 WeakPolarHBondContact O-CB 3.29Å; I126-L130 WeakPolarHBondContact O-CG 3.35Å; I126-L130 PolarHBondContact O-N 3.06Å
127E92.1Very high88.1Confident156 Ų15670 Ų7073%0.72935%0.347SS*.Hα-helixtrans-61.7-44.7-172.8-65.6166.6-174.300112.3N125 A131N125-E127 PolarHBondContact O-N 3.46Å; N125-E127 PolarHBondContact OD1-N 3.11Å; E127-A131 PolarHBondContact O-N 2.94Å; E127-A131 VanDerWaalsContact O-N 3.1Å
128K91.3Very high86.4Confident131 Ų13171 Ų7157%0.5735%0.35SS*.Hα-helixtrans-66.3-44.1175-69.1180-178.3-171.10111.5H122 N125 I126 L130 A131 D132H122-K128 HydrophobicContact CB-CB 4.34Å; N125-K128 HydrophobicContact CB-CB 4.37Å; N125-K128 HydrophobicContact CB-CD 4.38Å; N125-K128 WeakPolarHBondContact OD1-CB 3.3Å; N125-K128 WeakPolarHBondContact OD1-CG 3.39Å; N125-K128 PolarHBondContact OD1-N 3.03Å; I126-K128 PolarHBondContact O-N 3.34Å; K128-L130 PolarHBondContact O-N 3.39Å; K128-A131 PolarHBondContact O-N 3.42Å; K128-D132 PolarHBondContact O-N 2.83Å; K128-D132 VanDerWaalsContact O-N 3.17Å
129S92.9Very high84.4Confident0 Ų079.1 Ų79.10%039%0.385CS..Hα-helixtrans-60-45.4177.5-154.40000111.4Y100 M118 L119 N125 I126 A131 D132 L133Y100-S129 PolarHBondContact OH-OG 3Å; M118-S129 WeakPolarHBondContact CG-OG 3.4Å; L119-S129 WeakPolarHBondContact CA-OG 3.4Å; L119-S129 PolarHBondContact N-OG 3.47Å; N125-S129 WeakPolarHBondContact O-CB 3.14Å; N125-S129 PolarHBondContact O-N 2.85Å; N125-S129 VanDerWaalsContact O-N 3.11Å; I126-S129 PolarHBondContact O-N 2.9Å; S129-A131 VanDerWaalsContact C-N 3.33Å; S129-A131 PolarHBondContact O-N 3.19Å; S129-D132 PolarHBondContact O-N 2.86Å; S129-L133 WeakPolarHBondContact O-CG 3.29Å; S129-L133 PolarHBondContact O-N 3.16Å
130L91.6Very high82.6Confident52 Ų5283.4 Ų83.427%0.27241%0.413SS..Hα-helixtrans-62.5-35.2176.1-72.7179.5000113.3Y100 I103 I126 K128 D132 L133Y100-L130 HydrophobicContact CD2-CD2 3.59Å; Y100-L130 HydrophobicContact CD2-CG 3.91Å; Y100-L130 HydrophobicContact CE2-CD2 3.9Å; Y100-L130 HydrophobicContact CE2-CG 4.24Å; I103-L130 HydrophobicContact CB-CD2 4.23Å; I103-L130 HydrophobicContact CG2-CD2 3.59Å; I126-L130 HydrophobicContact CG2-CD1 3.63Å; I126-L130 HydrophobicContact CG2-CG 3.98Å; I126-L130 WeakPolarHBondContact O-CB 3.29Å; I126-L130 WeakPolarHBondContact O-CG 3.35Å; I126-L130 PolarHBondContact O-N 3.06Å; K128-L130 PolarHBondContact O-N 3.39Å; L130-D132 VanDerWaalsContact C-N 3.32Å; L130-L133 HydrophobicContact CD2-CD1 3.7Å
131A90.9Very high81Confident65 Ų6585.5 Ų85.554%0.53743%0.427SS..Hα-helixtrans-69.1-29.4176.900000113E127 K128 S129 P134E127-A131 PolarHBondContact O-N 2.94Å; E127-A131 VanDerWaalsContact O-N 3.1Å; K128-A131 PolarHBondContact O-N 3.42Å; S129-A131 VanDerWaalsContact C-N 3.33Å; S129-A131 PolarHBondContact O-N 3.19Å; A131-P134 WeakPolarHBondContact O-CD 3.48Å
132D88.7Confident80.1Confident48 Ų4883 Ų8326%0.25742%0.424SS..Hα-helixtrans-98.2-13-178.6-84.1-46.2000114.6H122 K128 S129 L130 P134 N135 F136H122-D132 IonicContact CE1-OD2 3.19Å; H122-D132 PolarHBondContact CE1-OD2 2.97Å; H122-D132 IonicContact NE2-OD2 3.85Å; K128-D132 PolarHBondContact O-N 2.83Å; K128-D132 VanDerWaalsContact O-N 3.17Å; S129-D132 PolarHBondContact O-N 2.86Å; L130-D132 VanDerWaalsContact C-N 3.32Å; D132-P134 VanDerWaalsContact C-CD 3.4Å; D132-P134 VanDerWaalsContact C-N 3.33Å; D132-N135 WeakPolarHBondContact O-CB 3.34Å; D132-N135 PolarHBondContact O-N 2.9Å; D132-N135 PolarHBondContact OD1-ND2 2.73Å; D132-F136 HydrophobicContact CB-CD2 4.01Å; D132-F136 HydrophobicContact CB-CE2 4.04Å; D132-F136 WeakPolarHBondContact O-CD2 3.41Å; D132-F136 PolarHBondContact O-N 3.07Å; D132-F136 VanDerWaalsContact O-N 3.1Å
133L86.7Confident79.6Confident0 Ų083.1 Ų83.10%042%0.423CS..THydrogen-bonded Turntrans-49.7-41.6170.5-76.6175.5000114.2Y100 A104 H108 Y110 M118 S129 L130 N135 T137Y100-L133 HydrophobicContact CE2-CD1 4.2Å; A104-L133 HydrophobicContact CB-CD1 3.72Å; A104-L133 HydrophobicContact CB-CD2 3.97Å; H108-L133 HydrophobicContact CB-CB 4.41Å; Y110-L133 HydrophobicContact CD1-CD2 3.87Å; Y110-L133 HydrophobicContact CD2-CD2 3.86Å; Y110-L133 HydrophobicContact CE1-CD2 3.61Å; Y110-L133 HydrophobicContact CE2-CB 4.32Å; Y110-L133 HydrophobicContact CE2-CD2 3.57Å; Y110-L133 HydrophobicContact CG-CD2 4.01Å; Y110-L133 VanDerWaalsContact CZ-CD2 3.44Å; Y110-L133 PolarHBondContact OH-O 2.86Å; M118-L133 HydrophobicContact CG-CD2 4.36Å; S129-L133 WeakPolarHBondContact O-CG 3.29Å; S129-L133 PolarHBondContact O-N 3.16Å; L130-L133 HydrophobicContact CD2-CD1 3.7Å; L133-N135 VanDerWaalsContact C-N 3.34Å; L133-T137 PolarHBondContact O-N 3.36Å; L133-T137 PolarHBondContact O-OG1 3.06Å
134P82.5Confident79.2Confident68 Ų6877.2 Ų77.244%0.44240%0.402SS..THydrogen-bonded Turntrans-63.7-39.4173.9-19.231.9000112.6A131 D132 F136 T137A131-P134 WeakPolarHBondContact O-CD 3.48Å; D132-P134 VanDerWaalsContact C-CD 3.4Å; D132-P134 VanDerWaalsContact C-N 3.33Å; P134-F136 VanDerWaalsContact C-N 3.34Å; P134-F136 PolarHBondContact O-N 2.89Å; P134-T137 WeakPolarHBondContact CA-OG1 3.46Å; P134-T137 PolarHBondContact O-N 2.96Å; P134-T137 PolarHBondContact O-OG1 3.16Å
135N78.5Confident78.6Confident113 Ų11380.1 Ų80.160%0.60442%0.422SS*.THydrogen-bonded Turntrans-71.4-29.8-173-59.7-27.9000112.5D132 L133D132-N135 WeakPolarHBondContact O-CB 3.34Å; D132-N135 PolarHBondContact O-N 2.9Å; D132-N135 PolarHBondContact OD1-ND2 2.73Å; L133-N135 VanDerWaalsContact C-N 3.34Å
136F74.1Confident78.2Confident119 Ų11983.3 Ų83.352%0.52244%0.435SS..THydrogen-bonded Turntrans-110.815.5179.9-62.3-72.8000113.7Y110 M118 D132 P134 P138Y110-F136 WeakPolarHBondContact OH-CB 3.38Å; Y110-F136 PolarHBondContact OH-O 3.03Å; M118-F136 HydrophobicContact CE-CB 3.52Å; M118-F136 HydrophobicContact CE-CD2 4.08Å; M118-F136 HydrophobicContact CE-CG 3.96Å; M118-F136 HydrophobicContact SD-CD2 4.19Å; D132-F136 HydrophobicContact CB-CD2 4.01Å; D132-F136 HydrophobicContact CB-CE2 4.04Å; D132-F136 WeakPolarHBondContact O-CD2 3.41Å; D132-F136 PolarHBondContact O-N 3.07Å; D132-F136 VanDerWaalsContact O-N 3.1Å; P134-F136 VanDerWaalsContact C-N 3.34Å; P134-F136 PolarHBondContact O-N 2.89Å; F136-P138 WeakPolarHBondContact O-CD 3.42Å
137T62.8Low78.2Confident63 Ų6382.6 Ų82.639%0.38743%0.432SS..  trans-52.4113.2-179.5-67.80000109.7Y110 L133 P134 F139Y110-T137 PolarHBondContact OH-N 3.01Å; L133-T137 PolarHBondContact O-N 3.36Å; L133-T137 PolarHBondContact O-OG1 3.06Å; P134-T137 WeakPolarHBondContact CA-OG1 3.46Å; P134-T137 PolarHBondContact O-N 2.96Å; P134-T137 PolarHBondContact O-OG1 3.16Å; T137-F139 PolarHBondContact O-N 2.91Å
138P55.5Low78Confident41 Ų4179.2 Ų79.227%0.26642%0.415SS..  trans-70.6133.9-171.627-33.5000110.3F136 P140F136-P138 WeakPolarHBondContact O-CD 3.42Å; P138-P140 WeakPolarHBondContact O-CD 3.35Å
139F47.4Very low78Confident200 Ų20077.4 Ų77.488%0.87741%0.414SS*.  trans-54.2124.9167.3-91.8-90.6000109.3T137 D141T137-F139 PolarHBondContact O-N 2.91Å; F139-D141 PolarHBondContact O-N 3.28Å
140P55.8Low77.9Confident89 Ų8980.7 Ų80.758%0.57843%0.432SS*.  trans-65.7107.6-177.1-24.435000112.9P138 E142 K172P138-P140 WeakPolarHBondContact O-CD 3.35Å; P140-E142 HydrophobicContact CB-CB 4.2Å; P140-E142 PolarHBondContact O-N 3.23Å; P140-K172 PolarHBondContact O-NZ 3.12Å
141D59.3Low78Confident101 Ų10178.2 Ų78.254%0.5442%0.419SS..  trans-72.1-0.1158.7-162.433.9000110.8F139 S176 R179F139-D141 PolarHBondContact O-N 3.28Å; D141-S176 PolarHBondContact OD1-OG 3.44Å; D141-R179 IonicContact OD1-NH2 3.9Å; D141-R179 IonicContact OD2-NH2 2.65Å; D141-R179 PolarHBondContact OD2-NH2 3.25Å
142E71.9Confident78.1Confident156 Ų15678.6 Ų78.673%0.72941%0.409SS*.SBendtrans-59.8140.9160.9-62.8-150.8145.800110.7P140 K172P140-E142 HydrophobicContact CB-CB 4.2Å; P140-E142 PolarHBondContact O-N 3.23Å; E142-K172 PolarHBondContact O-NZ 3.16Å
143W81.2Confident78.2Confident33 Ų3380.4 Ų80.413%0.12542%0.416CS..  trans-88.2118.6170.1-80.166.8000107.8D147 K148 F151 L169 K172 S176 L177 F180W143-D147 HydrophobicContact CD2-CB 4.36Å; W143-D147 HydrophobicContact CE3-CB 3.61Å; W143-D147 HydrophobicContact CZ3-CB 4.09Å; W143-K148 HydrophobicContact CB-CG 4.27Å; W143-K148 HydrophobicContact CE3-CG 4.3Å; W143-K148 PolarHBondContact O-NZ 2.88Å; W143-F151 HydrophobicContact CH2-CB 4.19Å; W143-F151 AromaticContact CH2-CD2 3.84Å; W143-F151 HydrophobicContact CH2-CD2 3.84Å; W143-F151 HydrophobicContact CH2-CG 4.22Å; W143-F151 HydrophobicContact CZ3-CB 3.68Å; W143-F151 HydrophobicContact CZ3-CD2 4.18Å; W143-F151 HydrophobicContact CZ3-CG 4.1Å; W143-L169 HydrophobicContact CH2-CD1 4.15Å; W143-L169 HydrophobicContact CZ3-CD1 4.05Å; W143-K172 HydrophobicContact CZ2-CB 4.39Å; W143-K172 HydrophobicContact CZ2-CG 4.4Å; W143-S176 PolarHBondContact NE1-OG 3.08Å; W143-L177 HydrophobicContact CH2-CD2 3.65Å; W143-L177 HydrophobicContact CZ2-CD2 4.07Å; W143-F180 HydrophobicContact CB-CE2 4.48Å; W143-F180 HydrophobicContact CD2-CB 4.22Å; W143-F180 HydrophobicContact CD2-CD1 4.43Å; W143-F180 AromaticContact CD2-CD2 3.52Å; W143-F180 HydrophobicContact CD2-CD2 3.52Å; W143-F180 AromaticContact CD2-CE2 3.99Å; W143-F180 HydrophobicContact CD2-CE2 3.99Å; W143-F180 AromaticContact CD2-CG 3.79Å; W143-F180 HydrophobicContact CD2-CG 3.79Å; W143-F180 AromaticContact CE2-CD2 3.79Å; W143-F180 AromaticContact CE2-CG 3.71Å; W143-F180 HydrophobicContact CE3-CD1 4.04Å; W143-F180 AromaticContact CE3-CD2 3.8Å; W143-F180 HydrophobicContact CE3-CD2 3.8Å; W143-F180 HydrophobicContact CE3-CE1 4.19Å; W143-F180 AromaticContact CE3-CE2 3.96Å; W143-F180 HydrophobicContact CE3-CE2 3.96Å; W143-F180 AromaticContact CE3-CG 3.86Å; W143-F180 HydrophobicContact CE3-CG 3.86Å; W143-F180 HydrophobicContact CE3-CZ 4.16Å; W143-F180 AromaticContact CG-CD2 3.86Å; W143-F180 HydrophobicContact CG-CD2 3.86Å; W143-F180 HydrophobicContact CG-CE2 4.22Å; W143-F180 HydrophobicContact CH2-CB 3.84Å; W143-F180 AromaticContact CH2-CD1 3.85Å; W143-F180 HydrophobicContact CH2-CD1 3.85Å; W143-F180 AromaticContact CH2-CG 3.8Å; W143-F180 HydrophobicContact CH2-CG 3.8Å; W143-F180 HydrophobicContact CZ2-CB 3.4Å; W143-F180 HydrophobicContact CZ2-CD1 4.26Å; W143-F180 HydrophobicContact CZ2-CD2 4.29Å; W143-F180 AromaticContact CZ2-CG 3.73Å; W143-F180 HydrophobicContact CZ2-CG 3.73Å; W143-F180 HydrophobicContact CZ3-CB 4.42Å; W143-F180 AromaticContact CZ3-CD1 3.75Å; W143-F180 HydrophobicContact CZ3-CD1 3.75Å; W143-F180 HydrophobicContact CZ3-CD2 4.3Å; W143-F180 HydrophobicContact CZ3-CE1 4.1Å; W143-F180 AromaticContact CZ3-CG 3.88Å; W143-F180 HydrophobicContact CZ3-CG 3.88Å
144T83.7Confident78.5Confident60 Ų6080.4 Ų80.437%0.36842%0.416SS..  trans-68-177.1174.964.50000111E146 D147 K148T144-E146 WeakPolarHBondContact CB-OE2 3.43Å; T144-E146 PolarHBondContact OG1-OE2 3.14Å; T144-D147 PolarHBondContact N-OD2 3.1Å; T144-D147 WeakPolarHBondContact OG1-CB 3.36Å; T144-D147 PolarHBondContact OG1-N 2.77Å; T144-D147 PolarHBondContact OG1-OD2 3.05Å; T144-K148 WeakPolarHBondContact O-CD 3.32Å; T144-K148 WeakPolarHBondContact O-CE 3.43Å; T144-K148 WeakPolarHBondContact O-CG 3.4Å; T144-K148 PolarHBondContact O-NZ 3.49Å
145V80.6Confident79Confident97 Ų9779.2 Ų79.259%0.58840%0.404SS*.Hα-helixtrans-76.8-37.2173179.20000109.2K148 V149V145-K148 WeakPolarHBondContact O-CB 3.43Å; V145-K148 PolarHBondContact O-N 2.82Å; V145-V149 WeakPolarHBondContact O-CG2 3.5Å; V145-V149 PolarHBondContact O-N 2.95Å
146E83.4Confident79.5Confident122 Ų12277.1 Ų77.157%0.5740%0.398SS*.Hα-helixtrans-60.3-48.4176.9-60.163.9-144.500110.3T144 K148 V149 L150T144-E146 WeakPolarHBondContact CB-OE2 3.43Å; T144-E146 PolarHBondContact OG1-OE2 3.14Å; E146-K148 VanDerWaalsContact C-N 3.29Å; E146-K148 PolarHBondContact O-N 3.07Å; E146-V149 PolarHBondContact O-N 3.02Å; E146-L150 WeakPolarHBondContact O-CB 3.25Å; E146-L150 WeakPolarHBondContact O-CG 3.36Å; E146-L150 PolarHBondContact O-N 2.9Å
147D90.8Very high80.2Confident21 Ų2178.2 Ų78.211%0.11240%0.403CS..Hα-helixtrans-56-43.4175.2-70.8-35.9000111.8W143 T144 L150 F151 L169 K172W143-D147 HydrophobicContact CD2-CB 4.36Å; W143-D147 HydrophobicContact CE3-CB 3.61Å; W143-D147 HydrophobicContact CZ3-CB 4.09Å; T144-D147 PolarHBondContact N-OD2 3.1Å; T144-D147 WeakPolarHBondContact OG1-CB 3.36Å; T144-D147 PolarHBondContact OG1-N 2.77Å; T144-D147 PolarHBondContact OG1-OD2 3.05Å; D147-L150 PolarHBondContact O-N 2.89Å; D147-F151 WeakPolarHBondContact O-CB 3.4Å; D147-F151 PolarHBondContact O-N 3.4Å; D147-L169 HydrophobicContact CB-CD2 4.42Å; D147-K172 VanDerWaalsContact OD1-CE 3.31Å; D147-K172 WeakPolarHBondContact OD1-CE 3.38Å; D147-K172 WeakPolarHBondContact OD2-CE 3.49Å; D147-K172 IonicContact OD2-NZ 3.8Å; D147-K172 PolarHBondContact OD2-NZ 2.68Å
148K89.4Confident81.5Confident85 Ų8578 Ų7837%0.3740%0.398SS..Hα-helixtrans-68.9-40.3-177.6-64.9172.3-171.7104.10111W143 T144 V145 E146 E152 F180W143-K148 HydrophobicContact CB-CG 4.27Å; W143-K148 HydrophobicContact CE3-CG 4.3Å; W143-K148 PolarHBondContact O-NZ 2.88Å; T144-K148 WeakPolarHBondContact O-CD 3.32Å; T144-K148 WeakPolarHBondContact O-CE 3.43Å; T144-K148 WeakPolarHBondContact O-CG 3.4Å; T144-K148 PolarHBondContact O-NZ 3.49Å; V145-K148 WeakPolarHBondContact O-CB 3.43Å; V145-K148 PolarHBondContact O-N 2.82Å; E146-K148 VanDerWaalsContact C-N 3.29Å; E146-K148 PolarHBondContact O-N 3.07Å; K148-E152 WeakPolarHBondContact O-CB 3.47Å; K148-E152 PolarHBondContact O-N 2.65Å; K148-F180 HydrophobicContact CB-CZ 4.26Å; K148-F180 HydrophobicContact CG-CE2 4.02Å; K148-F180 HydrophobicContact CG-CZ 3.75Å
149V90.6Very high83.2Confident92 Ų9277.3 Ų77.356%0.55840%0.398SS*.Hα-helixtrans-67.8-44.7175.4172.90000110.8V145 E146 F151 E152 Q153V145-V149 WeakPolarHBondContact O-CG2 3.5Å; V145-V149 PolarHBondContact O-N 2.95Å; E146-V149 PolarHBondContact O-N 3.02Å; V149-F151 PolarHBondContact O-N 3.29Å; V149-E152 PolarHBondContact O-N 3.42Å; V149-Q153 WeakPolarHBondContact O-CB 3.17Å; V149-Q153 PolarHBondContact O-N 3Å
150L91.6Very high85.3Confident69 Ų6974.4 Ų74.436%0.36139%0.385SS..Hα-helixtrans-62.3-40176.2-76.3169.6000112.2E146 D147 G154 M168 L169E146-L150 WeakPolarHBondContact O-CB 3.25Å; E146-L150 WeakPolarHBondContact O-CG 3.36Å; E146-L150 PolarHBondContact O-N 2.9Å; D147-L150 PolarHBondContact O-N 2.89Å; L150-G154 PolarHBondContact O-N 2.93Å; L150-M168 HydrophobicContact CD2-CE 4.16Å; L150-L169 HydrophobicContact CB-CD1 4.37Å; L150-L169 HydrophobicContact CB-CD2 3.77Å; L150-L169 HydrophobicContact CB-CG 4.06Å; L150-L169 HydrophobicContact CD1-CD2 3.8Å; L150-L169 HydrophobicContact CG-CD2 4.45Å
151F93.3Very high87Confident0 Ų073.9 Ų73.90%038%0.38CS..Hα-helixtrans-66.6-43.8173.1177.2-83.4000112.2W143 D147 V149 Q153 G154 F155 F162 I165 L169 L177 F180 Y181 W184W143-F151 HydrophobicContact CH2-CB 4.19Å; W143-F151 AromaticContact CH2-CD2 3.84Å; W143-F151 HydrophobicContact CH2-CD2 3.84Å; W143-F151 HydrophobicContact CH2-CG 4.22Å; W143-F151 HydrophobicContact CZ3-CB 3.68Å; W143-F151 HydrophobicContact CZ3-CD2 4.18Å; W143-F151 HydrophobicContact CZ3-CG 4.1Å; D147-F151 WeakPolarHBondContact O-CB 3.4Å; D147-F151 PolarHBondContact O-N 3.4Å; V149-F151 PolarHBondContact O-N 3.29Å; F151-Q153 VanDerWaalsContact C-N 3.33Å; F151-Q153 PolarHBondContact O-N 3.4Å; F151-G154 PolarHBondContact O-N 2.82Å; F151-F155 HydrophobicContact CE1-CB 4.33Å; F151-F155 HydrophobicContact CZ-CD2 4.33Å; F151-F155 WeakPolarHBondContact O-CB 3.29Å; F151-F155 PolarHBondContact O-N 3.43Å; F151-F162 HydrophobicContact CE2-CE1 4.18Å; F151-F162 HydrophobicContact CZ-CE1 4.34Å; F151-I165 HydrophobicContact CD2-CG2 3.94Å; F151-I165 HydrophobicContact CE2-CD1 4.3Å; F151-I165 HydrophobicContact CE2-CG2 4.48Å; F151-L169 HydrophobicContact CB-CD1 3.86Å; F151-L177 HydrophobicContact CD2-CD2 4.24Å; F151-L177 HydrophobicContact CE2-CB 4.42Å; F151-F180 HydrophobicContact CB-CD1 4.48Å; F151-F180 HydrophobicContact CB-CE1 4.34Å; F151-F180 AromaticContact CD1-CD1 3.61Å; F151-F180 HydrophobicContact CD1-CD1 3.61Å; F151-F180 AromaticContact CD1-CE1 3.51Å; F151-F180 HydrophobicContact CD1-CE1 3.51Å; F151-F180 HydrophobicContact CD2-CD1 4.03Å; F151-F180 AromaticContact CE1-CD1 3.75Å; F151-F180 HydrophobicContact CE1-CD1 3.75Å; F151-F180 AromaticContact CE1-CE1 3.94Å; F151-F180 HydrophobicContact CE1-CE1 3.94Å; F151-F180 HydrophobicContact CE2-CD1 4.15Å; F151-F180 AromaticContact CG-CD1 3.77Å; F151-F180 HydrophobicContact CG-CD1 3.77Å; F151-F180 AromaticContact CG-CE1 3.91Å; F151-F180 HydrophobicContact CG-CE1 3.91Å; F151-F180 HydrophobicContact CZ-CD1 4.03Å; F151-Y181 HydrophobicContact CZ-CD2 4.31Å; F151-W184 HydrophobicContact CE1-CD2 4.1Å; F151-W184 AromaticContact CE1-CE3 3.95Å; F151-W184 HydrophobicContact CE1-CE3 3.95Å; F151-W184 HydrophobicContact CE1-CH2 4.44Å; F151-W184 HydrophobicContact CE1-CZ3 4.14Å
152E92.4Very high88.7Confident73 Ų7370.5 Ų70.534%0.34136%0.361SS..Hα-helixtrans-63.3-40.5177.9-177.5148.8146.900111.3K148 V149 S156 W184 R188K148-E152 WeakPolarHBondContact O-CB 3.47Å; K148-E152 PolarHBondContact O-N 2.65Å; V149-E152 PolarHBondContact O-N 3.42Å; E152-S156 WeakPolarHBondContact O-CB 3.17Å; E152-S156 PolarHBondContact O-N 3.37Å; E152-W184 HydrophobicContact CB-CZ2 4.26Å; E152-W184 HydrophobicContact CG-CZ2 3.97Å; E152-W184 VanDerWaalsContact OE2-CZ2 3.32Å; E152-W184 WeakPolarHBondContact OE2-CZ2 3.22Å; E152-W184 PolarHBondContact OE2-NE1 3Å; E152-R188 IonicContact OE1-CZ 3.31Å; E152-R188 IonicContact OE1-NE 3.07Å; E152-R188 PolarHBondContact OE1-NE 3.24Å; E152-R188 IonicContact OE1-NH2 2.73Å; E152-R188 PolarHBondContact OE1-NH2 2.91Å; E152-R188 IonicContact OE2-CZ 2.74Å; E152-R188 IonicContact OE2-NE 2.73Å; E152-R188 PolarHBondContact OE2-NE 3.23Å; E152-R188 VanDerWaalsContact OE2-NE 3.09Å; E152-R188 IonicContact OE2-NH2 3.68Å
153Q91.1Very high89.8Confident87 Ų8769.1 Ų69.141%0.40735%0.354SS..Hα-helixtrans-67.2-49.3175.1-167.763.471.200111.9V149 F151 F155 S156 F157 M168V149-Q153 WeakPolarHBondContact O-CB 3.17Å; V149-Q153 PolarHBondContact O-N 3Å; F151-Q153 VanDerWaalsContact C-N 3.33Å; F151-Q153 PolarHBondContact O-N 3.4Å; Q153-F155 PolarHBondContact O-N 3.42Å; Q153-S156 PolarHBondContact NE2-OG 3.25Å; Q153-S156 VanDerWaalsContact NE2-OG 3.11Å; Q153-S156 PolarHBondContact O-N 3.18Å; Q153-S156 VanDerWaalsContact O-N 3.12Å; Q153-S156 PolarHBondContact O-OG 3.4Å; Q153-F157 HydrophobicContact CG-CD2 4.14Å; Q153-F157 HydrophobicContact CG-CE2 3.81Å; Q153-F157 WeakPolarHBondContact O-CD2 3.49Å; Q153-F157 PolarHBondContact O-N 3.49Å; Q153-F157 VanDerWaalsContact O-N 3.15Å; Q153-M168 HydrophobicContact CB-CE 4.44Å; Q153-M168 HydrophobicContact CG-CE 4.4Å
154G92.1Very high90.4Very high0 Ų073.3 Ų73.30%037%0.37CS..Hα-helixtrans-62.3-39.5177.600000112.7L150 F151 S156 F157 H158L150-G154 PolarHBondContact O-N 2.93Å; F151-G154 PolarHBondContact O-N 2.82Å; G154-S156 VanDerWaalsContact C-N 3.34Å; G154-F157 PolarHBondContact O-N 3.17Å; G154-H158 VanDerWaalsContact O-CB 3.29Å; G154-H158 WeakPolarHBondContact O-CB 3.48Å; G154-H158 PolarHBondContact O-N 3.23Å
155F93Very high90.8Very high42 Ų4270.4 Ų70.418%0.18435%0.352CS..Hα-helixtrans-67.1-33.6173.5-170.3-86.1000112F151 Q153 G159 K160 I165 Y181 W184F151-F155 HydrophobicContact CE1-CB 4.33Å; F151-F155 HydrophobicContact CZ-CD2 4.33Å; F151-F155 WeakPolarHBondContact O-CB 3.29Å; F151-F155 PolarHBondContact O-N 3.43Å; Q153-F155 PolarHBondContact O-N 3.42Å; F155-G159 WeakPolarHBondContact CD2-O 3.33Å; F155-G159 WeakPolarHBondContact CE2-O 3.45Å; F155-G159 WeakPolarHBondContact O-CA 3.45Å; F155-G159 PolarHBondContact O-N 3.13Å; F155-K160 HydrophobicContact CE2-CG 4.06Å; F155-K160 HydrophobicContact CZ-CG 4.33Å; F155-I165 HydrophobicContact CB-CD1 4.1Å; F155-I165 HydrophobicContact CD2-CD1 4.05Å; F155-Y181 HydrophobicContact CD2-CD2 4.23Å; F155-Y181 HydrophobicContact CD2-CE2 4.35Å; F155-Y181 AromaticContact CE2-CD2 3.67Å; F155-Y181 HydrophobicContact CE2-CD2 3.67Å; F155-Y181 AromaticContact CE2-CE2 3.41Å; F155-Y181 HydrophobicContact CE2-CE2 3.41Å; F155-Y181 VanDerWaalsContact CE2-CE2 3.41Å; F155-Y181 HydrophobicContact CZ-CD2 4.23Å; F155-Y181 AromaticContact CZ-CE2 3.55Å; F155-Y181 HydrophobicContact CZ-CE2 3.55Å; F155-W184 AromaticContact CD1-CH2 3.74Å; F155-W184 HydrophobicContact CD1-CH2 3.74Å; F155-W184 HydrophobicContact CD1-CZ3 4.08Å; F155-W184 HydrophobicContact CE1-CH2 4.22Å; F155-W184 HydrophobicContact CE1-CZ3 4.23Å; F155-W184 HydrophobicContact CG-CH2 4.14Å; F155-W184 HydrophobicContact CG-CZ3 4.33Å
156S89Confident91.5Very high69 Ų6968.4 Ų68.448%0.48334%0.337SS..Hα-helixtrans-67-37.9176.179.10000113.1E152 Q153 G154E152-S156 WeakPolarHBondContact O-CB 3.17Å; E152-S156 PolarHBondContact O-N 3.37Å; Q153-S156 PolarHBondContact NE2-OG 3.25Å; Q153-S156 VanDerWaalsContact NE2-OG 3.11Å; Q153-S156 PolarHBondContact O-N 3.18Å; Q153-S156 VanDerWaalsContact O-N 3.12Å; Q153-S156 PolarHBondContact O-OG 3.4Å; G154-S156 VanDerWaalsContact C-N 3.34Å
157F88.7Confident91.9Very high143 Ų14368.9 Ų68.963%0.62734%0.339SS*.Hα-helixtrans-85.3-31.1178.4-69.5-52000114.1Q153 G154Q153-F157 HydrophobicContact CG-CD2 4.14Å; Q153-F157 HydrophobicContact CG-CE2 3.81Å; Q153-F157 WeakPolarHBondContact O-CD2 3.49Å; Q153-F157 PolarHBondContact O-N 3.49Å; Q153-F157 VanDerWaalsContact O-N 3.15Å; G154-F157 PolarHBondContact O-N 3.17Å
158H91.8Very high91.8Very high57 Ų5770.8 Ų70.826%0.26435%0.348SS..Hα-helixtrans-124.10.3-167-54.7-44.9000114G154 K160 T161 R164G154-H158 VanDerWaalsContact O-CB 3.29Å; G154-H158 WeakPolarHBondContact O-CB 3.48Å; G154-H158 PolarHBondContact O-N 3.23Å; H158-K160 PolarHBondContact O-N 3.33Å; H158-T161 WeakPolarHBondContact O-CB 3.37Å; H158-T161 PolarHBondContact O-N 2.89Å; H158-T161 VanDerWaalsContact O-N 3.15Å; H158-T161 PolarHBondContact O-OG1 3.49Å; H158-R164 HydrophobicContact CB-CB 4.29Å; H158-R164 HydrophobicContact CB-CG 3.9Å; H158-R164 WeakPolarHBondContact CD2-CG 3.33Å; H158-R164 VanDerWaalsContact CG-CG 3.43Å; H158-R164 PolarHBondContact NE2-NE 3.37Å
159G89.4Confident91.8Very high27 Ų2767 Ų6728%0.27833%0.331SS..THydrogen-bonded Turntrans57.4-133.9176.300000112.4F155 T161 I165F155-G159 WeakPolarHBondContact CD2-O 3.33Å; F155-G159 WeakPolarHBondContact CE2-O 3.45Å; F155-G159 WeakPolarHBondContact O-CA 3.45Å; F155-G159 PolarHBondContact O-N 3.13Å; G159-T161 PolarHBondContact O-N 3.18Å; G159-I165 WeakPolarHBondContact O-CD1 3.32Å
160K91.8Very high91.6Very high140 Ų14066.8 Ų66.861%0.60933%0.332SS*.THydrogen-bonded Turntrans-80.115.3179.1-63.2179.7-178.5174.20114.1F155 H158 F162 Y181F155-K160 HydrophobicContact CE2-CG 4.06Å; F155-K160 HydrophobicContact CZ-CG 4.33Å; H158-K160 PolarHBondContact O-N 3.33Å; K160-F162 HydrophobicContact CB-CE2 4.27Å; K160-F162 WeakPolarHBondContact O-CD2 3.18Å; K160-F162 PolarHBondContact O-N 3.46Å; K160-Y181 WeakPolarHBondContact CE-OH 3.23Å
161T92.8Very high91.3Very high77 Ų7770.3 Ų70.347%0.47235%0.351SS..  trans-81.270.5-178.1-44.30000109.6H158 G159 H163 R164 I165H158-T161 WeakPolarHBondContact O-CB 3.37Å; H158-T161 PolarHBondContact O-N 2.89Å; H158-T161 VanDerWaalsContact O-N 3.15Å; H158-T161 PolarHBondContact O-OG1 3.49Å; G159-T161 PolarHBondContact O-N 3.18Å; T161-H163 VanDerWaalsContact C-N 3.26Å; T161-H163 PolarHBondContact O-N 3.19Å; T161-H163 VanDerWaalsContact O-N 3.17Å; T161-R164 HydrophobicContact CG2-CB 3.79Å; T161-R164 WeakPolarHBondContact O-CA 3.43Å; T161-R164 WeakPolarHBondContact O-CB 3.4Å; T161-R164 PolarHBondContact O-N 3.34Å; T161-I165 PolarHBondContact O-N 2.87Å; T161-I165 VanDerWaalsContact O-N 3.1Å
162F94.7Very high91Very high30 Ų3071.2 Ų71.213%0.13236%0.355CS..Hα-helixtrans-56.6-35.4-170.6-67.4-72.3000113.8F151 K160 R164 I165 Q166 I174 L177 V178 Y181F151-F162 HydrophobicContact CE2-CE1 4.18Å; F151-F162 HydrophobicContact CZ-CE1 4.34Å; K160-F162 HydrophobicContact CB-CE2 4.27Å; K160-F162 WeakPolarHBondContact O-CD2 3.18Å; K160-F162 PolarHBondContact O-N 3.46Å; F162-R164 PolarHBondContact O-N 2.82Å; F162-I165 HydrophobicContact CD1-CD1 4.1Å; F162-I165 HydrophobicContact CE1-CD1 4.44Å; F162-I165 PolarHBondContact O-N 3.3Å; F162-Q166 WeakPolarHBondContact O-CB 3.21Å; F162-Q166 PolarHBondContact O-N 3.42Å; F162-I174 HydrophobicContact CB-CG2 4.19Å; F162-L177 HydrophobicContact CD1-CB 3.93Å; F162-V178 HydrophobicContact CD1-CG2 4.19Å; F162-V178 HydrophobicContact CD2-CG2 3.75Å; F162-V178 HydrophobicContact CE1-CG2 4.25Å; F162-V178 HydrophobicContact CE2-CG2 3.82Å; F162-V178 HydrophobicContact CG-CG2 3.94Å; F162-V178 HydrophobicContact CZ-CG2 4.07Å; F162-Y181 HydrophobicContact CE1-CG 4.26Å; F162-Y181 HydrophobicContact CZ-CD1 4.11Å; F162-Y181 HydrophobicContact CZ-CD2 4.32Å; F162-Y181 AromaticContact CZ-CG 3.81Å; F162-Y181 HydrophobicContact CZ-CG 3.81Å
163H94.5Very high91Very high128 Ų12870.5 Ų70.559%0.59336%0.358SS*.Hα-helixtrans-57.9-32.3172.1-57.7104.5000113.5T161 I174T161-H163 VanDerWaalsContact C-N 3.26Å; T161-H163 PolarHBondContact O-N 3.19Å; T161-H163 VanDerWaalsContact O-N 3.17Å; H163-I174 VanDerWaalsContact CD2-CD1 3.45Å; H163-I174 WeakPolarHBondContact CD2-CD1 3.21Å
164R93.5Very high91Very high120 Ų12069.3 Ų69.345%0.45335%0.354SS..Hα-helixtrans-84.9-30.7177.1-178.758.4175.3-157.4-6.1112.1H158 T161 F162 Q166 Q167H158-R164 HydrophobicContact CB-CB 4.29Å; H158-R164 HydrophobicContact CB-CG 3.9Å; H158-R164 WeakPolarHBondContact CD2-CG 3.33Å; H158-R164 VanDerWaalsContact CG-CG 3.43Å; H158-R164 PolarHBondContact NE2-NE 3.37Å; T161-R164 HydrophobicContact CG2-CB 3.79Å; T161-R164 WeakPolarHBondContact O-CA 3.43Å; T161-R164 WeakPolarHBondContact O-CB 3.4Å; T161-R164 PolarHBondContact O-N 3.34Å; F162-R164 PolarHBondContact O-N 2.82Å; R164-Q166 VanDerWaalsContact C-N 3.31Å; R164-Q167 PolarHBondContact O-N 3.33Å
165I93.1Very high90.9Very high0 Ų072 Ų720%038%0.376CS..Hα-helixtrans-64.3-39.4168.1-58.3177.4000110.2F151 F155 G159 T161 F162 Q167 M168 L169 L177F151-I165 HydrophobicContact CD2-CG2 3.94Å; F151-I165 HydrophobicContact CE2-CD1 4.3Å; F151-I165 HydrophobicContact CE2-CG2 4.48Å; F155-I165 HydrophobicContact CB-CD1 4.1Å; F155-I165 HydrophobicContact CD2-CD1 4.05Å; G159-I165 WeakPolarHBondContact O-CD1 3.32Å; T161-I165 PolarHBondContact O-N 2.87Å; T161-I165 VanDerWaalsContact O-N 3.1Å; F162-I165 HydrophobicContact CD1-CD1 4.1Å; F162-I165 HydrophobicContact CE1-CD1 4.44Å; F162-I165 PolarHBondContact O-N 3.3Å; I165-Q167 PolarHBondContact O-N 2.94Å; I165-M168 WeakPolarHBondContact O-CA 3.41Å; I165-M168 WeakPolarHBondContact O-CB 3.46Å; I165-M168 PolarHBondContact O-N 3.19Å; I165-L169 HydrophobicContact CG2-CD1 4.38Å; I165-L169 PolarHBondContact O-N 2.96Å; I165-L177 HydrophobicContact CB-CD1 4.36Å; I165-L177 HydrophobicContact CG2-CD1 4.34Å; I165-L177 HydrophobicContact CG2-CD2 4.45Å
166Q94.4Very high90.8Very high55 Ų5570.1 Ų70.126%0.25737%0.368SS..Hα-helixtrans-61.2-26.1177-163.4-178.12.500112.8F162 R164 M168 L169 P170 L177F162-Q166 WeakPolarHBondContact O-CB 3.21Å; F162-Q166 PolarHBondContact O-N 3.42Å; R164-Q166 VanDerWaalsContact C-N 3.31Å; Q166-M168 PolarHBondContact O-N 3.25Å; Q166-L169 CarbonylContact O-C 3.03Å; Q166-L169 PolarHBondContact O-N 3.16Å; Q166-P170 WeakPolarHBondContact O-CA 3.27Å; Q166-P170 VanDerWaalsContact O-N 3.07Å; Q166-L177 HydrophobicContact CB-CD1 3.8Å; Q166-L177 HydrophobicContact CG-CD1 4.34Å
167Q93.1Very high91Very high131 Ų13166.9 Ų66.961%0.61235%0.345SS*.THydrogen-bonded Turntrans-67.7-14.8173-66.7173.8-0.900113.1R164 I165R164-Q167 PolarHBondContact O-N 3.33Å; I165-Q167 PolarHBondContact O-N 2.94Å
168M87Confident91.2Very high61 Ų6162.3 Ų62.330%0.333%0.329SS..THydrogen-bonded Turntrans-102.4-8.8170.3-59.1176.561.600113L150 Q153 I165 Q166L150-M168 HydrophobicContact CD2-CE 4.16Å; Q153-M168 HydrophobicContact CB-CE 4.44Å; Q153-M168 HydrophobicContact CG-CE 4.4Å; I165-M168 WeakPolarHBondContact O-CA 3.41Å; I165-M168 WeakPolarHBondContact O-CB 3.46Å; I165-M168 PolarHBondContact O-N 3.19Å; Q166-M168 PolarHBondContact O-N 3.25Å
169L90.1Very high91Very high5 Ų566.2 Ų66.23%0.02634%0.342CS..  trans-143.466.1-176.8-72.9176000109.3W143 D147 L150 F151 I165 Q166 D171 K172 L177W143-L169 HydrophobicContact CH2-CD1 4.15Å; W143-L169 HydrophobicContact CZ3-CD1 4.05Å; D147-L169 HydrophobicContact CB-CD2 4.42Å; L150-L169 HydrophobicContact CB-CD1 4.37Å; L150-L169 HydrophobicContact CB-CD2 3.77Å; L150-L169 HydrophobicContact CB-CG 4.06Å; L150-L169 HydrophobicContact CD1-CD2 3.8Å; L150-L169 HydrophobicContact CG-CD2 4.45Å; F151-L169 HydrophobicContact CB-CD1 3.86Å; I165-L169 HydrophobicContact CG2-CD1 4.38Å; I165-L169 PolarHBondContact O-N 2.96Å; Q166-L169 CarbonylContact O-C 3.03Å; Q166-L169 PolarHBondContact O-N 3.16Å; L169-D171 VanDerWaalsContact C-N 3.26Å; L169-D171 PolarHBondContact O-N 3.39Å; L169-K172 HydrophobicContact CB-CB 4.23Å; L169-K172 HydrophobicContact CB-CG 4.29Å; L169-K172 PolarHBondContact O-N 3.27Å; L169-K172 VanDerWaalsContact O-N 3.17Å; L169-L177 HydrophobicContact CB-CD2 4.36Å; L169-L177 HydrophobicContact CD1-CD2 4Å
170P86.3Confident91.1Very high88 Ų8866.1 Ų66.157%0.57133%0.333SS*.THydrogen-bonded Turntrans-60.3-38.3-171.223.5-33.3000112.1Q166 K172Q166-P170 WeakPolarHBondContact O-CA 3.27Å; Q166-P170 VanDerWaalsContact O-N 3.07Å; P170-K172 VanDerWaalsContact C-N 3.27Å; P170-K172 PolarHBondContact O-N 3.27Å
171D84.4Confident91.1Very high143 Ų14360 Ų6077%0.76531%0.307SS*.THydrogen-bonded Turntrans-74.2-14.5-176.6-45.8-60.6000113.3L169L169-D171 VanDerWaalsContact C-N 3.26Å; L169-D171 PolarHBondContact O-N 3.39Å
172K87.6Confident90.8Very high20 Ų2063.7 Ų63.79%0.08731%0.313CS..SBendtrans-98101.9177.5-54.5-54.3-176.4-176.60109.8P140 E142 W143 D147 L169 P170 L177P140-K172 PolarHBondContact O-NZ 3.12Å; E142-K172 PolarHBondContact O-NZ 3.16Å; W143-K172 HydrophobicContact CZ2-CB 4.39Å; W143-K172 HydrophobicContact CZ2-CG 4.4Å; D147-K172 VanDerWaalsContact OD1-CE 3.31Å; D147-K172 WeakPolarHBondContact OD1-CE 3.38Å; D147-K172 WeakPolarHBondContact OD2-CE 3.49Å; D147-K172 IonicContact OD2-NZ 3.8Å; D147-K172 PolarHBondContact OD2-NZ 2.68Å; L169-K172 HydrophobicContact CB-CB 4.23Å; L169-K172 HydrophobicContact CB-CG 4.29Å; L169-K172 PolarHBondContact O-N 3.27Å; L169-K172 VanDerWaalsContact O-N 3.17Å; P170-K172 VanDerWaalsContact C-N 3.27Å; P170-K172 PolarHBondContact O-N 3.27Å; K172-L177 HydrophobicContact CB-CD2 3.67Å; K172-L177 HydrophobicContact CB-CG 4.4Å; K172-L177 WeakPolarHBondContact O-CG 3.39Å
173S92Very high90.1Very high57 Ų5765.3 Ų65.340%0.39933%0.328SS..  trans-51.6149.8176.467.50000112.9A175 S176 L177S173-A175 PolarHBondContact O-N 3.4Å; S173-S176 WeakPolarHBondContact O-CA 3.46Å; S173-S176 WeakPolarHBondContact O-CB 3.41Å; S173-S176 PolarHBondContact O-N 2.93Å; S173-S176 PolarHBondContact OG-N 3.04Å; S173-L177 PolarHBondContact O-N 3.39Å
174I91.6Very high89.7Confident62 Ų6260.7 Ų60.732%0.31831%0.306SS..Hα-helixtrans-50.1-37.5178.1-56165.9000111.6F162 H163 L177 V178F162-I174 HydrophobicContact CB-CG2 4.19Å; H163-I174 VanDerWaalsContact CD2-CD1 3.45Å; H163-I174 WeakPolarHBondContact CD2-CD1 3.21Å; I174-L177 PolarHBondContact O-N 2.6Å; I174-V178 HydrophobicContact CG2-CG2 4.4Å; I174-V178 WeakPolarHBondContact O-CB 3.47Å; I174-V178 VanDerWaalsContact O-CG2 3.3Å; I174-V178 WeakPolarHBondContact O-CG2 3.35Å; I174-V178 PolarHBondContact O-N 2.9Å
175A90.8Very high89.1Confident56 Ų5660.2 Ų60.246%0.46331%0.307SS..Hα-helixtrans-62.8-43.9175.200000112.4S173 V178 R179S173-A175 PolarHBondContact O-N 3.4Å; A175-V178 PolarHBondContact O-N 3.47Å; A175-R179 VanDerWaalsContact O-CG 3.31Å; A175-R179 WeakPolarHBondContact O-CG 3.48Å; A175-R179 PolarHBondContact O-N 2.56Å
176S90.5Very high87.9Confident4 Ų468.6 Ų68.63%0.02834%0.343CS..Hα-helixtrans-66.3-42.6175-157.40000111.5D141 W143 S173 V178 R179 F180D141-S176 PolarHBondContact OD1-OG 3.44Å; W143-S176 PolarHBondContact NE1-OG 3.08Å; S173-S176 WeakPolarHBondContact O-CA 3.46Å; S173-S176 WeakPolarHBondContact O-CB 3.41Å; S173-S176 PolarHBondContact O-N 2.93Å; S173-S176 PolarHBondContact OG-N 3.04Å; S176-V178 VanDerWaalsContact C-N 3.32Å; S176-V178 PolarHBondContact O-N 2.87Å; S176-R179 PolarHBondContact O-N 3.36Å; S176-F180 WeakPolarHBondContact O-CB 3.44Å; S176-F180 PolarHBondContact O-N 3.05Å
177L92.8Very high86.3Confident0 Ų070.8 Ų70.80%036%0.36CS..Hα-helixtrans-57.3-41.9174.2-57.8-177.6000112.4W143 F151 F162 I165 Q166 L169 K172 S173 I174 Y181W143-L177 HydrophobicContact CH2-CD2 3.65Å; W143-L177 HydrophobicContact CZ2-CD2 4.07Å; F151-L177 HydrophobicContact CD2-CD2 4.24Å; F151-L177 HydrophobicContact CE2-CB 4.42Å; F162-L177 HydrophobicContact CD1-CB 3.93Å; I165-L177 HydrophobicContact CB-CD1 4.36Å; I165-L177 HydrophobicContact CG2-CD1 4.34Å; I165-L177 HydrophobicContact CG2-CD2 4.45Å; Q166-L177 HydrophobicContact CB-CD1 3.8Å; Q166-L177 HydrophobicContact CG-CD1 4.34Å; L169-L177 HydrophobicContact CB-CD2 4.36Å; L169-L177 HydrophobicContact CD1-CD2 4Å; K172-L177 HydrophobicContact CB-CD2 3.67Å; K172-L177 HydrophobicContact CB-CG 4.4Å; K172-L177 WeakPolarHBondContact O-CG 3.39Å; S173-L177 PolarHBondContact O-N 3.39Å; I174-L177 PolarHBondContact O-N 2.6Å; L177-Y181 WeakPolarHBondContact O-CB 3.5Å; L177-Y181 PolarHBondContact O-N 2.88Å
178V93.1Very high84.7Confident47 Ų4767.7 Ų67.729%0.28534%0.343SS..Hα-helixtrans-73-38.8178.2171.20000111.9F162 I174 A175 S176 Y181 Y182F162-V178 HydrophobicContact CD1-CG2 4.19Å; F162-V178 HydrophobicContact CD2-CG2 3.75Å; F162-V178 HydrophobicContact CE1-CG2 4.25Å; F162-V178 HydrophobicContact CE2-CG2 3.82Å; F162-V178 HydrophobicContact CG-CG2 3.94Å; F162-V178 HydrophobicContact CZ-CG2 4.07Å; I174-V178 HydrophobicContact CG2-CG2 4.4Å; I174-V178 WeakPolarHBondContact O-CB 3.47Å; I174-V178 VanDerWaalsContact O-CG2 3.3Å; I174-V178 WeakPolarHBondContact O-CG2 3.35Å; I174-V178 PolarHBondContact O-N 2.9Å; A175-V178 PolarHBondContact O-N 3.47Å; S176-V178 VanDerWaalsContact C-N 3.32Å; S176-V178 PolarHBondContact O-N 2.87Å; V178-Y181 PolarHBondContact O-N 3.49Å; V178-Y182 HydrophobicContact CG1-CD2 4.11Å; V178-Y182 HydrophobicContact CG1-CE2 3.92Å; V178-Y182 VanDerWaalsContact O-CD2 3.27Å; V178-Y182 WeakPolarHBondContact O-CD2 3.48Å; V178-Y182 PolarHBondContact O-N 2.78Å
179R88.1Confident83.1Confident140 Ų14069.7 Ų69.753%0.52836%0.363SS..Hα-helixtrans-58.4-49171.5-74-172.5-56.6-112.116.5110.6D141 A175 S176 Y182 S183D141-R179 IonicContact OD1-NH2 3.9Å; D141-R179 IonicContact OD2-NH2 2.65Å; D141-R179 PolarHBondContact OD2-NH2 3.25Å; A175-R179 VanDerWaalsContact O-CG 3.31Å; A175-R179 WeakPolarHBondContact O-CG 3.48Å; A175-R179 PolarHBondContact O-N 2.56Å; S176-R179 PolarHBondContact O-N 3.36Å; R179-Y182 PolarHBondContact O-N 2.87Å; R179-S183 PolarHBondContact O-N 3.15Å
180F90.1Very high81Confident24 Ų2478.8 Ų78.811%0.10540%0.402CS..Hα-helixtrans-63.5-41.1179.5-173.8-97.4000112.4W143 K148 F151 S176 Y182 S183 W184W143-F180 HydrophobicContact CB-CE2 4.48Å; W143-F180 HydrophobicContact CD2-CB 4.22Å; W143-F180 HydrophobicContact CD2-CD1 4.43Å; W143-F180 AromaticContact CD2-CD2 3.52Å; W143-F180 HydrophobicContact CD2-CD2 3.52Å; W143-F180 AromaticContact CD2-CE2 3.99Å; W143-F180 HydrophobicContact CD2-CE2 3.99Å; W143-F180 AromaticContact CD2-CG 3.79Å; W143-F180 HydrophobicContact CD2-CG 3.79Å; W143-F180 AromaticContact CE2-CD2 3.79Å; W143-F180 AromaticContact CE2-CG 3.71Å; W143-F180 HydrophobicContact CE3-CD1 4.04Å; W143-F180 AromaticContact CE3-CD2 3.8Å; W143-F180 HydrophobicContact CE3-CD2 3.8Å; W143-F180 HydrophobicContact CE3-CE1 4.19Å; W143-F180 AromaticContact CE3-CE2 3.96Å; W143-F180 HydrophobicContact CE3-CE2 3.96Å; W143-F180 AromaticContact CE3-CG 3.86Å; W143-F180 HydrophobicContact CE3-CG 3.86Å; W143-F180 HydrophobicContact CE3-CZ 4.16Å; W143-F180 AromaticContact CG-CD2 3.86Å; W143-F180 HydrophobicContact CG-CD2 3.86Å; W143-F180 HydrophobicContact CG-CE2 4.22Å; W143-F180 HydrophobicContact CH2-CB 3.84Å; W143-F180 AromaticContact CH2-CD1 3.85Å; W143-F180 HydrophobicContact CH2-CD1 3.85Å; W143-F180 AromaticContact CH2-CG 3.8Å; W143-F180 HydrophobicContact CH2-CG 3.8Å; W143-F180 HydrophobicContact CZ2-CB 3.4Å; W143-F180 HydrophobicContact CZ2-CD1 4.26Å; W143-F180 HydrophobicContact CZ2-CD2 4.29Å; W143-F180 AromaticContact CZ2-CG 3.73Å; W143-F180 HydrophobicContact CZ2-CG 3.73Å; W143-F180 HydrophobicContact CZ3-CB 4.42Å; W143-F180 AromaticContact CZ3-CD1 3.75Å; W143-F180 HydrophobicContact CZ3-CD1 3.75Å; W143-F180 HydrophobicContact CZ3-CD2 4.3Å; W143-F180 HydrophobicContact CZ3-CE1 4.1Å; W143-F180 AromaticContact CZ3-CG 3.88Å; W143-F180 HydrophobicContact CZ3-CG 3.88Å; K148-F180 HydrophobicContact CB-CZ 4.26Å; K148-F180 HydrophobicContact CG-CE2 4.02Å; K148-F180 HydrophobicContact CG-CZ 3.75Å; F151-F180 HydrophobicContact CB-CD1 4.48Å; F151-F180 HydrophobicContact CB-CE1 4.34Å; F151-F180 AromaticContact CD1-CD1 3.61Å; F151-F180 HydrophobicContact CD1-CD1 3.61Å; F151-F180 AromaticContact CD1-CE1 3.51Å; F151-F180 HydrophobicContact CD1-CE1 3.51Å; F151-F180 HydrophobicContact CD2-CD1 4.03Å; F151-F180 AromaticContact CE1-CD1 3.75Å; F151-F180 HydrophobicContact CE1-CD1 3.75Å; F151-F180 AromaticContact CE1-CE1 3.94Å; F151-F180 HydrophobicContact CE1-CE1 3.94Å; F151-F180 HydrophobicContact CE2-CD1 4.15Å; F151-F180 AromaticContact CG-CD1 3.77Å; F151-F180 HydrophobicContact CG-CD1 3.77Å; F151-F180 AromaticContact CG-CE1 3.91Å; F151-F180 HydrophobicContact CG-CE1 3.91Å; F151-F180 HydrophobicContact CZ-CD1 4.03Å; S176-F180 WeakPolarHBondContact O-CB 3.44Å; S176-F180 PolarHBondContact O-N 3.05Å; F180-Y182 VanDerWaalsContact C-N 3.28Å; F180-Y182 PolarHBondContact O-N 3.44Å; F180-S183 PolarHBondContact O-N 2.72Å; F180-S183 PolarHBondContact O-OG 3.15Å; F180-W184 HydrophobicContact CD1-CB 4.16Å; F180-W184 HydrophobicContact CE1-CB 3.74Å; F180-W184 AromaticContact CE1-CD1 3.92Å; F180-W184 AromaticContact CE1-CG 3.88Å; F180-W184 HydrophobicContact CE1-CG 3.88Å; F180-W184 HydrophobicContact CZ-CB 3.96Å; F180-W184 HydrophobicContact CZ-CG 4.22Å; F180-W184 VanDerWaalsContact O-CB 3.25Å; F180-W184 WeakPolarHBondContact O-CB 3.43Å; F180-W184 PolarHBondContact O-N 3.18Å
181Y91.7Very high79.3Confident13 Ų1380.4 Ų80.45%0.05141%0.411CS..Hα-helixtrans-51.8-45.6174.2174.1-110.2000112.6F151 F155 K160 F162 L177 V178 W184 K185F151-Y181 HydrophobicContact CZ-CD2 4.31Å; F155-Y181 HydrophobicContact CD2-CD2 4.23Å; F155-Y181 HydrophobicContact CD2-CE2 4.35Å; F155-Y181 AromaticContact CE2-CD2 3.67Å; F155-Y181 HydrophobicContact CE2-CD2 3.67Å; F155-Y181 AromaticContact CE2-CE2 3.41Å; F155-Y181 HydrophobicContact CE2-CE2 3.41Å; F155-Y181 VanDerWaalsContact CE2-CE2 3.41Å; F155-Y181 HydrophobicContact CZ-CD2 4.23Å; F155-Y181 AromaticContact CZ-CE2 3.55Å; F155-Y181 HydrophobicContact CZ-CE2 3.55Å; K160-Y181 WeakPolarHBondContact CE-OH 3.23Å; F162-Y181 HydrophobicContact CE1-CG 4.26Å; F162-Y181 HydrophobicContact CZ-CD1 4.11Å; F162-Y181 HydrophobicContact CZ-CD2 4.32Å; F162-Y181 AromaticContact CZ-CG 3.81Å; F162-Y181 HydrophobicContact CZ-CG 3.81Å; L177-Y181 WeakPolarHBondContact O-CB 3.5Å; L177-Y181 PolarHBondContact O-N 2.88Å; V178-Y181 PolarHBondContact O-N 3.49Å; Y181-W184 HydrophobicContact CD2-CE3 4.36Å; Y181-W184 HydrophobicContact CD2-CZ3 4.31Å; Y181-W184 HydrophobicContact CE2-CZ3 4.4Å; Y181-K185 HydrophobicContact CE1-CD 4.21Å; Y181-K185 HydrophobicContact CE2-CB 4.4Å; Y181-K185 HydrophobicContact CE2-CD 4.45Å; Y181-K185 WeakPolarHBondContact O-CB 3.34Å; Y181-K185 PolarHBondContact O-N 2.86Å
182Y87.6Confident77.5Confident153 Ų15375.5 Ų75.560%0.639%0.388SS*.Hα-helixtrans-75.6-27.9-176.5-76.9-67.4000114V178 R179 F180V178-Y182 HydrophobicContact CG1-CD2 4.11Å; V178-Y182 HydrophobicContact CG1-CE2 3.92Å; V178-Y182 VanDerWaalsContact O-CD2 3.27Å; V178-Y182 WeakPolarHBondContact O-CD2 3.48Å; V178-Y182 PolarHBondContact O-N 2.78Å; R179-Y182 PolarHBondContact O-N 2.87Å; F180-Y182 VanDerWaalsContact C-N 3.28Å; F180-Y182 PolarHBondContact O-N 3.44Å
183S80.4Confident75.7Confident65 Ų6579.4 Ų79.446%0.45541%0.413SS..Hα-helixtrans-76-50.1171.758.50000111.7R179 F180 K185 K186R179-S183 PolarHBondContact O-N 3.15Å; F180-S183 PolarHBondContact O-N 2.72Å; F180-S183 PolarHBondContact O-OG 3.15Å; S183-K185 PolarHBondContact O-N 3.18Å; S183-K186 WeakPolarHBondContact O-CB 3.44Å; S183-K186 PolarHBondContact O-N 3.27Å; S183-K186 VanDerWaalsContact O-N 3.15Å
184W85.3Confident73.5Confident31 Ų3182.1 Ų82.112%0.11742%0.421CS..Hα-helixtrans-61.8-42.3179.2170.292.3000113F151 E152 F155 F180 Y181 K186 T187 R188F151-W184 HydrophobicContact CE1-CD2 4.1Å; F151-W184 AromaticContact CE1-CE3 3.95Å; F151-W184 HydrophobicContact CE1-CE3 3.95Å; F151-W184 HydrophobicContact CE1-CH2 4.44Å; F151-W184 HydrophobicContact CE1-CZ3 4.14Å; E152-W184 HydrophobicContact CB-CZ2 4.26Å; E152-W184 HydrophobicContact CG-CZ2 3.97Å; E152-W184 VanDerWaalsContact OE2-CZ2 3.32Å; E152-W184 WeakPolarHBondContact OE2-CZ2 3.22Å; E152-W184 PolarHBondContact OE2-NE1 3Å; F155-W184 AromaticContact CD1-CH2 3.74Å; F155-W184 HydrophobicContact CD1-CH2 3.74Å; F155-W184 HydrophobicContact CD1-CZ3 4.08Å; F155-W184 HydrophobicContact CE1-CH2 4.22Å; F155-W184 HydrophobicContact CE1-CZ3 4.23Å; F155-W184 HydrophobicContact CG-CH2 4.14Å; F155-W184 HydrophobicContact CG-CZ3 4.33Å; F180-W184 HydrophobicContact CD1-CB 4.16Å; F180-W184 HydrophobicContact CE1-CB 3.74Å; F180-W184 AromaticContact CE1-CD1 3.92Å; F180-W184 AromaticContact CE1-CG 3.88Å; F180-W184 HydrophobicContact CE1-CG 3.88Å; F180-W184 HydrophobicContact CZ-CB 3.96Å; F180-W184 HydrophobicContact CZ-CG 4.22Å; F180-W184 VanDerWaalsContact O-CB 3.25Å; F180-W184 WeakPolarHBondContact O-CB 3.43Å; F180-W184 PolarHBondContact O-N 3.18Å; Y181-W184 HydrophobicContact CD2-CE3 4.36Å; Y181-W184 HydrophobicContact CD2-CZ3 4.31Å; Y181-W184 HydrophobicContact CE2-CZ3 4.4Å; W184-K186 PolarHBondContact O-N 2.83Å; W184-T187 PolarHBondContact O-N 3.46Å; W184-T187 PolarHBondContact O-OG1 2.92Å; W184-T187 VanDerWaalsContact O-OG1 3.05Å; W184-R188 WeakPolarHBondContact O-CB 3.39Å; W184-R188 PolarHBondContact O-N 3.17Å
185K80.8Confident71.8Confident110 Ų11083.6 Ų83.648%0.47843%0.43SS..Hα-helixtrans-61.3-32.6176-173-159.8179.8-171.90112.1Y181 S183 T187Y181-K185 HydrophobicContact CE1-CD 4.21Å; Y181-K185 HydrophobicContact CE2-CB 4.4Å; Y181-K185 HydrophobicContact CE2-CD 4.45Å; Y181-K185 WeakPolarHBondContact O-CB 3.34Å; Y181-K185 PolarHBondContact O-N 2.86Å; S183-K185 PolarHBondContact O-N 3.18Å; K185-T187 VanDerWaalsContact C-N 3.29Å; K185-T187 PolarHBondContact O-N 3.1Å
186K68.5Low70.1Confident175 Ų17590.8 Ų90.876%0.76145%0.445SS*.Hα-helixtrans-71.5-22.7-177.3-166.6177.1179.2-176.40112.6S183 W184S183-K186 WeakPolarHBondContact O-CB 3.44Å; S183-K186 PolarHBondContact O-N 3.27Å; S183-K186 VanDerWaalsContact O-N 3.15Å; W184-K186 PolarHBondContact O-N 2.83Å
187T59.8Low68.5Low101 Ų10196.3 Ų96.362%0.6247%0.47SS*.Hα-helixtrans-100.4-3417850.70000113.6W184 K185 S189W184-T187 PolarHBondContact O-N 3.46Å; W184-T187 PolarHBondContact O-OG1 2.92Å; W184-T187 VanDerWaalsContact O-OG1 3.05Å; K185-T187 VanDerWaalsContact C-N 3.29Å; K185-T187 PolarHBondContact O-N 3.1Å; T187-S189 VanDerWaalsContact C-N 3.27Å; T187-S189 PolarHBondContact O-N 3.21Å
188R61.1Low66.9Low67 Ų6799.2 Ų99.225%0.25349%0.494SS..Hα-helixtrans-68.7-17.3-173.5-158.7168.6-171.2-110.8-0.3114.9E152 W184 K190E152-R188 IonicContact OE1-CZ 3.31Å; E152-R188 IonicContact OE1-NE 3.07Å; E152-R188 PolarHBondContact OE1-NE 3.24Å; E152-R188 IonicContact OE1-NH2 2.73Å; E152-R188 PolarHBondContact OE1-NH2 2.91Å; E152-R188 IonicContact OE2-CZ 2.74Å; E152-R188 IonicContact OE2-NE 2.73Å; E152-R188 PolarHBondContact OE2-NE 3.23Å; E152-R188 VanDerWaalsContact OE2-NE 3.09Å; E152-R188 IonicContact OE2-NH2 3.68Å; W184-R188 WeakPolarHBondContact O-CB 3.39Å; W184-R188 PolarHBondContact O-N 3.17Å; R188-K190 PolarHBondContact O-N 3.05Å; R188-K190 VanDerWaalsContact O-N 3.08Å
189S53.2Low65.4Low103 Ų103105.7 Ų105.772%0.7251%0.513SS*.THydrogen-bonded Turntrans-74.19.2-17455.60000116.1T187T187-S189 VanDerWaalsContact C-N 3.27Å; T187-S189 PolarHBondContact O-N 3.21Å
190K45.8Very low63.9Low195 Ų195104.6 Ų104.685%0.84851%0.512SS*.THydrogen-bonded Turntrans-116.5-6.2-178.5-121.4-177.7-178.5-175.80116R188R188-K190 PolarHBondContact O-N 3.05Å; R188-K190 VanDerWaalsContact O-N 3.08Å
191T50.9Low62.2Low123 Ų123110.4 Ų110.476%0.75554%0.54SS*.THydrogen-bonded Turntrans-143.3-11.6-167.744.30000117.7
192S45.7Very low60.7Low40 Ų40115.7 Ų115.728%0.2856%0.563SS.*  trans-83.6123-171.2-1690000115.1M194S192-M194 VanDerWaalsContact C-N 3.26Å; S192-M194 PolarHBondContact O-N 3.33Å; S192-M194 PolarHBondContact OG-N 3.35Å
193V49.6Very low59.2Low102 Ų102117.3 Ų117.362%0.61857%0.568SS**THydrogen-bonded Turntrans-67.8-24.3170.2179.10000112D195 R196V193-D195 VanDerWaalsContact C-N 3.31Å; V193-D195 PolarHBondContact O-N 3.17Å; V193-R196 WeakPolarHBondContact O-CB 3.4Å; V193-R196 PolarHBondContact O-N 3.49Å
194M46.9Very low58Low113 Ų113118.5 Ų118.556%0.55757%0.566SS**Hα-helixtrans-64.9-32.1-174.4-58.5175.678.100112.9S192 R196 H197 A198S192-M194 VanDerWaalsContact C-N 3.26Å; S192-M194 PolarHBondContact O-N 3.33Å; S192-M194 PolarHBondContact OG-N 3.35Å; M194-R196 PolarHBondContact O-N 3.35Å; M194-R196 VanDerWaalsContact O-N 3.14Å; M194-H197 PolarHBondContact O-N 3.1Å; M194-A198 PolarHBondContact O-N 3.5Å
195D55.2Low56.6Low94 Ų94125.3 Ų125.350%0.50359%0.592SS.*Hα-helixtrans-59.5-23.6173.9-105.423.8000112.4V193 R199V193-D195 VanDerWaalsContact C-N 3.31Å; V193-D195 PolarHBondContact O-N 3.17Å; D195-R199 VanDerWaalsContact O-CG 3.25Å; D195-R199 WeakPolarHBondContact O-CG 3.11Å; D195-R199 PolarHBondContact O-N 3.3Å
196R54.9Low55.2Low206 Ų206124.7 Ų124.778%0.77759%0.591SS**Hα-helixtrans-74.2-37.1174.2-147.5179-163.2-1665.4111.7V193 M194 K200V193-R196 WeakPolarHBondContact O-CB 3.4Å; V193-R196 PolarHBondContact O-N 3.49Å; M194-R196 PolarHBondContact O-N 3.35Å; M194-R196 VanDerWaalsContact O-N 3.14Å; R196-K200 PolarHBondContact O-N 3.24Å; R196-K200 VanDerWaalsContact O-N 3.1Å
197H58.1Low54.1Low121 Ų121121.9 Ų121.956%0.5658%0.58SS**Hα-helixtrans-76.4-39.8177.6-72.9-98.1000112.3M194 R199 K200 Q201M194-H197 PolarHBondContact O-N 3.1Å; H197-R199 VanDerWaalsContact C-N 3.25Å; H197-R199 PolarHBondContact O-N 3.47Å; H197-K200 WeakPolarHBondContact O-CA 3.47Å; H197-K200 WeakPolarHBondContact O-CB 3.15Å; H197-K200 PolarHBondContact O-N 2.86Å; H197-Q201 PolarHBondContact O-N 2.55Å
198A58.2Low53.6Low60 Ų60120.9 Ų120.950%0.49658%0.578SS.*Hα-helixtrans-59.6-36.8173.400000112.1M194 K202M194-A198 PolarHBondContact O-N 3.5Å; A198-K202 PolarHBondContact O-N 3.39Å
199R61.2Low52.8Low184 Ų184123.8 Ų123.869%0.69459%0.594SS**Hα-helixtrans-71.9-31.1171.4-68.9175.4-163.2-149.36.5113.1D195 H197 R203D195-R199 VanDerWaalsContact O-CG 3.25Å; D195-R199 WeakPolarHBondContact O-CG 3.11Å; D195-R199 PolarHBondContact O-N 3.3Å; H197-R199 VanDerWaalsContact C-N 3.25Å; H197-R199 PolarHBondContact O-N 3.47Å; R199-R203 WeakPolarHBondContact O-CB 3.49Å; R199-R203 PolarHBondContact O-N 3.42Å; R199-R203 VanDerWaalsContact O-N 3.12Å
200K56.2Low52.2Low117 Ų117125.9 Ų125.951%0.50960%0.597SS.*Hα-helixtrans-67.3-51.8177.2-165.7175.4-174.6-84.50111.3R196 H197 K202 R203 E204R196-K200 PolarHBondContact O-N 3.24Å; R196-K200 VanDerWaalsContact O-N 3.1Å; H197-K200 WeakPolarHBondContact O-CA 3.47Å; H197-K200 WeakPolarHBondContact O-CB 3.15Å; H197-K200 PolarHBondContact O-N 2.86Å; K200-K202 VanDerWaalsContact C-N 3.3Å; K200-K202 PolarHBondContact O-N 3.34Å; K200-R203 WeakPolarHBondContact O-CA 3.38Å; K200-R203 WeakPolarHBondContact O-CB 3.48Å; K200-R203 PolarHBondContact O-N 3.17Å; K200-E204 HydrophobicContact CG-CG 4.45Å; K200-E204 IonicContact NZ-OE1 3.33Å; K200-E204 PolarHBondContact NZ-OE1 3.1Å; K200-E204 WeakPolarHBondContact O-CG 3.3Å; K200-E204 PolarHBondContact O-N 2.77Å
201Q55.5Low52Low146 Ų146124.4 Ų124.468%0.68259%0.593SS**Hα-helixtrans-58.5-39176.3-85.1-172.9-19.700113H197 R203 E204 R205H197-Q201 PolarHBondContact O-N 2.55Å; Q201-R203 VanDerWaalsContact C-N 3.33Å; Q201-R203 PolarHBondContact O-N 2.92Å; Q201-E204 PolarHBondContact O-N 3.42Å; Q201-R205 PolarHBondContact O-N 2.85Å; Q201-R205 VanDerWaalsContact O-N 3.08Å
202K59.6Low51.7Low124 Ų124122.4 Ų122.454%0.53959%0.589SS.*Hα-helixtrans-62.4-42.2174.9-174173.8177.9-70.50111.5A198 K200 R205 E206A198-K202 PolarHBondContact O-N 3.39Å; K200-K202 VanDerWaalsContact C-N 3.3Å; K200-K202 PolarHBondContact O-N 3.34Å; K202-R205 PolarHBondContact O-N 3.21Å; K202-E206 IonicContact NZ-OE1 3.31Å; K202-E206 PolarHBondContact NZ-OE1 3.38Å; K202-E206 IonicContact NZ-OE2 2.95Å; K202-E206 PolarHBondContact NZ-OE2 3.24Å; K202-E206 WeakPolarHBondContact O-CG 3.36Å; K202-E206 PolarHBondContact O-N 2.89Å
203R57.3Low51.5Low187 Ų187129.5 Ų129.571%0.70662%0.618SS**Hα-helixtrans-69.9-37179.4-152178.2-166.3-160.50.4112.7R199 K200 Q201 R205 E206 Q207R199-R203 WeakPolarHBondContact O-CB 3.49Å; R199-R203 PolarHBondContact O-N 3.42Å; R199-R203 VanDerWaalsContact O-N 3.12Å; K200-R203 WeakPolarHBondContact O-CA 3.38Å; K200-R203 WeakPolarHBondContact O-CB 3.48Å; K200-R203 PolarHBondContact O-N 3.17Å; Q201-R203 VanDerWaalsContact C-N 3.33Å; Q201-R203 PolarHBondContact O-N 2.92Å; R203-R205 VanDerWaalsContact C-N 3.34Å; R203-E206 PolarHBondContact O-N 3.21Å; R203-Q207 VanDerWaalsContact O-CB 3.25Å; R203-Q207 WeakPolarHBondContact O-CB 3.46Å; R203-Q207 PolarHBondContact O-N 2.98Å
204E54.3Low50.7Low89 Ų89133.4 Ų133.442%0.41663%0.629SS.*Hα-helixtrans-65.4-36.8175.5-72165.6150.300111.8K200 Q201 S208K200-E204 HydrophobicContact CG-CG 4.45Å; K200-E204 IonicContact NZ-OE1 3.33Å; K200-E204 PolarHBondContact NZ-OE1 3.1Å; K200-E204 WeakPolarHBondContact O-CG 3.3Å; K200-E204 PolarHBondContact O-N 2.77Å; Q201-E204 PolarHBondContact O-N 3.42Å; E204-S208 PolarHBondContact O-N 3.28Å; E204-S208 PolarHBondContact O-OG 3.42Å
205R55.8Low50Low175 Ų175135.4 Ų135.466%0.6665%0.648SS**Hα-helixtrans-71.1-39.6173.6-175.7174.8177.2163.94.2113.2Q201 K202 R203 Q207 S208Q201-R205 PolarHBondContact O-N 2.85Å; Q201-R205 VanDerWaalsContact O-N 3.08Å; K202-R205 PolarHBondContact O-N 3.21Å; R203-R205 VanDerWaalsContact C-N 3.34Å; R205-Q207 VanDerWaalsContact C-N 3.32Å; R205-S208 PolarHBondContact O-N 3.08Å; R205-S208 PolarHBondContact O-OG 3.43Å
206E52.3Low48.8Very low97 Ų97138.7 Ų138.745%0.45367%0.666SS.*Hα-helixtrans-67.4-35.6175.4-71.6174.1141.400111.1K202 R203 S208 E209K202-E206 IonicContact NZ-OE1 3.31Å; K202-E206 PolarHBondContact NZ-OE1 3.38Å; K202-E206 IonicContact NZ-OE2 2.95Å; K202-E206 PolarHBondContact NZ-OE2 3.24Å; K202-E206 WeakPolarHBondContact O-CG 3.36Å; K202-E206 PolarHBondContact O-N 2.89Å; R203-E206 PolarHBondContact O-N 3.21Å; E206-S208 PolarHBondContact O-N 3.49Å; E206-E209 PolarHBondContact O-N 2.96Å
207Q45.1Very low47.6Very low115 Ų115132 Ų13254%0.53766%0.661SS.*Hα-helixtrans-72.9-24.4178.1-169.2166-0.300113.6R203 R205 E209R203-Q207 VanDerWaalsContact O-CB 3.25Å; R203-Q207 WeakPolarHBondContact O-CB 3.46Å; R203-Q207 PolarHBondContact O-N 2.98Å; R205-Q207 VanDerWaalsContact C-N 3.32Å; Q207-E209 VanDerWaalsContact C-N 3.3Å
208S48.4Very low46.1Very low81 Ų81134.2 Ų134.257%0.56668%0.677SS**Hα-helixtrans-78.1-8.5173.555.40000114.9E204 R205 E206E204-S208 PolarHBondContact O-N 3.28Å; E204-S208 PolarHBondContact O-OG 3.42Å; R205-S208 PolarHBondContact O-N 3.08Å; R205-S208 PolarHBondContact O-OG 3.43Å; E206-S208 PolarHBondContact O-N 3.49Å
209E45.5Very low44.9Very low128 Ų128134.9 Ų134.960%0.59868%0.682SS**Hα-helixtrans-96.9-20.5178.3-69.6174.1-179.900112.1E206 Q207E206-E209 PolarHBondContact O-N 2.96Å; Q207-E209 VanDerWaalsContact C-N 3.3Å
210D39.3Very low43.8Very low147 Ų147131.7 Ų131.779%0.78669%0.686SS**Hα-helixtrans-84.8-21.3178.3-83.7-25.7000114.5A212D210-A212 PolarHBondContact O-N 3.26Å
211E42.3Very low42.5Very low164 Ų164131.5 Ų131.577%0.76670%0.699SS**SBendtrans-89.49.4-176.6-70-172.9174.500114.4
212A43.6Very low41.3Very low81 Ų81131.4 Ų131.467%0.66970%0.703SS**SBendtrans-103.8-10.4-171.400000116.2D210D210-A212 PolarHBondContact O-N 3.26Å
213E42.1Very low40.1Very low189 Ų189132.2 Ų132.288%0.88372%0.718SS**SBendtrans-116.756-176.9-71.6-158.6156.300114.5
214E33.8Very low39Very low184 Ų184132 Ų13286%0.8673%0.725SS**  trans-160.190.4154.7-126.5177.6-143.100115.2
215T31.9Very low37.9Very low154 Ų154137.6 Ų137.695%0.94574%0.744SS**  trans171.4162.9132.431.70000111.3
216N30Very low36.9Very low163 Ų163135.8 Ų135.887%0.87275%0.747SS**  trans-127.7129.3-150.1-177.325.9000115.3
217G28.2Very low36.2Very low66 Ų66135.4 Ų135.468%0.6875%0.753SS**  trans72.6116.8138.200000120.4
218N27.1Very low35.4Very low168 Ų168136.6 Ų136.690%0.89876%0.763SS**  -158161.5114.5-154.422.8000112.5
219A32.8Very low34.6Very low73 Ų73140.8 Ų140.860%0.60377%0.771SS**  trans-124.1178.817200000108.4
220P39.6Very low33.8Very low118 Ų118141 Ų14177%0.76677%0.772SS**  cis-142.8-149.617.945-23.3000114.8
221S28.7Very low33.4Very low112 Ų112140.7 Ų140.778%0.78377%0.766SS**  trans71.7120.1-176.263.10000115.3
222D30.1Very low33Very low145 Ų145139.8 Ų139.878%0.77576%0.76SS**  cis96.594.428.1-172.131.2000113.8
223V34.4Very low32.2Very low141 Ų141144.6 Ų144.686%0.85577%0.765SS**  trans-153.8126.4156.5-159.80000108.8
224E34.4Very low31.5Very low181 Ų181141.7 Ų141.785%0.84675%0.752SS**  trans-85.4136.4165.9-66.4-175.3123.600111.2
225Y30Very low31.1Very low208 Ų208140.8 Ų140.882%0.81675%0.752SS**  trans-162.4132.4150.5-156.6-126000113.5P227Y225-P227 HydrophobicContact CD1-CG 4.26Å; Y225-P227 HydrophobicContact CE1-CG 3.54Å
226D34.6Very low30.9Very low136 Ų136137.2 Ų137.273%0.72775%0.746SS**  trans-138.6127.4166.4173.45.4000108.1N228D226-N228 PolarHBondContact OD1-N 3.3Å
227P39.4Very low30.5Very low90 Ų90134.5 Ų134.558%0.58475%0.746SS**  trans-138.2106.2145.336.3-21.8000113.7Y225 K229Y225-P227 HydrophobicContact CD1-CG 4.26Å; Y225-P227 HydrophobicContact CE1-CG 3.54Å; P227-K229 PolarHBondContact O-N 2.88Å
228N28Very low30.6Very low139 Ų139136.1 Ų136.174%0.74375%0.753SS**  trans-49.2122.2159.2169.334.7000114.7D226D226-N228 PolarHBondContact OD1-N 3.3Å
229K31.1Very low30.9Very low170 Ų170133.8 Ų133.874%0.73975%0.747SS**  trans-159.9118.9146-142156.1-174.6172.60111P227P227-K229 PolarHBondContact O-N 2.88Å
230E29.1Very low30.6Very low132 Ų132139 Ų13962%0.61776%0.759SS**  54.812889.6-105178.7176.200112.8
231E31.6Very low30.1Very low140 Ų140143 Ų14365%0.65476%0.764SS**  cis-148.2170.624.6-66.8-161.1171.600110.7
232K32.1Very low30.1Very low146 Ų146146.5 Ų146.564%0.63577%0.768SS**  cis-170.3177.4-16.9-101.5174.5-160.5147.50107.4
233K28.6Very low29.9Very low182 Ų182148.7 Ų148.779%0.79177%0.774SS**  trans70.2142.6161.4-80.4-165.5167.5-136.70118
234E26.5Very low29.9Very low128 Ų128147.9 Ų147.960%0.59877%0.771SS**  cis-130.9142.5-8.8-71.1-141.9157.200109.3
235L26.1Very low29.6Very low164 Ų164148.6 Ų148.686%0.85977%0.772SS**  41.7129.994.7-49174.4000115.1
236G26.2Very low29.7Very low80 Ų80144.8 Ų144.883%0.82577%0.773SS**  cis-173.4171.7-200000112.5
237A23.1Very low29.3Very low106 Ų106146.5 Ų146.588%0.87678%0.781SS**  trans-130.5123.1-175.300000112.5
238A29.2Very low28.9Very low99 Ų99146.9 Ų146.982%0.81879%0.792SS**  trans-177.3167.5167.900000109
239P34.1Very low29Very low120 Ų120146.4 Ų146.478%0.77979%0.793SS**  cis-121.5156.4-9.333.2-17.2000114.2
240E25.5Very low28.9Very low182 Ų182144.9 Ų144.985%0.8580%0.798SS**  trans-90.1143160.8-171.6170-153.600109.2
241K30.2Very low29Very low202 Ų202147 Ų14788%0.87881%0.808SS**  trans-96.2141.2179.6-74-172.2176.7-175.50111.6
242Q27.2Very low28.9Very low185 Ų185149.7 Ų149.786%0.86482%0.817SS**  trans-127144.5165.6-64.3-174.6500109.9
243E27.9Very low28.7Very low192 Ų192148.9 Ų148.990%0.89783%0.827SS**  trans-102.2146.4174.4-68-177.1119.500111.2
244P32.9Very low28.7Very low123 Ų123146.4 Ų146.480%0.79983%0.828SS**  trans-82.5162.2178.434.4-35.8000113.2
245K28.5Very low28.9Very low196 Ų196147.7 Ų147.785%0.85284%0.844SS**  trans-128.8149.2162.4-78.6-173.1177179.50110.4
246P31.7Very low29Very low129 Ų129143.3 Ų143.384%0.83884%0.839SS**  trans-77155.9-168.130.6-36.6000113.9
247L26.7Very low29.2Very low172 Ų172146.6 Ų146.690%0.90184%0.842SS**  trans-88.4141.2169.4-74.3158.2000110.5
248A30.1Very low29.7Very low98 Ų98146.1 Ų146.181%0.8184%0.839SS**  trans-141.5124.8163.900000108.9
249V30.1Very low29.8Very low129 Ų129150.7 Ų150.778%0.78284%0.843SS**  trans-98.9122.7-177.7175.50000109.5
250V29.8Very low29.7Very low138 Ų138153.9 Ų153.984%0.83685%0.845SS**  trans-135.5126.3164.6179.70000108.3
251Q30.6Very low29.8Very low176 Ų176153.9 Ų153.982%0.82285%0.85SS**  trans-77.9148.1-179-60.6174.14.700110.9
252K29.4Very low29.8Very low196 Ų196149.3 Ų149.385%0.85284%0.839SS**  trans-106.3133.2168.4-75.3-175175.6-177.40110
253P29.4Very low30Very low130 Ų130148 Ų14884%0.84483%0.832SS**  trans-68.6154.6158.531.1-33000110.5
254T28Very low30.2Very low130 Ų130145 Ų14580%0.79883%0.827SS**  trans-96.9130.4-168.550.20000113.9
255T30Very low30.1Very low154 Ų154146 Ų14695%0.94582%0.819SS**  trans-178.7151.1145.517.10000108.5
256G27.9Very low30.5Very low72 Ų72146.3 Ų146.374%0.74282%0.82SS**  cis176.911.3-1.400000116.6
257V31.2Very low30.5Very low149 Ų149146.7 Ų146.790%0.90381%0.811SS**  trans-136.2139.5176.3-174.30000109.2
258A33.3Very low31.1Very low97 Ų97144.2 Ų144.280%0.80281%0.805SS**  trans-124121-175.400000111.9
259E30.5Very low31.5Very low194 Ų194148.9 Ų148.991%0.90781%0.81SS**  trans-118.3148.9159.7-74.4-152.1120.400110.8L261E259-L261 PolarHBondContact O-N 3.47Å
260K33.1Very low31.9Very low188 Ų188145.8 Ų145.882%0.81780%0.804SS**  trans-10581.6-151.3-167.4-177.2-175.7179.80112.3T262K260-T262 HydrophobicContact CD-CG2 4.49Å; K260-T262 HydrophobicContact CG-CG2 4.24Å; K260-T262 PolarHBondContact O-N 2.89Å
261L27.8Very low32.4Very low182 Ų182145.1 Ų145.195%0.95380%0.802SS**  trans-67.294.1171.1-91.2167.6000111.2E259 H263E259-L261 PolarHBondContact O-N 3.47Å; L261-H263 PolarHBondContact O-N 3.42Å
262T30.4Very low33.1Very low106 Ų106143.6 Ų143.665%0.6581%0.808SS**  trans-73.5121.6-179.350.20000112.3K260 V264K260-T262 HydrophobicContact CD-CG2 4.49Å; K260-T262 HydrophobicContact CG-CG2 4.24Å; K260-T262 PolarHBondContact O-N 2.89Å; T262-V264 PolarHBondContact O-N 2.91Å
263H30.4Very low33.9Very low156 Ų156136.9 Ų136.972%0.72279%0.794SS**  trans-24.1121.6159.816660.5000114.6L261 K265L261-H263 PolarHBondContact O-N 3.42Å; H263-K265 PolarHBondContact O-N 3.22Å
264V31.7Very low35Very low131 Ų131140.5 Ų140.579%0.79480%0.797SS**  trans-72.893.2169.1179.60000108.8T262T262-V264 PolarHBondContact O-N 2.91Å
265K31.8Very low35.7Very low144 Ų144140 Ų14063%0.62679%0.789SS**  trans-65.1130.4171.2-160.2-170.4-175-159.40109.2H263 E267H263-K265 PolarHBondContact O-N 3.22Å; K265-E267 WeakPolarHBondContact CE-OE1 3.48Å; K265-E267 IonicContact NZ-OE1 3.09Å; K265-E267 PolarHBondContact NZ-OE1 3.35Å
266K37.5Very low36.8Very low202 Ų202140.1 Ų140.188%0.87878%0.783SS**  trans-103.8109.6-178.4-172.2-175.4-179.5-171.30109.3
267E31.7Very low38.1Very low137 Ų137143.9 Ų143.964%0.6478%0.781SS**  trans-113.9161.6177.8-101.7173.3-153.400111.9K265K265-E267 WeakPolarHBondContact CE-OE1 3.48Å; K265-E267 IonicContact NZ-OE1 3.09Å; K265-E267 PolarHBondContact NZ-OE1 3.35Å
268P39.2Very low39Very low120 Ų120146 Ų14678%0.77977%0.773SS**  trans-76.1156.9-155.929.1-36000114.5
269Q37.2Very low40Very low196 Ų196145.4 Ų145.492%0.91677%0.768SS**  trans-82.2120.7171.3-73.1-179.5-27.700110.4
270G39.1Very low41.2Very low63 Ų63145.1 Ų145.165%0.64976%0.763SS**  trans-69.9174.3160.400000112.4
271P40.3Very low43Very low124 Ų124145 Ų14581%0.80576%0.763SS**  trans-66154.3-167.225.2-34.8000114.4G273P271-G273 VanDerWaalsContact C-N 3.31Å; P271-G273 PolarHBondContact O-N 3.44Å
272P45.7Very low45.6Very low144 Ų144144.9 Ų144.994%0.93576%0.755SS**  trans-79.864.8-168.733.7-37.6000114
273G46.9Very low48.4Very low55 Ų55142.8 Ų142.857%0.56774%0.743SS**  trans-104.6121.8178.300000114.9P271P271-G273 VanDerWaalsContact C-N 3.31Å; P271-G273 PolarHBondContact O-N 3.44Å
274K50.9Low51.3Low207 Ų207139.9 Ų139.990%0.974%0.738SS**  trans5087.8153.4-54.9170.6-174.4172.90116.9
275N43.8Very low54.1Low118 Ų118144.2 Ų144.263%0.63175%0.746SS**  trans-155.140.2169.8-119.3-68.2000118H277 R278N275-H277 PolarHBondContact O-N 2.94Å; N275-R278 PolarHBondContact O-N 3.48Å
276L52.6Low56.9Low157 Ų157140.2 Ų140.282%0.82275%0.746SS**G310 helixtrans-58-22.4-179.2-173.657.4000114.5
277H54.6Low59.6Low152 Ų152135.5 Ų135.570%0.70473%0.728SS**G310 helixtrans-80.8-17.5-176.9-66.8-103.7000114.4N275 A279N275-H277 PolarHBondContact O-N 2.94Å; H277-A279 VanDerWaalsContact C-N 3.26Å; H277-A279 PolarHBondContact O-N 3.02Å
278R50.1Low62.4Low193 Ų193136.7 Ų136.773%0.72873%0.733SS**G310 helixtrans-72.5-17.7-175.9-162170.9-176.21772.2113.6N275 K280N275-R278 PolarHBondContact O-N 3.48Å; R278-K280 PolarHBondContact O-N 2.95Å
279A54Low65Low84 Ų84136.4 Ų136.469%0.69473%0.725SS**G310 helixtrans-63.5-25.8178.600000113.8H277 K281H277-A279 VanDerWaalsContact C-N 3.26Å; H277-A279 PolarHBondContact O-N 3.02Å; A279-K281 PolarHBondContact O-N 3.37Å
280K57.6Low67.6Low188 Ų188129.5 Ų129.582%0.81770%0.698SS**G310 helixtrans-77.44.8-176.4-58.9-169178.9-171.90115R278R278-K280 PolarHBondContact O-N 2.95Å
281K70.7Confident70.1Confident185 Ų185134.2 Ų134.280%0.80470%0.703SS**G310 helixtrans-11324.7-173.8-64.1-166175.2-169.80114.6A279A279-K281 PolarHBondContact O-N 3.37Å
282K81.3Confident72.7Confident180 Ų180130.6 Ų130.678%0.78369%0.688SS**SBendtrans-127.8146.4174.1-67.1-170.9177.4-172.80110
283P88.4Confident74.9Confident62 Ų62128 Ų12840%0.40367%0.667SS.*PPolyproline II helixtrans-62.9158.7173.928.1-35.2000111.2M287 L289P283-M287 HydrophobicContact CB-CB 4.31Å; P283-M287 HydrophobicContact CB-CG 4.3Å; P283-M287 WeakPolarHBondContact CG-O 3.41Å; P283-L289 HydrophobicContact CB-CD1 4.29Å
284P93.1Very high77Confident96 Ų96128.8 Ų128.862%0.62366%0.661SS**PPolyproline II helixtrans-52.9152.5175.4-27.435.5000113.3G286 M287P284-G286 PolarHBondContact O-N 3.15Å; P284-G286 VanDerWaalsContact O-N 3.12Å; P284-M287 HydrophobicContact CB-CB 4.16Å; P284-M287 HydrophobicContact CG-CB 4.45Å; P284-M287 WeakPolarHBondContact O-CB 3.31Å; P284-M287 PolarHBondContact O-N 2.95Å
285K89.8Confident79Confident221 Ų221121 Ų12196%0.96164%0.635SS**THydrogen-bonded Turntrans-61.8118.1-179.6-178.362.1176174.40110.3
286G91.4Very high81.2Confident60 Ų60117.7 Ų117.762%0.61962%0.623SS**THydrogen-bonded Turntrans98.6-16.6-175.900000114.1P284 H288P284-G286 PolarHBondContact O-N 3.15Å; P284-G286 VanDerWaalsContact O-N 3.12Å; G286-H288 PolarHBondContact O-CE1 3.12Å; G286-H288 PolarHBondContact O-ND1 3.01Å; G286-H288 VanDerWaalsContact O-ND1 3.12Å
287M93Very high83Confident103 Ų103114.4 Ų114.451%0.50761%0.605SS.*  trans-86.6127.6172.3-174.658.668.700109.9P283 P284 L289P283-M287 HydrophobicContact CB-CB 4.31Å; P283-M287 HydrophobicContact CB-CG 4.3Å; P283-M287 WeakPolarHBondContact CG-O 3.41Å; P284-M287 HydrophobicContact CB-CB 4.16Å; P284-M287 HydrophobicContact CG-CB 4.45Å; P284-M287 WeakPolarHBondContact O-CB 3.31Å; P284-M287 PolarHBondContact O-N 2.95Å; M287-L289 HydrophobicContact CG-CD1 4.16Å; M287-L289 HydrophobicContact CG-CG 4.06Å; M287-L289 HydrophobicContact SD-CD2 4.49Å; M287-L289 HydrophobicContact SD-CG 4.48Å
288H91.6Very high84.7Confident162 Ų162111.2 Ų111.275%0.7560%0.6SS**  trans-114.7118.6-179.9-59.788.2000108.4G286G286-H288 PolarHBondContact O-CE1 3.12Å; G286-H288 PolarHBondContact O-ND1 3.01Å; G286-H288 VanDerWaalsContact O-ND1 3.12Å
289L92.3Very high86.6Confident114 Ų114107 Ų10760%0.59760%0.595SS**  trans-136.3112.6179.2-64.5173.5000107.6P283 M287P283-L289 HydrophobicContact CB-CD1 4.29Å; M287-L289 HydrophobicContact CG-CD1 4.16Å; M287-L289 HydrophobicContact CG-CG 4.06Å; M287-L289 HydrophobicContact SD-CD2 4.49Å; M287-L289 HydrophobicContact SD-CG 4.48Å
290S92.4Very high88.3Confident52 Ų52105.9 Ų105.936%0.36458%0.583SS.*  trans-116.5156.7169.393.30000110.8G292 D293 V294S290-G292 PolarHBondContact O-N 2.99Å; S290-G292 PolarHBondContact OG-N 3.33Å; S290-D293 WeakPolarHBondContact CB-OD2 3.34Å; S290-D293 PolarHBondContact O-N 3.3Å; S290-D293 PolarHBondContact OG-N 2.97Å; S290-D293 PolarHBondContact OG-OD2 2.98Å; S290-V294 WeakPolarHBondContact O-CG2 3.41Å; S290-V294 PolarHBondContact O-N 3.1Å
291Q91.9Very high89.6Confident161 Ų161103.9 Ų103.975%0.75259%0.586SS**Hα-helixtrans-63.1-31.3177.8-172.663.126.200112A295Q291-A295 VanDerWaalsContact O-CB 3.23Å; Q291-A295 WeakPolarHBondContact O-CB 3.49Å; Q291-A295 PolarHBondContact O-N 3.46Å; Q291-A295 VanDerWaalsContact O-N 3.1Å
292G93.9Very high90.6Very high48 Ų4899.3 Ų99.350%0.49558%0.576SS.*Hα-helixtrans-69.3-50.3178.600000112S290 V294 A295 A296S290-G292 PolarHBondContact O-N 2.99Å; S290-G292 PolarHBondContact OG-N 3.33Å; G292-V294 PolarHBondContact O-N 3Å; G292-A295 PolarHBondContact O-N 2.85Å; G292-A296 WeakPolarHBondContact O-CB 3.2Å; G292-A296 PolarHBondContact O-N 3.33Å
293D92.4Very high91.1Very high91 Ų9191.4 Ų91.449%0.48754%0.544SS..Hα-helixtrans-63.4-44.6-178.4-46.1-48.3000111S290 A295 A296 M297S290-D293 WeakPolarHBondContact CB-OD2 3.34Å; S290-D293 PolarHBondContact O-N 3.3Å; S290-D293 PolarHBondContact OG-N 2.97Å; S290-D293 PolarHBondContact OG-OD2 2.98Å; D293-A295 PolarHBondContact O-N 3.48Å; D293-A296 PolarHBondContact O-N 3.11Å; D293-M297 WeakPolarHBondContact O-CB 3.49Å; D293-M297 WeakPolarHBondContact O-CG 3.47Å; D293-M297 PolarHBondContact O-N 2.68Å
294V91.4Very high91.2Very high71 Ų7189.8 Ų89.843%0.4354%0.536SS..Hα-helixtrans-62.9-43.2178173.20000110.9S290 G292 S298S290-V294 WeakPolarHBondContact O-CG2 3.41Å; S290-V294 PolarHBondContact O-N 3.1Å; G292-V294 PolarHBondContact O-N 3Å; V294-S298 VanDerWaalsContact O-CB 3.31Å; V294-S298 WeakPolarHBondContact O-CB 3.42Å; V294-S298 PolarHBondContact O-N 3.12Å; V294-S298 PolarHBondContact O-OG 3.32Å
295A92.3Very high91.2Very high44 Ų4488.6 Ų88.636%0.36453%0.527SS..Hα-helixtrans-63.6-49.3175.200000111.7Q291 G292 D293 M297 S298 T299Q291-A295 VanDerWaalsContact O-CB 3.23Å; Q291-A295 WeakPolarHBondContact O-CB 3.49Å; Q291-A295 PolarHBondContact O-N 3.46Å; Q291-A295 VanDerWaalsContact O-N 3.1Å; G292-A295 PolarHBondContact O-N 2.85Å; D293-A295 PolarHBondContact O-N 3.48Å; A295-M297 PolarHBondContact O-N 3.26Å; A295-S298 PolarHBondContact O-N 3.47Å; A295-S298 PolarHBondContact O-OG 2.8Å; A295-T299 WeakPolarHBondContact O-CG2 3.49Å; A295-T299 PolarHBondContact O-N 3.29Å
296A89.8Confident91.4Very high47 Ų4780 Ų8039%0.38850%0.501SS..Hα-helixtrans-56.9-49.2-179.600000112.2G292 D293 S298 T299G292-A296 WeakPolarHBondContact O-CB 3.2Å; G292-A296 PolarHBondContact O-N 3.33Å; D293-A296 PolarHBondContact O-N 3.11Å; A296-S298 VanDerWaalsContact C-N 3.31Å; A296-S298 PolarHBondContact O-N 3.21Å; A296-T299 PolarHBondContact O-OG1 3.45Å
297M90.1Very high91.5Very high89 Ų8980 Ų8044%0.43849%0.489SS..Hα-helixtrans-68.6-24.6-179.7-69.5-179.370.600114D293 A295 A304D293-M297 WeakPolarHBondContact O-CB 3.49Å; D293-M297 WeakPolarHBondContact O-CG 3.47Å; D293-M297 PolarHBondContact O-N 2.68Å; A295-M297 PolarHBondContact O-N 3.26Å; M297-A304 HydrophobicContact CB-CB 4.23Å; M297-A304 HydrophobicContact CE-CB 3.85Å; M297-A304 HydrophobicContact CG-CB 4.49Å
298S91.3Very high91.6Very high84 Ų8480.1 Ų80.159%0.58749%0.491SS*.Hα-helixtrans-96.9-2.8-177.959.10000114.7V294 A295 A296 S300V294-S298 VanDerWaalsContact O-CB 3.31Å; V294-S298 WeakPolarHBondContact O-CB 3.42Å; V294-S298 PolarHBondContact O-N 3.12Å; V294-S298 PolarHBondContact O-OG 3.32Å; A295-S298 PolarHBondContact O-N 3.47Å; A295-S298 PolarHBondContact O-OG 2.8Å; A296-S298 VanDerWaalsContact C-N 3.31Å; A296-S298 PolarHBondContact O-N 3.21Å; S298-S300 PolarHBondContact O-N 2.83Å
299T90Very high91.8Very high104 Ų10480.4 Ų80.464%0.63849%0.485SS*.SBendtrans-56.6-31.6-179.153.40000114.7A295 A296 A303A295-T299 WeakPolarHBondContact O-CG2 3.49Å; A295-T299 PolarHBondContact O-N 3.29Å; A296-T299 PolarHBondContact O-OG1 3.45Å; T299-A303 WeakPolarHBondContact OG1-CB 3.39Å
300S89.8Confident92Very high62 Ų6279.8 Ų79.843%0.43448%0.48SS..SBendtrans-163.5162173.362.60000111.3S298 A303S298-S300 PolarHBondContact O-N 2.83Å; S300-A303 WeakPolarHBondContact O-CB 3.26Å; S300-A303 PolarHBondContact O-N 2.88Å
301T84.5Confident92.1Very high145 Ų14583 Ų8389%0.8949%0.49SS*.THydrogen-bonded Turntrans-49.7-42.3180-40.60000115
302P92.4Very high92.4Very high89 Ų8979.9 Ų79.958%0.57848%0.479SS*.THydrogen-bonded Turntrans-82.6-9.8175.633.1-37.2000114.8A304 V305 G306P302-A304 PolarHBondContact O-N 2.94Å; P302-V305 PolarHBondContact O-N 2.84Å; P302-V305 VanDerWaalsContact O-N 3.11Å; P302-G306 PolarHBondContact O-N 3.41Å
303A90.8Very high92.5Very high15 Ų1584.2 Ų84.212%0.12449%0.488CS..Hα-helixtrans-59-47.7-168.700000113.2T299 S300 V305 G306 V307T299-A303 WeakPolarHBondContact OG1-CB 3.39Å; S300-A303 WeakPolarHBondContact O-CB 3.26Å; S300-A303 PolarHBondContact O-N 2.88Å; A303-V305 VanDerWaalsContact C-N 3.27Å; A303-V305 PolarHBondContact O-N 3.5Å; A303-G306 WeakPolarHBondContact O-CA 3.36Å; A303-G306 PolarHBondContact O-N 2.95Å; A303-G306 VanDerWaalsContact O-N 3.07Å; A303-V307 WeakPolarHBondContact O-CG2 3.2Å; A303-V307 PolarHBondContact O-N 3.05Å
304A90.6Very high92.8Very high28 Ų2884.4 Ų84.423%0.23149%0.486CS..Hα-helixtrans-56.5-39.4176.900000112.9M297 P302 L308M297-A304 HydrophobicContact CB-CB 4.23Å; M297-A304 HydrophobicContact CE-CB 3.85Å; M297-A304 HydrophobicContact CG-CB 4.49Å; P302-A304 PolarHBondContact O-N 2.94Å; A304-L308 WeakPolarHBondContact O-CG 3.45Å; A304-L308 PolarHBondContact O-N 3.12Å; A304-L308 VanDerWaalsContact O-N 3.16Å
305V93.5Very high93.1Very high71 Ų7184.9 Ų84.943%0.4349%0.485SS..Hα-helixtrans-72.6-34.3177.5-176.10000111.3P302 A303 R309P302-V305 PolarHBondContact O-N 2.84Å; P302-V305 VanDerWaalsContact O-N 3.11Å; A303-V305 VanDerWaalsContact C-N 3.27Å; A303-V305 PolarHBondContact O-N 3.5Å; V305-R309 WeakPolarHBondContact O-CB 3.46Å; V305-R309 WeakPolarHBondContact O-CG 3.25Å; V305-R309 PolarHBondContact O-N 3.37Å; V305-R309 VanDerWaalsContact O-N 3.1Å
306G94.2Very high93.4Very high41 Ų4186.8 Ų86.842%0.42349%0.493SS..Hα-helixtrans-62.9-48.517300000112.6P302 A303 L308 R309 Q310P302-G306 PolarHBondContact O-N 3.41Å; A303-G306 WeakPolarHBondContact O-CA 3.36Å; A303-G306 PolarHBondContact O-N 2.95Å; A303-G306 VanDerWaalsContact O-N 3.07Å; G306-L308 PolarHBondContact O-N 3.24Å; G306-R309 PolarHBondContact O-N 3.17Å; G306-Q310 PolarHBondContact O-N 2.81Å
307V93.8Very high93.8Very high60 Ų6085.5 Ų85.536%0.36448%0.484SS..Hα-helixtrans-60.1-46.6177.6173.60000111.1A303 R309 Q310 M311A303-V307 WeakPolarHBondContact O-CG2 3.2Å; A303-V307 PolarHBondContact O-N 3.05Å; V307-R309 PolarHBondContact O-N 3.17Å; V307-Q310 WeakPolarHBondContact O-CB 3.48Å; V307-Q310 PolarHBondContact O-N 3.28Å; V307-M311 WeakPolarHBondContact O-CG 3.33Å; V307-M311 PolarHBondContact O-N 3.39Å; V307-M311 VanDerWaalsContact O-N 3.09Å
308L94Very high94.2Very high104 Ų10485.7 Ų85.755%0.54549%0.485SS..Hα-helixtrans-60.6-45.7178-70.4170.9000112A304 G306 Q310 M311 D312A304-L308 WeakPolarHBondContact O-CG 3.45Å; A304-L308 PolarHBondContact O-N 3.12Å; A304-L308 VanDerWaalsContact O-N 3.16Å; G306-L308 PolarHBondContact O-N 3.24Å; L308-Q310 VanDerWaalsContact C-N 3.32Å; L308-Q310 PolarHBondContact O-N 2.64Å; L308-M311 PolarHBondContact O-N 3.18Å; L308-D312 PolarHBondContact O-N 2.96Å
309R95.7Very high94.5Very high168 Ų16887.2 Ų87.263%0.63448%0.482SS*.Hα-helixtrans-62.1-36.8176.4-76.6177.1176.5152.80.1113.1V305 G306 V307 D312 M313V305-R309 WeakPolarHBondContact O-CB 3.46Å; V305-R309 WeakPolarHBondContact O-CG 3.25Å; V305-R309 PolarHBondContact O-N 3.37Å; V305-R309 VanDerWaalsContact O-N 3.1Å; G306-R309 PolarHBondContact O-N 3.17Å; V307-R309 PolarHBondContact O-N 3.17Å; R309-D312 PolarHBondContact O-N 3.07Å; R309-M313 WeakPolarHBondContact O-CG 3.14Å; R309-M313 PolarHBondContact O-N 3.38Å
310Q96.4Very high94.9Very high102 Ų10290.3 Ų90.348%0.47748%0.482SS..Hα-helixtrans-62-45.7174.4178.659.829.200110.8G306 V307 L308 D312 M313 E314G306-Q310 PolarHBondContact O-N 2.81Å; V307-Q310 WeakPolarHBondContact O-CB 3.48Å; V307-Q310 PolarHBondContact O-N 3.28Å; L308-Q310 VanDerWaalsContact C-N 3.32Å; L308-Q310 PolarHBondContact O-N 2.64Å; Q310-D312 PolarHBondContact O-N 2.96Å; Q310-M313 PolarHBondContact O-N 3.29Å; Q310-E314 PolarHBondContact NE2-OE1 3.47Å; Q310-E314 PolarHBondContact O-N 2.92Å
311M95.9Very high95.3Very high118 Ų11893.1 Ų93.158%0.58149%0.488SS*.Hα-helixtrans-66.1-35.5177.1-58.1-151.3100.400112.7V307 L308 E314 L315V307-M311 WeakPolarHBondContact O-CG 3.33Å; V307-M311 PolarHBondContact O-N 3.39Å; V307-M311 VanDerWaalsContact O-N 3.09Å; L308-M311 PolarHBondContact O-N 3.18Å; M311-E314 PolarHBondContact O-N 2.92Å; M311-L315 VanDerWaalsContact O-CB 3.26Å; M311-L315 WeakPolarHBondContact O-CB 3.33Å; M311-L315 PolarHBondContact O-N 3.09Å
312D97.5Very high95.9Very high97 Ų9790.3 Ų90.352%0.51947%0.467SS..Hα-helixtrans-62.8-42.3172.3-77.3-38.5000111.9L308 R309 Q310 L315 V316L308-D312 PolarHBondContact O-N 2.96Å; R309-D312 PolarHBondContact O-N 3.07Å; Q310-D312 PolarHBondContact O-N 2.96Å; D312-L315 PolarHBondContact O-N 3.25Å; D312-V316 WeakPolarHBondContact O-CG2 3.32Å; D312-V316 PolarHBondContact O-N 2.94Å
313M97.2Very high96.2Very high139 Ų13991.7 Ų91.769%0.68547%0.465SS*.Hα-helixtrans-66.2-40.1176.8-72.6-172.870.600112.3R309 Q310 V316 G317R309-M313 WeakPolarHBondContact O-CG 3.14Å; R309-M313 PolarHBondContact O-N 3.38Å; Q310-M313 PolarHBondContact O-N 3.29Å; M313-V316 PolarHBondContact O-N 3.17Å; M313-G317 PolarHBondContact O-N 3.39Å
314E98.1Very high96.6Very high94 Ų9494.6 Ų94.644%0.43949%0.485SS..Hα-helixtrans-64.4-43173-74.6174.4-156.800111.8Q310 M311 V316 G317 I318Q310-E314 PolarHBondContact NE2-OE1 3.47Å; Q310-E314 PolarHBondContact O-N 2.92Å; M311-E314 PolarHBondContact O-N 2.92Å; E314-V316 VanDerWaalsContact C-N 3.33Å; E314-V316 PolarHBondContact O-N 3.11Å; E314-G317 WeakPolarHBondContact O-CA 3.35Å; E314-G317 PolarHBondContact O-N 3.16Å; E314-G317 VanDerWaalsContact O-N 3.1Å; E314-I318 WeakPolarHBondContact O-CG1 3.44Å; E314-I318 PolarHBondContact O-N 3.49Å
315L97.4Very high96.9Very high81 Ų8197.2 Ų97.242%0.42449%0.494SS..Hα-helixtrans-60.3-41.2175.5-179.863.3000111.8M311 D312 K319M311-L315 VanDerWaalsContact O-CB 3.26Å; M311-L315 WeakPolarHBondContact O-CB 3.33Å; M311-L315 PolarHBondContact O-N 3.09Å; D312-L315 PolarHBondContact O-N 3.25Å; L315-K319 HydrophobicContact CD1-CD 4.49Å; L315-K319 HydrophobicContact CG-CD 4.23Å; L315-K319 WeakPolarHBondContact O-CB 3.49Å; L315-K319 WeakPolarHBondContact O-CD 3.33Å; L315-K319 WeakPolarHBondContact O-CG 3.27Å; L315-K319 PolarHBondContact O-N 3.47Å
316V97.9Very high97.2Very high85 Ų85100.1 Ų100.152%0.51550%0.501SS..Hα-helixtrans-68.2-36.9173.5170.70000111.6D312 M313 E314 R320D312-V316 WeakPolarHBondContact O-CG2 3.32Å; D312-V316 PolarHBondContact O-N 2.94Å; M313-V316 PolarHBondContact O-N 3.17Å; E314-V316 VanDerWaalsContact C-N 3.33Å; E314-V316 PolarHBondContact O-N 3.11Å; V316-R320 WeakPolarHBondContact O-CB 3.49Å; V316-R320 PolarHBondContact O-N 3.39Å
317G98.3Very high97.3Very high20 Ų20105.5 Ų105.521%0.20652%0.515CS..Hα-helixtrans-58.1-53.5172.100000112.7M313 E314 R320 Q321M313-G317 PolarHBondContact O-N 3.39Å; E314-G317 WeakPolarHBondContact O-CA 3.35Å; E314-G317 PolarHBondContact O-N 3.16Å; E314-G317 VanDerWaalsContact O-N 3.1Å; G317-R320 PolarHBondContact O-N 3.34Å; G317-Q321 PolarHBondContact O-N 3.1Å
318I98.4Very high97.5Very high92 Ų92107.2 Ų107.247%0.47252%0.522SS..Hα-helixtrans-63.5-43179-66.5166.1000110.8E314 R320 Q321 I322E314-I318 WeakPolarHBondContact O-CG1 3.44Å; E314-I318 PolarHBondContact O-N 3.49Å; I318-R320 VanDerWaalsContact C-N 3.33Å; I318-R320 PolarHBondContact O-N 2.98Å; I318-Q321 PolarHBondContact O-N 3.24Å; I318-I322 HydrophobicContact CG2-CD1 3.83Å; I318-I322 HydrophobicContact CG2-CG1 4.42Å; I318-I322 WeakPolarHBondContact O-CG1 3.31Å; I318-I322 PolarHBondContact O-N 2.99Å
319K97.9Very high97.7Very high117 Ų117106.2 Ų106.251%0.50952%0.517SS..Hα-helixtrans-56.9-43.9174.4-78.4169179173.40112L315 I322 Q323L315-K319 HydrophobicContact CD1-CD 4.49Å; L315-K319 HydrophobicContact CG-CD 4.23Å; L315-K319 WeakPolarHBondContact O-CB 3.49Å; L315-K319 WeakPolarHBondContact O-CD 3.33Å; L315-K319 WeakPolarHBondContact O-CG 3.27Å; L315-K319 PolarHBondContact O-N 3.47Å; K319-I322 PolarHBondContact O-N 3.38Å; K319-Q323 WeakPolarHBondContact O-CG 3.37Å; K319-Q323 PolarHBondContact O-N 3.44Å; K319-Q323 VanDerWaalsContact O-N 3.17Å
320R98.2Very high97.8Very high168 Ų168101.8 Ų101.863%0.63451%0.512SS*.Hα-helixtrans-64.9-42.6176.2-176.8175.764.8-99.92.4112.1V316 G317 I318 I322 Q323 S324V316-R320 WeakPolarHBondContact O-CB 3.49Å; V316-R320 PolarHBondContact O-N 3.39Å; G317-R320 PolarHBondContact O-N 3.34Å; I318-R320 VanDerWaalsContact C-N 3.33Å; I318-R320 PolarHBondContact O-N 2.98Å; R320-I322 PolarHBondContact O-N 2.87Å; R320-Q323 PolarHBondContact O-N 2.97Å; R320-S324 PolarHBondContact O-N 2.96Å; R320-S324 VanDerWaalsContact O-N 3.08Å
321Q98.2Very high97.9Very high121 Ų12198.8 Ų98.857%0.56551%0.505SS*.Hα-helixtrans-61.6-42.3176.1-172.61802.900111.8G317 I318 Q323 S324 I325G317-Q321 PolarHBondContact O-N 3.1Å; I318-Q321 PolarHBondContact O-N 3.24Å; Q321-Q323 VanDerWaalsContact C-N 3.34Å; Q321-Q323 PolarHBondContact O-N 2.95Å; Q321-S324 PolarHBondContact O-N 2.88Å; Q321-I325 HydrophobicContact CG-CD1 4.01Å; Q321-I325 WeakPolarHBondContact O-CG1 3.31Å; Q321-I325 PolarHBondContact O-N 3.41Å
322I98.4Very high98Very high87 Ų8797.1 Ų97.145%0.44650%0.498SS..Hα-helixtrans-59.9-42175.6-71.3165.5000111.4I318 K319 R320 I325 K326I318-I322 HydrophobicContact CG2-CD1 3.83Å; I318-I322 HydrophobicContact CG2-CG1 4.42Å; I318-I322 WeakPolarHBondContact O-CG1 3.31Å; I318-I322 PolarHBondContact O-N 2.99Å; K319-I322 PolarHBondContact O-N 3.38Å; R320-I322 PolarHBondContact O-N 2.87Å; I322-I325 PolarHBondContact O-N 3.02Å; I322-K326 HydrophobicContact CG2-CD 4.44Å; I322-K326 WeakPolarHBondContact O-CB 3.41Å; I322-K326 WeakPolarHBondContact O-CG 2.88Å; I322-K326 PolarHBondContact O-N 3.14Å
323Q98.2Very high98Very high118 Ų118100.1 Ų100.155%0.55151%0.506SS*.Hα-helixtrans-67.3-39.6177.7-63.3-6827.700112.3K319 R320 Q321 K326 Q327K319-Q323 WeakPolarHBondContact O-CG 3.37Å; K319-Q323 PolarHBondContact O-N 3.44Å; K319-Q323 VanDerWaalsContact O-N 3.17Å; R320-Q323 PolarHBondContact O-N 2.97Å; Q321-Q323 VanDerWaalsContact C-N 3.34Å; Q321-Q323 PolarHBondContact O-N 2.95Å; Q323-K326 PolarHBondContact O-N 3Å; Q323-Q327 PolarHBondContact O-N 3.31Å
324S98.2Very high97.9Very high76 Ų76100.6 Ų100.653%0.53151%0.507SS..Hα-helixtrans-61.4-44.2173.7177.40000112.1R320 Q321 Q327 N328R320-S324 PolarHBondContact O-N 2.96Å; R320-S324 VanDerWaalsContact O-N 3.08Å; Q321-S324 PolarHBondContact O-N 2.88Å; S324-Q327 PolarHBondContact O-N 3.26Å; S324-N328 PolarHBondContact O-N 3.45Å
325I98.4Very high97.8Very high82 Ų82104.2 Ų104.242%0.42152%0.521SS..Hα-helixtrans-63.9-42175.3-67.5167.6000111Q321 I322 N328 N329Q321-I325 HydrophobicContact CG-CD1 4.01Å; Q321-I325 WeakPolarHBondContact O-CG1 3.31Å; Q321-I325 PolarHBondContact O-N 3.41Å; I322-I325 PolarHBondContact O-N 3.02Å; I325-N328 PolarHBondContact O-N 3.17Å; I325-N329 VanDerWaalsContact O-CB 3.27Å; I325-N329 WeakPolarHBondContact O-CB 3.37Å; I325-N329 PolarHBondContact O-N 2.98Å; I325-N329 PolarHBondContact O-OD1 3.25Å
326K98.4Very high97.7Very high133 Ų133106.5 Ų106.558%0.57853%0.533SS*.Hα-helixtrans-58.6-47.5174.9-82.5-177.5169.5-167.10112I322 Q323 N329 S330I322-K326 HydrophobicContact CG2-CD 4.44Å; I322-K326 WeakPolarHBondContact O-CB 3.41Å; I322-K326 WeakPolarHBondContact O-CG 2.88Å; I322-K326 PolarHBondContact O-N 3.14Å; Q323-K326 PolarHBondContact O-N 3Å; K326-N329 PolarHBondContact O-N 3.33Å; K326-S330 WeakPolarHBondContact O-CB 3.35Å; K326-S330 PolarHBondContact O-N 3.04Å
327Q97.6Very high97.5Very high153 Ų153109.2 Ų109.272%0.71555%0.545SS*.Hα-helixtrans-63.4-46.4-179.8-171.4177.67.200111.5Q323 S324 S330 A331Q323-Q327 PolarHBondContact O-N 3.31Å; S324-Q327 PolarHBondContact O-N 3.26Å; Q327-S330 WeakPolarHBondContact O-CB 3.44Å; Q327-S330 PolarHBondContact O-N 3.32Å; Q327-A331 PolarHBondContact O-N 3.49Å; Q327-A331 VanDerWaalsContact O-N 3.15Å
328N98.3Very high97Very high96 Ų96113.3 Ų113.351%0.51357%0.565SS.*Hα-helixtrans-62.7-45177.3-170.343.4000111.9S324 I325 S330 A331 L332S324-N328 PolarHBondContact O-N 3.45Å; I325-N328 PolarHBondContact O-N 3.17Å; N328-S330 VanDerWaalsContact C-N 3.26Å; N328-S330 PolarHBondContact O-N 3.24Å; N328-A331 PolarHBondContact O-N 2.65Å; N328-L332 WeakPolarHBondContact O-CG 3.38Å; N328-L332 PolarHBondContact O-N 3.09Å
329N97.9Very high96.7Very high84 Ų84110.8 Ų110.845%0.44956%0.562SS.*Hα-helixtrans-64.9-29.7176.7-71.12.4000112.4I325 K326 L332 K333I325-N329 VanDerWaalsContact O-CB 3.27Å; I325-N329 WeakPolarHBondContact O-CB 3.37Å; I325-N329 PolarHBondContact O-N 2.98Å; I325-N329 PolarHBondContact O-OD1 3.25Å; K326-N329 PolarHBondContact O-N 3.33Å; N329-L332 PolarHBondContact O-N 2.81Å; N329-K333 WeakPolarHBondContact O-CG 3.06Å; N329-K333 PolarHBondContact O-N 2.95Å
330S97.6Very high96.6Very high75 Ų75110 Ų11052%0.52457%0.567SS.*Hα-helixtrans-64.9-48.3173.2-159.30000111.3K326 Q327 N328 L332 K333 E334K326-S330 WeakPolarHBondContact O-CB 3.35Å; K326-S330 PolarHBondContact O-N 3.04Å; Q327-S330 WeakPolarHBondContact O-CB 3.44Å; Q327-S330 PolarHBondContact O-N 3.32Å; N328-S330 VanDerWaalsContact C-N 3.26Å; N328-S330 PolarHBondContact O-N 3.24Å; S330-L332 VanDerWaalsContact C-N 3.29Å; S330-L332 PolarHBondContact O-N 3.44Å; S330-K333 WeakPolarHBondContact O-CB 3.47Å; S330-K333 PolarHBondContact O-N 2.95Å; S330-K333 VanDerWaalsContact O-N 3.16Å; S330-E334 PolarHBondContact O-N 2.87Å
331A97.5Very high96.2Very high39 Ų39107 Ų10732%0.32256%0.563SS.*Hα-helixtrans-66-29.7176.800000113Q327 N328 K335Q327-A331 PolarHBondContact O-N 3.49Å; Q327-A331 VanDerWaalsContact O-N 3.15Å; N328-A331 PolarHBondContact O-N 2.65Å; A331-K335 WeakPolarHBondContact O-CG 3.33Å; A331-K335 PolarHBondContact O-N 3.36Å
332L97.8Very high95.9Very high83 Ų83107.5 Ų107.544%0.43557%0.57SS.*Hα-helixtrans-72.7-35.4171.8-69.9173.5000112.6N328 N329 S330 L336N328-L332 WeakPolarHBondContact O-CG 3.38Å; N328-L332 PolarHBondContact O-N 3.09Å; N329-L332 PolarHBondContact O-N 2.81Å; S330-L332 VanDerWaalsContact C-N 3.29Å; S330-L332 PolarHBondContact O-N 3.44Å; L332-L336 WeakPolarHBondContact O-CG 3.38Å
333K97.3Very high95.6Very high159 Ų159111.2 Ų111.269%0.69158%0.583SS**Hα-helixtrans-66-45172.3-80.6-174.971.4-157.60112N329 S330 K335 L336 D337N329-K333 WeakPolarHBondContact O-CG 3.06Å; N329-K333 PolarHBondContact O-N 2.95Å; S330-K333 WeakPolarHBondContact O-CB 3.47Å; S330-K333 PolarHBondContact O-N 2.95Å; S330-K333 VanDerWaalsContact O-N 3.16Å; K333-K335 VanDerWaalsContact C-N 3.29Å; K333-K335 PolarHBondContact O-N 2.98Å; K333-L336 CarbonylContact O-C 3.42Å; K333-L336 WeakPolarHBondContact O-CA 3.39Å; K333-L336 PolarHBondContact O-N 2.81Å; K333-D337 PolarHBondContact O-N 3.12Å; K333-D337 VanDerWaalsContact O-N 3.12Å
334E96.8Very high95.4Very high150 Ų150113.3 Ų113.370%0.70159%0.586SS**Hα-helixtrans-57-42.3177.7-174.6-177.9175.300111.7S330 L336 D337S330-E334 PolarHBondContact O-N 2.87Å; E334-L336 PolarHBondContact O-N 2.95Å; E334-L336 VanDerWaalsContact O-N 3.16Å; E334-D337 WeakPolarHBondContact O-CB 3.21Å; E334-D337 PolarHBondContact O-N 3.24Å
335K96.1Very high95.1Very high170 Ų170115.4 Ų115.474%0.73960%0.595SS**THydrogen-bonded Turntrans-65.5-11.9173.4-73.4174.7179.3-177.10115A331 K333A331-K335 WeakPolarHBondContact O-CG 3.33Å; A331-K335 PolarHBondContact O-N 3.36Å; K333-K335 VanDerWaalsContact C-N 3.29Å; K333-K335 PolarHBondContact O-N 2.98Å
336L95.3Very high94.8Very high128 Ų128116.8 Ų116.867%0.6761%0.61SS**THydrogen-bonded Turntrans-115.77-179.3-65.2173.7000112.5L332 K333 E334 V338 G339L332-L336 WeakPolarHBondContact O-CG 3.38Å; K333-L336 CarbonylContact O-C 3.42Å; K333-L336 WeakPolarHBondContact O-CA 3.39Å; K333-L336 PolarHBondContact O-N 2.81Å; E334-L336 PolarHBondContact O-N 2.95Å; E334-L336 VanDerWaalsContact O-N 3.16Å; L336-V338 VanDerWaalsContact C-N 3.29Å; L336-V338 PolarHBondContact O-N 2.89Å; L336-G339 WeakPolarHBondContact O-CA 3.25Å; L336-G339 PolarHBondContact O-N 2.91Å
337D92.3Very high94.3Very high143 Ų143117.9 Ų117.977%0.76562%0.617SS**THydrogen-bonded Turntrans-62.2-34.5-174.5-166.569.5000113K333 E334 G339K333-D337 PolarHBondContact O-N 3.12Å; K333-D337 VanDerWaalsContact O-N 3.12Å; E334-D337 WeakPolarHBondContact O-CB 3.21Å; E334-D337 PolarHBondContact O-N 3.24Å; D337-G339 PolarHBondContact O-N 2.92Å
338V89.3Confident93.9Very high105 Ų105115.8 Ų115.864%0.63662%0.615SS**THydrogen-bonded Turntrans-67.1-12.9174.5-175.90000112.7L336 N342L336-V338 VanDerWaalsContact C-N 3.29Å; L336-V338 PolarHBondContact O-N 2.89Å; V338-N342 WeakPolarHBondContact CG1-ND2 3.48Å
339G91.9Very high93.3Very high40 Ų40118.2 Ų118.241%0.41263%0.628SS.*  trans62.4-149.5179.300000113.5L336 D337L336-G339 WeakPolarHBondContact O-CA 3.25Å; L336-G339 PolarHBondContact O-N 2.91Å; D337-G339 PolarHBondContact O-N 2.92Å
340V94.7Very high92.9Very high99 Ų99119.1 Ų119.160%0.663%0.629SS**SBendtrans-123.70.1177.2-63.30000113.6N342 F343 R344V340-N342 VanDerWaalsContact C-N 3.31Å; V340-N342 PolarHBondContact O-N 3.34Å; V340-F343 CarbonylContact O-C 3.52Å; V340-F343 WeakPolarHBondContact O-CA 3.33Å; V340-F343 WeakPolarHBondContact O-CB 3.35Å; V340-F343 PolarHBondContact O-N 3.43Å; V340-R344 PolarHBondContact O-N 3.27Å
341D90.4Very high92.7Very high105 Ų105124.9 Ų124.956%0.56165%0.645SS**G310 helixtrans-70.2-27.4-170.6-62.7-60000113.2F343 R344D341-F343 PolarHBondContact O-N 3.41Å; D341-R344 WeakPolarHBondContact O-CB 3.46Å; D341-R344 PolarHBondContact O-N 3.28Å; D341-R344 VanDerWaalsContact O-N 3.13Å; D341-R344 IonicContact OD1-CZ 2.7Å; D341-R344 IonicContact OD1-NE 3.45Å; D341-R344 PolarHBondContact OD1-NE 2.79Å; D341-R344 IonicContact OD1-NH2 3.63Å
342N90.8Very high92.5Very high133 Ų133129.6 Ų129.671%0.71166%0.658SS**G310 helixtrans-64.6-14.2168.6-67.1-46.4000113.8V338 V340V338-N342 WeakPolarHBondContact CG1-ND2 3.48Å; V340-N342 VanDerWaalsContact C-N 3.31Å; V340-N342 PolarHBondContact O-N 3.34Å
343F92.6Very high92.3Very high165 Ų165128.8 Ų128.872%0.72465%0.654SS**G310 helixtrans-1101.4176.5-53-80.1000112.5V340 D341 V345V340-F343 CarbonylContact O-C 3.52Å; V340-F343 WeakPolarHBondContact O-CA 3.33Å; V340-F343 WeakPolarHBondContact O-CB 3.35Å; V340-F343 PolarHBondContact O-N 3.43Å; D341-F343 PolarHBondContact O-N 3.41Å; F343-V345 PolarHBondContact O-N 3.31Å
344R93.5Very high92.2Very high161 Ų161127.1 Ų127.161%0.60866%0.658SS**  trans-78105.3179.9-179-173.3-74.2-912.7110.2V340 D341V340-R344 PolarHBondContact O-N 3.27Å; D341-R344 WeakPolarHBondContact O-CB 3.46Å; D341-R344 PolarHBondContact O-N 3.28Å; D341-R344 VanDerWaalsContact O-N 3.13Å; D341-R344 IonicContact OD1-CZ 2.7Å; D341-R344 IonicContact OD1-NE 3.45Å; D341-R344 PolarHBondContact OD1-NE 2.79Å; D341-R344 IonicContact OD1-NH2 3.63Å
345V92.8Very high92.2Very high120 Ų120129 Ų12973%0.72766%0.658SS**PPolyproline II helixtrans-66.9138.9169.6-175.30000109.8F343F343-V345 PolarHBondContact O-N 3.31Å
346P91.6Very high92.3Very high111 Ų111123 Ų12372%0.72163%0.631SS**PPolyproline II helixtrans-61.7142.2175.9-24.935.1000113.7V348P346-V348 PolarHBondContact O-N 3.31Å
347E88.6Confident92.4Very high156 Ų156119.4 Ų119.473%0.72962%0.615SS**PPolyproline II helixtrans-75.7116.9-179.9-70.8177.8-169.800112.6N349E347-N349 PolarHBondContact O-N 3.03Å; E347-N349 PolarHBondContact O-ND2 3.45Å
348V88.6Confident92.7Very high110 Ų110117.6 Ų117.667%0.66761%0.609SS**  trans-8689-176.41780000110.7P346 Q350P346-V348 PolarHBondContact O-N 3.31Å; V348-Q350 HydrophobicContact CG1-CG 3.99Å; V348-Q350 PolarHBondContact O-N 3.31Å
349N85.2Confident93Very high147 Ų147119.4 Ų119.479%0.78661%0.61SS**  trans-77.282-178.9-82.6-89.9000112.7E347E347-N349 PolarHBondContact O-N 3.03Å; E347-N349 PolarHBondContact O-ND2 3.45Å
350Q89.9Confident93.3Very high103 Ų103118.1 Ų118.148%0.48159%0.594SS.*PPolyproline II helixtrans-89.7154.2171.9-73.2-175.954.500112.6V348 N384V348-Q350 HydrophobicContact CG1-CG 3.99Å; V348-Q350 PolarHBondContact O-N 3.31Å; Q350-N384 HydrophobicContact CB-CB 4.32Å
351K93.1Very high93.5Very high195 Ų195114.8 Ų114.885%0.84857%0.572SS**PPolyproline II helixtrans-89.8134.8173.8-67.2-177.1179.6179.20110.1N353K351-N353 PolarHBondContact O-N 3.18Å
352F94.6Very high93.8Very high138 Ų138114.3 Ų114.361%0.60557%0.568SS**PPolyproline II helixtrans-60.1135.7177.5-63.2-60.5000112.4N384 K385F352-N384 CarbonylContact C-O 3.56Å; F352-N384 VanDerWaalsContact CA-O 3.29Å; F352-N384 WeakPolarHBondContact CA-O 3.26Å; F352-K385 VanDerWaalsContact CD1-C 3.46Å; F352-K385 WeakPolarHBondContact CE1-O 3.32Å
353N93.9Very high94.1Very high66 Ų66111 Ų11135%0.35355%0.55SS.*  trans-122.6136.1-177.4-173.9-5.1000110.6K351 R355 N384 K385 Q389K351-N353 PolarHBondContact O-N 3.18Å; N353-R355 PolarHBondContact OD1-N 3.46Å; N353-N384 PolarHBondContact N-O 3.21Å; N353-K385 WeakPolarHBondContact O-CD 3.32Å; N353-Q389 PolarHBondContact O-NE2 3.48Å
354T95.1Very high94.4Very high125 Ų125103.1 Ų103.177%0.76752%0.516SS*.SBendtrans-83.1-20.8179.753.70000114
355R96.8Very high94.6Very high189 Ų18996.8 Ų96.871%0.71350%0.495SS*.SBendtrans-78.1141.5174.2-171.9173.6-63.1-81.8-1.4109.9N353 K385N353-R355 PolarHBondContact OD1-N 3.46Å; R355-K385 WeakPolarHBondContact O-CE 3.32Å; R355-K385 PolarHBondContact O-NZ 3.42Å
356W97.6Very high94.8Very high43 Ų4397.1 Ų97.116%0.16349%0.489CS..  trans-104.5115.4171.4-75.690.8000109.9E360 Q361 A364 I382 K385 Q389 F393W356-E360 VanDerWaalsContact CA-OE2 3.26Å; W356-E360 WeakPolarHBondContact CA-OE2 3.47Å; W356-E360 HydrophobicContact CE3-CB 3.93Å; W356-E360 HydrophobicContact CZ3-CB 4.3Å; W356-Q361 HydrophobicContact CB-CG 4.07Å; W356-Q361 HydrophobicContact CE3-CG 4.14Å; W356-Q361 PolarHBondContact O-NE2 3.05Å; W356-A364 HydrophobicContact CH2-CB 4.44Å; W356-A364 HydrophobicContact CZ3-CB 3.98Å; W356-I382 HydrophobicContact CH2-CD1 4Å; W356-I382 HydrophobicContact CZ3-CD1 4.06Å; W356-K385 HydrophobicContact CD2-CD 4.15Å; W356-K385 VanDerWaalsContact CD2-CE 3.46Å; W356-K385 HydrophobicContact CE3-CD 4.38Å; W356-K385 HydrophobicContact CE3-CG 4.45Å; W356-K385 HydrophobicContact CH2-CB 4.21Å; W356-K385 HydrophobicContact CH2-CD 3.98Å; W356-K385 HydrophobicContact CH2-CG 3.64Å; W356-K385 HydrophobicContact CZ2-CB 4.38Å; W356-K385 HydrophobicContact CZ2-CD 3.68Å; W356-K385 HydrophobicContact CZ2-CG 3.85Å; W356-K385 HydrophobicContact CZ3-CD 4.31Å; W356-K385 HydrophobicContact CZ3-CG 3.95Å; W356-Q389 HydrophobicContact CZ2-CB 4.39Å; W356-F393 HydrophobicContact CD2-CD2 4.13Å; W356-F393 HydrophobicContact CE3-CD2 4.1Å; W356-F393 HydrophobicContact CE3-CE2 4.42Å; W356-F393 HydrophobicContact CH2-CB 3.89Å; W356-F393 HydrophobicContact CH2-CD2 4.1Å; W356-F393 AromaticContact CH2-CG 3.97Å; W356-F393 HydrophobicContact CH2-CG 3.97Å; W356-F393 HydrophobicContact CZ2-CB 3.61Å; W356-F393 HydrophobicContact CZ2-CD2 4.14Å; W356-F393 HydrophobicContact CZ2-CG 4.08Å; W356-F393 HydrophobicContact CZ3-CD2 4.08Å; W356-F393 HydrophobicContact CZ3-CE2 4.5Å; W356-F393 HydrophobicContact CZ3-CG 4.33Å
357T97.4Very high95.1Very high54 Ų5492 Ų9233%0.33146%0.455SS..  trans-78.4165.5169.974.30000110.5E359 E360 Q361T357-E359 VanDerWaalsContact C-N 3.29Å; T357-E359 PolarHBondContact O-N 3.08Å; T357-E360 PolarHBondContact N-OE2 3.49Å; T357-E360 PolarHBondContact O-N 3.23Å; T357-E360 VanDerWaalsContact OG1-CG 3.23Å; T357-E360 WeakPolarHBondContact OG1-CG 3.34Å; T357-E360 PolarHBondContact OG1-N 3.06Å; T357-E360 VanDerWaalsContact OG1-N 3.1Å; T357-Q361 WeakPolarHBondContact O-CG 3.47Å; T357-Q361 PolarHBondContact O-N 3.49Å; T357-Q361 VanDerWaalsContact O-N 3.13Å; T357-Q361 PolarHBondContact O-NE2 2.9Å
358T97.3Very high95.5Very high105 Ų10584.5 Ų84.564%0.64442%0.421SS*.Hα-helixtrans-63.7-37.4175.6-46.30000111.6Q361 L362T358-Q361 PolarHBondContact O-N 2.94Å; T358-L362 HydrophobicContact CG2-CD1 4.31Å; T358-L362 WeakPolarHBondContact O-CG 3.4Å; T358-L362 PolarHBondContact O-N 3.31Å
359E97.6Very high95.9Very high142 Ų14282.2 Ų82.266%0.66440%0.4SS*.Hα-helixtrans-61-50.1175.3179.7177.9-156.600111.7T357 Q361 L362 L363T357-E359 VanDerWaalsContact C-N 3.29Å; T357-E359 PolarHBondContact O-N 3.08Å; E359-Q361 VanDerWaalsContact C-N 3.27Å; E359-Q361 PolarHBondContact O-N 3.25Å; E359-L362 PolarHBondContact O-N 3.23Å; E359-L363 HydrophobicContact CG-CD1 4.2Å; E359-L363 WeakPolarHBondContact O-CB 3.41Å; E359-L363 WeakPolarHBondContact O-CG 3.44Å; E359-L363 PolarHBondContact O-N 3.25Å
360E97.6Very high96.4Very high14 Ų1481.4 Ų81.47%0.06539%0.39CS..Hα-helixtrans-61.3-34.4177.2-68.3164.4169.300112.5W356 T357 A364 I382 N384 K385W356-E360 VanDerWaalsContact CA-OE2 3.26Å; W356-E360 WeakPolarHBondContact CA-OE2 3.47Å; W356-E360 HydrophobicContact CE3-CB 3.93Å; W356-E360 HydrophobicContact CZ3-CB 4.3Å; T357-E360 PolarHBondContact N-OE2 3.49Å; T357-E360 PolarHBondContact O-N 3.23Å; T357-E360 VanDerWaalsContact OG1-CG 3.23Å; T357-E360 WeakPolarHBondContact OG1-CG 3.34Å; T357-E360 PolarHBondContact OG1-N 3.06Å; T357-E360 VanDerWaalsContact OG1-N 3.1Å; E360-A364 VanDerWaalsContact O-CB 3.31Å; E360-A364 WeakPolarHBondContact O-CB 3.47Å; E360-A364 PolarHBondContact O-N 3.26Å; E360-I382 HydrophobicContact CB-CG2 4.31Å; E360-I382 HydrophobicContact CG-CG2 4.26Å; E360-N384 PolarHBondContact OE1-ND2 3.15Å; E360-N384 PolarHBondContact OE1-OD1 3.44Å; E360-K385 IonicContact OE1-NZ 2.97Å; E360-K385 PolarHBondContact OE1-NZ 2.88Å; E360-K385 VanDerWaalsContact OE1-NZ 3.07Å; E360-K385 WeakPolarHBondContact OE2-CE 3.44Å; E360-K385 IonicContact OE2-NZ 3.27Å; E360-K385 PolarHBondContact OE2-NZ 3.23Å
361Q97.6Very high96.7Very high29 Ų2980.4 Ų80.414%0.13638%0.382CS..Hα-helixtrans-69.8-42.3176.2-68.9168.664.600111.6W356 T357 T358 E359 A364 V365 F393 Y397 F401W356-Q361 HydrophobicContact CB-CG 4.07Å; W356-Q361 HydrophobicContact CE3-CG 4.14Å; W356-Q361 PolarHBondContact O-NE2 3.05Å; T357-Q361 WeakPolarHBondContact O-CG 3.47Å; T357-Q361 PolarHBondContact O-N 3.49Å; T357-Q361 VanDerWaalsContact O-N 3.13Å; T357-Q361 PolarHBondContact O-NE2 2.9Å; T358-Q361 PolarHBondContact O-N 2.94Å; E359-Q361 VanDerWaalsContact C-N 3.27Å; E359-Q361 PolarHBondContact O-N 3.25Å; Q361-A364 PolarHBondContact O-N 3.01Å; Q361-V365 WeakPolarHBondContact O-CG2 3.39Å; Q361-V365 PolarHBondContact O-N 2.86Å; Q361-F393 HydrophobicContact CB-CE2 4.25Å; Q361-F393 HydrophobicContact CB-CZ 4.49Å; Q361-F393 HydrophobicContact CG-CE2 3.93Å; Q361-Y397 HydrophobicContact CG-CE1 4.41Å; Q361-F401 HydrophobicContact CB-CE2 4.02Å; Q361-F401 HydrophobicContact CB-CZ 4.11Å; Q361-F401 HydrophobicContact CG-CE2 4.48Å
362L97.7Very high96.9Very high94 Ų9471.1 Ų71.149%0.49234%0.341SS..Hα-helixtrans-69.3-36.7176.2-69171.4000112.1T358 E359 Q366T358-L362 HydrophobicContact CG2-CD1 4.31Å; T358-L362 WeakPolarHBondContact O-CG 3.4Å; T358-L362 PolarHBondContact O-N 3.31Å; E359-L362 PolarHBondContact O-N 3.23Å; L362-Q366 WeakPolarHBondContact O-CG 3.4Å; L362-Q366 PolarHBondContact O-N 2.61Å; L362-Q366 VanDerWaalsContact O-N 3.11Å; L362-Q366 PolarHBondContact O-NE2 3.28Å
363L98Very high96.9Very high63 Ų6370.3 Ų70.333%0.3333%0.334SS..Hα-helixtrans-63.5-42.5170.8-73.7172.5000111.2E359 Q366 A367E359-L363 HydrophobicContact CG-CD1 4.2Å; E359-L363 WeakPolarHBondContact O-CB 3.41Å; E359-L363 WeakPolarHBondContact O-CG 3.44Å; E359-L363 PolarHBondContact O-N 3.25Å; L363-Q366 PolarHBondContact O-N 3.27Å; L363-A367 VanDerWaalsContact O-CB 3.27Å; L363-A367 WeakPolarHBondContact O-CB 3.46Å; L363-A367 PolarHBondContact O-N 3.18Å
364A97.8Very high97.1Very high0 Ų071.1 Ų71.10%034%0.339CS..Hα-helixtrans-60.5-47.3175.600000112.1W356 E360 Q361 Q366 A367 I368 I382 F393W356-A364 HydrophobicContact CH2-CB 4.44Å; W356-A364 HydrophobicContact CZ3-CB 3.98Å; E360-A364 VanDerWaalsContact O-CB 3.31Å; E360-A364 WeakPolarHBondContact O-CB 3.47Å; E360-A364 PolarHBondContact O-N 3.26Å; Q361-A364 PolarHBondContact O-N 3.01Å; A364-Q366 PolarHBondContact O-N 3.35Å; A364-A367 PolarHBondContact O-N 3.02Å; A364-I368 WeakPolarHBondContact O-CG1 3.33Å; A364-I368 PolarHBondContact O-N 3.1Å; A364-I382 HydrophobicContact CB-CD1 3.77Å; A364-F393 HydrophobicContact CB-CD1 3.96Å; A364-F393 HydrophobicContact CB-CE1 3.53Å; A364-F393 HydrophobicContact CB-CZ 3.85Å
365V97.9Very high97.2Very high29 Ų2967.6 Ų67.618%0.17631%0.313CS..Hα-helixtrans-61.1-44.1177.9175.60000111.7Q361 A367 I368 R369 F393 F401 L403 V406Q361-V365 WeakPolarHBondContact O-CG2 3.39Å; Q361-V365 PolarHBondContact O-N 2.86Å; V365-A367 PolarHBondContact O-N 3.02Å; V365-I368 PolarHBondContact O-N 2.96Å; V365-R369 PolarHBondContact O-N 2.96Å; V365-F393 HydrophobicContact CG2-CZ 4.33Å; V365-F401 HydrophobicContact CG2-CB 3.71Å; V365-F401 HydrophobicContact CG2-CD1 4.43Å; V365-F401 HydrophobicContact CG2-CD2 3.63Å; V365-F401 HydrophobicContact CG2-CE2 4.32Å; V365-F401 HydrophobicContact CG2-CG 3.7Å; V365-L403 HydrophobicContact CG2-CD2 4.13Å; V365-V406 HydrophobicContact CG1-CG2 4.47Å
366Q97.5Very high97.3Very high126 Ų12663.2 Ų63.259%0.58930%0.301SS*.Hα-helixtrans-64.4-38.2175.9-73.3168.892.200112.6L362 L363 A364 R369 K370L362-Q366 WeakPolarHBondContact O-CG 3.4Å; L362-Q366 PolarHBondContact O-N 2.61Å; L362-Q366 VanDerWaalsContact O-N 3.11Å; L362-Q366 PolarHBondContact O-NE2 3.28Å; L363-Q366 PolarHBondContact O-N 3.27Å; A364-Q366 PolarHBondContact O-N 3.35Å; Q366-R369 PolarHBondContact O-N 3.22Å; Q366-K370 WeakPolarHBondContact O-CB 3.45Å; Q366-K370 PolarHBondContact O-N 3.12Å
367A97.8Very high97.3Very high3 Ų362 Ų623%0.02530%0.3CS..Hα-helixtrans-67.8-40.7175.700000111.4L363 A364 V365 R369 K370 Y371 I378 V381L363-A367 VanDerWaalsContact O-CB 3.27Å; L363-A367 WeakPolarHBondContact O-CB 3.46Å; L363-A367 PolarHBondContact O-N 3.18Å; A364-A367 PolarHBondContact O-N 3.02Å; V365-A367 PolarHBondContact O-N 3.02Å; A367-R369 VanDerWaalsContact C-N 3.31Å; A367-R369 PolarHBondContact O-N 3.17Å; A367-K370 PolarHBondContact O-N 3.2Å; A367-K370 VanDerWaalsContact O-N 3.11Å; A367-Y371 HydrophobicContact CB-CD2 4.18Å; A367-Y371 WeakPolarHBondContact O-CB 3.43Å; A367-Y371 VanDerWaalsContact O-CD2 3.26Å; A367-Y371 WeakPolarHBondContact O-CD2 3.43Å; A367-Y371 PolarHBondContact O-N 2.76Å; A367-I378 HydrophobicContact CB-CB 4.22Å; A367-I378 HydrophobicContact CB-CG1 3.88Å; A367-I378 HydrophobicContact CB-CG2 3.96Å; A367-V381 HydrophobicContact CB-CB 4.43Å; A367-V381 HydrophobicContact CB-CG1 4.11Å
368I97Very high97.3Very high0 Ų059.5 Ų59.50%028%0.284CS..Hα-helixtrans-59.3-44.1172.8-66.2168000110.4A364 V365 K370 G372 I378 F393 F394 L403 V406 L407A364-I368 WeakPolarHBondContact O-CG1 3.33Å; A364-I368 PolarHBondContact O-N 3.1Å; V365-I368 PolarHBondContact O-N 2.96Å; I368-K370 PolarHBondContact O-N 3.3Å; I368-G372 VanDerWaalsContact O-CA 3.26Å; I368-G372 WeakPolarHBondContact O-CA 3.45Å; I368-G372 PolarHBondContact O-N 3.27Å; I368-I378 HydrophobicContact CG1-CD1 3.87Å; I368-F393 HydrophobicContact CD1-CD1 4.18Å; I368-F393 HydrophobicContact CD1-CE1 3.95Å; I368-F394 HydrophobicContact CB-CZ 4.14Å; I368-F394 HydrophobicContact CD1-CD1 4.36Å; I368-F394 HydrophobicContact CD1-CD2 4.07Å; I368-F394 HydrophobicContact CD1-CE1 3.93Å; I368-F394 HydrophobicContact CD1-CE2 3.63Å; I368-F394 HydrophobicContact CD1-CG 4.45Å; I368-F394 HydrophobicContact CD1-CZ 3.59Å; I368-F394 HydrophobicContact CG1-CE1 4.13Å; I368-F394 HydrophobicContact CG1-CE2 3.61Å; I368-F394 HydrophobicContact CG1-CZ 3.41Å; I368-F394 VanDerWaalsContact CG1-CZ 3.41Å; I368-F394 HydrophobicContact CG2-CE1 3.8Å; I368-F394 HydrophobicContact CG2-CZ 3.67Å; I368-L403 HydrophobicContact CD1-CD1 4.16Å; I368-L403 HydrophobicContact CD1-CD2 3.9Å; I368-V406 HydrophobicContact CB-CG1 4.45Å; I368-V406 HydrophobicContact CG2-CG1 4.01Å; I368-L407 HydrophobicContact CG2-CD2 4.05Å; I368-L407 HydrophobicContact CG2-CG 4.18Å
369R96.3Very high97.3Very high62 Ų6254.7 Ų54.723%0.23426%0.255CS..Hα-helixtrans-63.1-22.3177.1-173.649-175.977.8-0.9114.4V365 Q366 A367 V406 E409 E413V365-R369 PolarHBondContact O-N 2.96Å; Q366-R369 PolarHBondContact O-N 3.22Å; A367-R369 VanDerWaalsContact C-N 3.31Å; A367-R369 PolarHBondContact O-N 3.17Å; R369-V406 HydrophobicContact CB-CG1 3.62Å; R369-V406 HydrophobicContact CG-CG1 4.27Å; R369-E409 IonicContact CZ-OE2 2.65Å; R369-E409 VanDerWaalsContact CZ-OE2 3.27Å; R369-E409 VanDerWaalsContact NE-CB 3.31Å; R369-E409 IonicContact NE-OE2 3.34Å; R369-E409 PolarHBondContact NE-OE2 3.02Å; R369-E409 IonicContact NH2-OE2 3.64Å; R369-E409 PolarHBondContact NH2-OE2 3.06Å; R369-E413 IonicContact CZ-OE1 3.81Å; R369-E413 IonicContact CZ-OE2 2.88Å; R369-E413 IonicContact NH1-OE1 2.67Å; R369-E413 PolarHBondContact NH1-OE1 2.79Å; R369-E413 IonicContact NH1-OE2 2.71Å; R369-E413 PolarHBondContact NH1-OE2 3.19Å; R369-E413 IonicContact NH2-OE1 3.15Å; R369-E413 PolarHBondContact NH2-OE1 3.08Å; R369-E413 IonicContact NH2-OE2 3.03Å
370K96.2Very high97.2Very high130 Ų13052.9 Ų52.957%0.56525%0.25SS*.Hα-helixtrans-103.5-32.4-175.7-175.6170.3179.761.20114.2Q366 A367 I368 W410Q366-K370 WeakPolarHBondContact O-CB 3.45Å; Q366-K370 PolarHBondContact O-N 3.12Å; A367-K370 PolarHBondContact O-N 3.2Å; A367-K370 VanDerWaalsContact O-N 3.11Å; I368-K370 PolarHBondContact O-N 3.3Å; K370-W410 VanDerWaalsContact C-CD1 3.5Å; K370-W410 PolarHBondContact O-NE1 3.08Å; K370-W410 VanDerWaalsContact O-NE1 3.11Å
371Y96.8Very high97.2Very high81 Ų8155.4 Ų55.432%0.31827%0.266SS..Hα-helixtrans-120.10.7-172.7-57.3-76.6000113A367 R373 D374 A377 V381A367-Y371 HydrophobicContact CB-CD2 4.18Å; A367-Y371 WeakPolarHBondContact O-CB 3.43Å; A367-Y371 VanDerWaalsContact O-CD2 3.26Å; A367-Y371 WeakPolarHBondContact O-CD2 3.43Å; A367-Y371 PolarHBondContact O-N 2.76Å; Y371-R373 PolarHBondContact O-N 2.94Å; Y371-D374 PolarHBondContact O-N 3.01Å; Y371-A377 HydrophobicContact CD1-CB 3.79Å; Y371-A377 HydrophobicContact CD2-CB 4.45Å; Y371-A377 HydrophobicContact CE1-CB 4.27Å; Y371-A377 HydrophobicContact CG-CB 3.9Å; Y371-V381 HydrophobicContact CE2-CG2 3.88Å
372G95.8Very high97.1Very high0 Ų054.6 Ų54.60%026%0.263CS..THydrogen-bonded Turntrans61.3-107.4176.800000112.1I368 F394 W410I368-G372 VanDerWaalsContact O-CA 3.26Å; I368-G372 WeakPolarHBondContact O-CA 3.45Å; I368-G372 PolarHBondContact O-N 3.27Å; G372-F394 WeakPolarHBondContact O-CZ 3.34Å; G372-W410 VanDerWaalsContact CA-CD2 3.41Å
373R96.3Very high97Very high121 Ų12151.4 Ų51.446%0.45725%0.252SS..THydrogen-bonded Turntrans-111.215.8179.7-59-178.3-169.778.4-5.1113.5Y371 F375 L407 E411Y371-R373 PolarHBondContact O-N 2.94Å; R373-F375 HydrophobicContact CB-CE2 4.4Å; R373-F375 HydrophobicContact CB-CZ 4.18Å; R373-F375 WeakPolarHBondContact O-CD2 3.39Å; R373-F375 WeakPolarHBondContact O-CE2 3.28Å; R373-F375 PolarHBondContact O-N 3.4Å; R373-L407 HydrophobicContact CG-CD2 3.72Å; R373-E411 IonicContact CZ-OE1 2.78Å; R373-E411 IonicContact NH1-OE1 3.69Å; R373-E411 PolarHBondContact NH1-OE1 2.92Å; R373-E411 IonicContact NH2-OE1 2.56Å; R373-E411 PolarHBondContact NH2-OE1 3.26Å
374D97.4Very high96.9Very high83 Ų8349.4 Ų49.444%0.44424%0.242SC..  trans-72.684.2166.9-169.9-20.2000110.2Y371 Q376 A377 I378Y371-D374 PolarHBondContact O-N 3.01Å; D374-Q376 PolarHBondContact O-N 2.81Å; D374-Q376 VanDerWaalsContact O-N 3.16Å; D374-Q376 WeakPolarHBondContact OD1-CA 3.31Å; D374-Q376 WeakPolarHBondContact OD1-CB 3.47Å; D374-Q376 PolarHBondContact OD1-N 2.84Å; D374-A377 HydrophobicContact CB-CB 4.06Å; D374-A377 PolarHBondContact O-N 3.49Å; D374-A377 PolarHBondContact OD1-N 3.1Å; D374-I378 WeakPolarHBondContact O-CD1 3.3Å; D374-I378 VanDerWaalsContact O-CG1 3.25Å; D374-I378 WeakPolarHBondContact O-CG1 3.48Å; D374-I378 PolarHBondContact O-N 3.48Å
375F97.6Very high96.9Very high51 Ų5149.4 Ų49.422%0.22424%0.242CC..Hα-helixtrans-63-16.3178.6-51.8-69.7000113.4R373 S379 V387 V390 K391 F394R373-F375 HydrophobicContact CB-CE2 4.4Å; R373-F375 HydrophobicContact CB-CZ 4.18Å; R373-F375 WeakPolarHBondContact O-CD2 3.39Å; R373-F375 WeakPolarHBondContact O-CE2 3.28Å; R373-F375 PolarHBondContact O-N 3.4Å; F375-S379 WeakPolarHBondContact O-CB 3.37Å; F375-S379 PolarHBondContact O-N 3.46Å; F375-S379 VanDerWaalsContact O-N 3.16Å; F375-V387 HydrophobicContact CB-CG1 3.78Å; F375-V390 HydrophobicContact CB-CG1 4.49Å; F375-V390 HydrophobicContact CD1-CG1 4.12Å; F375-K391 HydrophobicContact CB-CG 4.48Å; F375-K391 HydrophobicContact CD1-CG 3.87Å; F375-K391 HydrophobicContact CD2-CD 4.44Å; F375-K391 HydrophobicContact CD2-CG 4.07Å; F375-K391 HydrophobicContact CE1-CG 4.04Å; F375-K391 HydrophobicContact CE2-CG 4.23Å; F375-K391 HydrophobicContact CG-CG 3.89Å; F375-K391 HydrophobicContact CZ-CG 4.21Å; F375-F394 AromaticContact CD1-CD2 3.95Å; F375-F394 HydrophobicContact CD1-CD2 3.95Å; F375-F394 AromaticContact CD1-CE2 3.69Å; F375-F394 HydrophobicContact CD1-CE2 3.69Å; F375-F394 AromaticContact CE1-CD2 3.56Å; F375-F394 HydrophobicContact CE1-CD2 3.56Å; F375-F394 AromaticContact CE1-CE2 3.46Å; F375-F394 HydrophobicContact CE1-CE2 3.46Å; F375-F394 VanDerWaalsContact CE1-CE2 3.46Å; F375-F394 HydrophobicContact CE1-CG 4.21Å; F375-F394 HydrophobicContact CE1-CZ 4.04Å
376Q97.9Very high96.9Very high98 Ų9849.6 Ų49.646%0.45825%0.245SC..Hα-helixtrans-80.6-52.8175.3-176.461.259.400109.8D374 I378 S379 D380 V387D374-Q376 PolarHBondContact O-N 2.81Å; D374-Q376 VanDerWaalsContact O-N 3.16Å; D374-Q376 WeakPolarHBondContact OD1-CA 3.31Å; D374-Q376 WeakPolarHBondContact OD1-CB 3.47Å; D374-Q376 PolarHBondContact OD1-N 2.84Å; Q376-I378 PolarHBondContact O-N 3.2Å; Q376-S379 CarbonylContact O-C 3.6Å; Q376-S379 WeakPolarHBondContact O-CA 3.29Å; Q376-S379 WeakPolarHBondContact O-CB 3.48Å; Q376-S379 PolarHBondContact O-N 2.95Å; Q376-D380 VanDerWaalsContact NE2-CG 3.29Å; Q376-D380 PolarHBondContact NE2-OD1 3.37Å; Q376-D380 PolarHBondContact NE2-OD2 3.42Å; Q376-D380 VanDerWaalsContact NE2-OD2 3.07Å; Q376-D380 VanDerWaalsContact O-CG 3.22Å; Q376-D380 PolarHBondContact O-N 3.37Å; Q376-V387 VanDerWaalsContact OE1-CG2 3.3Å
377A97.8Very high96.9Very high18 Ų1845.7 Ų45.715%0.14923%0.229CC..Hα-helixtrans-56.1-38.7174.900000112.3Y371 D374 D380 V381Y371-A377 HydrophobicContact CD1-CB 3.79Å; Y371-A377 HydrophobicContact CD2-CB 4.45Å; Y371-A377 HydrophobicContact CE1-CB 4.27Å; Y371-A377 HydrophobicContact CG-CB 3.9Å; D374-A377 HydrophobicContact CB-CB 4.06Å; D374-A377 PolarHBondContact O-N 3.49Å; D374-A377 PolarHBondContact OD1-N 3.1Å; A377-D380 PolarHBondContact O-N 3.18Å; A377-V381 WeakPolarHBondContact O-CB 3.46Å; A377-V381 VanDerWaalsContact O-CG2 3.29Å; A377-V381 WeakPolarHBondContact O-CG2 3.25Å; A377-V381 PolarHBondContact O-N 3.17Å
378I97.8Very high96.9Very high0 Ų050 Ų500%026%0.255CS..Hα-helixtrans-67.5-38.4173.8-61.7160.8000111.5A367 I368 D374 Q376 D380 I382 V390 F394A367-I378 HydrophobicContact CB-CB 4.22Å; A367-I378 HydrophobicContact CB-CG1 3.88Å; A367-I378 HydrophobicContact CB-CG2 3.96Å; I368-I378 HydrophobicContact CG1-CD1 3.87Å; D374-I378 WeakPolarHBondContact O-CD1 3.3Å; D374-I378 VanDerWaalsContact O-CG1 3.25Å; D374-I378 WeakPolarHBondContact O-CG1 3.48Å; D374-I378 PolarHBondContact O-N 3.48Å; Q376-I378 PolarHBondContact O-N 3.2Å; I378-D380 VanDerWaalsContact C-N 3.33Å; I378-I382 HydrophobicContact CG2-CD1 3.88Å; I378-I382 WeakPolarHBondContact O-CD1 3.43Å; I378-I382 VanDerWaalsContact O-CG1 3.28Å; I378-I382 WeakPolarHBondContact O-CG1 3.43Å; I378-I382 PolarHBondContact O-N 3.46Å; I378-V390 HydrophobicContact CB-CG1 3.98Å; I378-V390 HydrophobicContact CG2-CB 4.5Å; I378-V390 HydrophobicContact CG2-CG1 3.46Å; I378-V390 VanDerWaalsContact CG2-CG1 3.46Å; I378-V390 HydrophobicContact CG2-CG2 4.17Å; I378-F394 HydrophobicContact CD1-CE2 4.05Å; I378-F394 HydrophobicContact CD1-CZ 4.31Å
379S97.1Very high96.9Very high5 Ų551.6 Ų51.64%0.03526%0.262CS..Hα-helixtrans-58.8-45.9173.5-148.60000111.2F375 Q376 I382 G383 K385 S386 V387F375-S379 WeakPolarHBondContact O-CB 3.37Å; F375-S379 PolarHBondContact O-N 3.46Å; F375-S379 VanDerWaalsContact O-N 3.16Å; Q376-S379 CarbonylContact O-C 3.6Å; Q376-S379 WeakPolarHBondContact O-CA 3.29Å; Q376-S379 WeakPolarHBondContact O-CB 3.48Å; Q376-S379 PolarHBondContact O-N 2.95Å; S379-I382 PolarHBondContact O-N 3.39Å; S379-G383 PolarHBondContact O-N 3.04Å; S379-K385 PolarHBondContact OG-O 3.48Å; S379-S386 VanDerWaalsContact OG-CA 3.3Å; S379-S386 WeakPolarHBondContact OG-CA 3.41Å; S379-V387 PolarHBondContact OG-N 2.93Å
380D96.2Very high97Very high104 Ų10448.6 Ų48.656%0.55625%0.251SS*.Hα-helixtrans-73.5-36.2-173.4-60.5-29.2000112Q376 A377 I378 I382 G383Q376-D380 VanDerWaalsContact NE2-CG 3.29Å; Q376-D380 PolarHBondContact NE2-OD1 3.37Å; Q376-D380 PolarHBondContact NE2-OD2 3.42Å; Q376-D380 VanDerWaalsContact NE2-OD2 3.07Å; Q376-D380 VanDerWaalsContact O-CG 3.22Å; Q376-D380 PolarHBondContact O-N 3.37Å; A377-D380 PolarHBondContact O-N 3.18Å; I378-D380 VanDerWaalsContact C-N 3.33Å; D380-I382 VanDerWaalsContact C-N 3.34Å; D380-G383 PolarHBondContact O-N 3.36Å
381V96.1Very high97.1Very high67 Ų6746.9 Ų46.941%0.40624%0.244SC..Hα-helixtrans-66.3-33.5173.8166.90000112.5A367 Y371 A377A367-V381 HydrophobicContact CB-CB 4.43Å; A367-V381 HydrophobicContact CB-CG1 4.11Å; Y371-V381 HydrophobicContact CE2-CG2 3.88Å; A377-V381 WeakPolarHBondContact O-CB 3.46Å; A377-V381 VanDerWaalsContact O-CG2 3.29Å; A377-V381 WeakPolarHBondContact O-CG2 3.25Å; A377-V381 PolarHBondContact O-N 3.17Å
382I96.4Very high97.1Very high12 Ų1247.1 Ų47.16%0.06225%0.251CS..Hα-helixtrans-82.6-27.1174.8-55.1160.4000110.9W356 E360 A364 I378 S379 D380 N384 K385 V390W356-I382 HydrophobicContact CH2-CD1 4Å; W356-I382 HydrophobicContact CZ3-CD1 4.06Å; E360-I382 HydrophobicContact CB-CG2 4.31Å; E360-I382 HydrophobicContact CG-CG2 4.26Å; A364-I382 HydrophobicContact CB-CD1 3.77Å; I378-I382 HydrophobicContact CG2-CD1 3.88Å; I378-I382 WeakPolarHBondContact O-CD1 3.43Å; I378-I382 VanDerWaalsContact O-CG1 3.28Å; I378-I382 WeakPolarHBondContact O-CG1 3.43Å; I378-I382 PolarHBondContact O-N 3.46Å; S379-I382 PolarHBondContact O-N 3.39Å; D380-I382 VanDerWaalsContact C-N 3.34Å; I382-N384 PolarHBondContact O-N 3.11Å; I382-K385 HydrophobicContact CB-CB 4.4Å; I382-K385 HydrophobicContact CB-CG 4.37Å; I382-K385 HydrophobicContact CG2-CB 4.05Å; I382-K385 HydrophobicContact CG2-CG 3.52Å; I382-V390 HydrophobicContact CD1-CG2 4.23Å
383G95.3Very high97.2Very high26 Ų2647.2 Ų47.227%0.26825%0.251SS..SBendtrans71.1-32.1172.700000116.1S379 D380S379-G383 PolarHBondContact O-N 3.04Å; D380-G383 PolarHBondContact O-N 3.36Å
384N96.6Very high97.2Very high21 Ų2142.6 Ų42.611%0.11223%0.234CC..SBendtrans-11511.9-177.77918.5000114.2Q350 F352 N353 E360 I382Q350-N384 HydrophobicContact CB-CB 4.32Å; F352-N384 CarbonylContact C-O 3.56Å; F352-N384 VanDerWaalsContact CA-O 3.29Å; F352-N384 WeakPolarHBondContact CA-O 3.26Å; N353-N384 PolarHBondContact N-O 3.21Å; E360-N384 PolarHBondContact OE1-ND2 3.15Å; E360-N384 PolarHBondContact OE1-OD1 3.44Å; I382-N384 PolarHBondContact O-N 3.11Å
385K97.6Very high97.2Very high0 Ų043.3 Ų43.30%024%0.241CC..SBendtrans-118.7143.3172.4-61.3-67.1179.6-79.50109.1F352 N353 R355 W356 E360 S379 I382 Q389 V390F352-K385 VanDerWaalsContact CD1-C 3.46Å; F352-K385 WeakPolarHBondContact CE1-O 3.32Å; N353-K385 WeakPolarHBondContact O-CD 3.32Å; R355-K385 WeakPolarHBondContact O-CE 3.32Å; R355-K385 PolarHBondContact O-NZ 3.42Å; W356-K385 HydrophobicContact CD2-CD 4.15Å; W356-K385 VanDerWaalsContact CD2-CE 3.46Å; W356-K385 HydrophobicContact CE3-CD 4.38Å; W356-K385 HydrophobicContact CE3-CG 4.45Å; W356-K385 HydrophobicContact CH2-CB 4.21Å; W356-K385 HydrophobicContact CH2-CD 3.98Å; W356-K385 HydrophobicContact CH2-CG 3.64Å; W356-K385 HydrophobicContact CZ2-CB 4.38Å; W356-K385 HydrophobicContact CZ2-CD 3.68Å; W356-K385 HydrophobicContact CZ2-CG 3.85Å; W356-K385 HydrophobicContact CZ3-CD 4.31Å; W356-K385 HydrophobicContact CZ3-CG 3.95Å; E360-K385 IonicContact OE1-NZ 2.97Å; E360-K385 PolarHBondContact OE1-NZ 2.88Å; E360-K385 VanDerWaalsContact OE1-NZ 3.07Å; E360-K385 WeakPolarHBondContact OE2-CE 3.44Å; E360-K385 IonicContact OE2-NZ 3.27Å; E360-K385 PolarHBondContact OE2-NZ 3.23Å; S379-K385 PolarHBondContact OG-O 3.48Å; I382-K385 HydrophobicContact CB-CB 4.4Å; I382-K385 HydrophobicContact CB-CG 4.37Å; I382-K385 HydrophobicContact CG2-CB 4.05Å; I382-K385 HydrophobicContact CG2-CG 3.52Å; K385-Q389 HydrophobicContact CB-CB 4.45Å; K385-Q389 HydrophobicContact CD-CB 4.47Å; K385-V390 HydrophobicContact CB-CG2 4.35Å
386S97.1Very high97.1Very high34 Ų3445.9 Ų45.924%0.23826%0.258CS..  trans-91.3158.8173.574.80000111.8S379 V388 Q389 V390S379-S386 VanDerWaalsContact OG-CA 3.3Å; S379-S386 WeakPolarHBondContact OG-CA 3.41Å; S386-V388 PolarHBondContact O-N 3.43Å; S386-Q389 WeakPolarHBondContact O-CA 3.34Å; S386-Q389 WeakPolarHBondContact O-CB 3.46Å; S386-Q389 PolarHBondContact O-N 2.99Å; S386-Q389 PolarHBondContact OG-OE1 2.9Å; S386-V390 PolarHBondContact O-N 3.26Å
387V97.8Very high97Very high43 Ų4342.9 Ų42.926%0.26124%0.242SC..Hα-helixtrans-47-39.2177.2179.50000112.9F375 Q376 S379 V390 K391F375-V387 HydrophobicContact CB-CG1 3.78Å; Q376-V387 VanDerWaalsContact OE1-CG2 3.3Å; S379-V387 PolarHBondContact OG-N 2.93Å; V387-V390 PolarHBondContact O-N 3.2Å; V387-K391 WeakPolarHBondContact O-CG 3.43Å; V387-K391 PolarHBondContact O-N 2.84Å
388V97.7Very high96.8Very high95 Ų9548.3 Ų48.358%0.57626%0.259SS*.Hα-helixtrans-68.8-39.1177.6-178.80000111.6S386 V390 K391 N392S386-V388 PolarHBondContact O-N 3.43Å; V388-V390 VanDerWaalsContact C-N 3.34Å; V388-K391 PolarHBondContact O-N 3.35Å; V388-N392 WeakPolarHBondContact O-CB 3.28Å; V388-N392 VanDerWaalsContact O-CG 3.23Å; V388-N392 PolarHBondContact O-N 2.95Å; V388-N392 PolarHBondContact O-ND2 2.98Å
389Q97.7Very high96.8Very high32 Ų3259.4 Ų59.415%0.1530%0.301CS..Hα-helixtrans-67.8-36175.1-61.1175.6-70.400111.5N353 W356 K385 S386 N392 F393N353-Q389 PolarHBondContact O-NE2 3.48Å; W356-Q389 HydrophobicContact CZ2-CB 4.39Å; K385-Q389 HydrophobicContact CB-CB 4.45Å; K385-Q389 HydrophobicContact CD-CB 4.47Å; S386-Q389 WeakPolarHBondContact O-CA 3.34Å; S386-Q389 WeakPolarHBondContact O-CB 3.46Å; S386-Q389 PolarHBondContact O-N 2.99Å; S386-Q389 PolarHBondContact OG-OE1 2.9Å; Q389-N392 PolarHBondContact O-N 3.46Å; Q389-F393 WeakPolarHBondContact O-CB 3.43Å; Q389-F393 PolarHBondContact O-N 3.49Å
390V98.2Very high96.7Very high0 Ų066.2 Ų66.20%033%0.326CS..Hα-helixtrans-65.2-47.3173.6178.20000111F375 I378 I382 K385 S386 V387 V388 N392 F393 F394F375-V390 HydrophobicContact CB-CG1 4.49Å; F375-V390 HydrophobicContact CD1-CG1 4.12Å; I378-V390 HydrophobicContact CB-CG1 3.98Å; I378-V390 HydrophobicContact CG2-CB 4.5Å; I378-V390 HydrophobicContact CG2-CG1 3.46Å; I378-V390 VanDerWaalsContact CG2-CG1 3.46Å; I378-V390 HydrophobicContact CG2-CG2 4.17Å; I382-V390 HydrophobicContact CD1-CG2 4.23Å; K385-V390 HydrophobicContact CB-CG2 4.35Å; S386-V390 PolarHBondContact O-N 3.26Å; V387-V390 PolarHBondContact O-N 3.2Å; V388-V390 VanDerWaalsContact C-N 3.34Å; V390-N392 VanDerWaalsContact C-N 3.29Å; V390-N392 PolarHBondContact O-N 2.92Å; V390-F393 WeakPolarHBondContact O-CB 3.46Å; V390-F393 PolarHBondContact O-N 2.9Å; V390-F394 HydrophobicContact CG1-CD2 4.28Å; V390-F394 HydrophobicContact CG1-CE2 4.25Å; V390-F394 PolarHBondContact O-N 2.82Å
391K97.6Very high96.6Very high94 Ų9464.1 Ų64.141%0.40931%0.312SS..Hα-helixtrans-56.8-42.3173.2-75.5-172.2173.2-163.10112.2F375 V387 V388 F393 F394 V395F375-K391 HydrophobicContact CB-CG 4.48Å; F375-K391 HydrophobicContact CD1-CG 3.87Å; F375-K391 HydrophobicContact CD2-CD 4.44Å; F375-K391 HydrophobicContact CD2-CG 4.07Å; F375-K391 HydrophobicContact CE1-CG 4.04Å; F375-K391 HydrophobicContact CE2-CG 4.23Å; F375-K391 HydrophobicContact CG-CG 3.89Å; F375-K391 HydrophobicContact CZ-CG 4.21Å; V387-K391 WeakPolarHBondContact O-CG 3.43Å; V387-K391 PolarHBondContact O-N 2.84Å; V388-K391 PolarHBondContact O-N 3.35Å; K391-F393 VanDerWaalsContact C-N 3.34Å; K391-F393 PolarHBondContact O-N 3.39Å; K391-F394 WeakPolarHBondContact O-CB 3.28Å; K391-F394 PolarHBondContact O-N 2.96Å; K391-V395 PolarHBondContact O-N 3.39Å
392N97.4Very high96.6Very high86 Ų8664.6 Ų64.646%0.4631%0.312SS..Hα-helixtrans-68-31.3175.5-69.9-14.7000112.7V388 Q389 V390 N396V388-N392 WeakPolarHBondContact O-CB 3.28Å; V388-N392 VanDerWaalsContact O-CG 3.23Å; V388-N392 PolarHBondContact O-N 2.95Å; V388-N392 PolarHBondContact O-ND2 2.98Å; Q389-N392 PolarHBondContact O-N 3.46Å; V390-N392 VanDerWaalsContact C-N 3.29Å; V390-N392 PolarHBondContact O-N 2.92Å; N392-N396 VanDerWaalsContact O-CB 3.26Å; N392-N396 WeakPolarHBondContact O-CB 3.43Å; N392-N396 VanDerWaalsContact O-CG 3.24Å; N392-N396 PolarHBondContact O-N 3.31Å; N392-N396 PolarHBondContact O-ND2 3.21Å
393F97.8Very high96.6Very high1 Ų164.1 Ų64.10%0.00431%0.309CS..Hα-helixtrans-64.1-46.1173.3174.7-96.3000111.3W356 Q361 A364 V365 I368 Q389 V390 K391 V395 N396 Y397 F401 L403W356-F393 HydrophobicContact CD2-CD2 4.13Å; W356-F393 HydrophobicContact CE3-CD2 4.1Å; W356-F393 HydrophobicContact CE3-CE2 4.42Å; W356-F393 HydrophobicContact CH2-CB 3.89Å; W356-F393 HydrophobicContact CH2-CD2 4.1Å; W356-F393 AromaticContact CH2-CG 3.97Å; W356-F393 HydrophobicContact CH2-CG 3.97Å; W356-F393 HydrophobicContact CZ2-CB 3.61Å; W356-F393 HydrophobicContact CZ2-CD2 4.14Å; W356-F393 HydrophobicContact CZ2-CG 4.08Å; W356-F393 HydrophobicContact CZ3-CD2 4.08Å; W356-F393 HydrophobicContact CZ3-CE2 4.5Å; W356-F393 HydrophobicContact CZ3-CG 4.33Å; Q361-F393 HydrophobicContact CB-CE2 4.25Å; Q361-F393 HydrophobicContact CB-CZ 4.49Å; Q361-F393 HydrophobicContact CG-CE2 3.93Å; A364-F393 HydrophobicContact CB-CD1 3.96Å; A364-F393 HydrophobicContact CB-CE1 3.53Å; A364-F393 HydrophobicContact CB-CZ 3.85Å; V365-F393 HydrophobicContact CG2-CZ 4.33Å; I368-F393 HydrophobicContact CD1-CD1 4.18Å; I368-F393 HydrophobicContact CD1-CE1 3.95Å; Q389-F393 WeakPolarHBondContact O-CB 3.43Å; Q389-F393 PolarHBondContact O-N 3.49Å; V390-F393 WeakPolarHBondContact O-CB 3.46Å; V390-F393 PolarHBondContact O-N 2.9Å; K391-F393 VanDerWaalsContact C-N 3.34Å; K391-F393 PolarHBondContact O-N 3.39Å; F393-V395 VanDerWaalsContact C-N 3.31Å; F393-V395 PolarHBondContact O-N 2.84Å; F393-N396 PolarHBondContact O-N 3.03Å; F393-Y397 HydrophobicContact CD2-CD1 4.37Å; F393-Y397 AromaticContact CD2-CD2 3.27Å; F393-Y397 HydrophobicContact CD2-CD2 3.27Å; F393-Y397 AromaticContact CD2-CE2 3.6Å; F393-Y397 HydrophobicContact CD2-CE2 3.6Å; F393-Y397 AromaticContact CD2-CG 3.7Å; F393-Y397 HydrophobicContact CD2-CG 3.7Å; F393-Y397 AromaticContact CE2-CD1 3.76Å; F393-Y397 HydrophobicContact CE2-CD1 3.76Å; F393-Y397 AromaticContact CE2-CD2 3.52Å; F393-Y397 HydrophobicContact CE2-CD2 3.52Å; F393-Y397 HydrophobicContact CE2-CE1 4.09Å; F393-Y397 AromaticContact CE2-CE2 3.91Å; F393-Y397 HydrophobicContact CE2-CE2 3.91Å; F393-Y397 AromaticContact CE2-CG 3.43Å; F393-Y397 HydrophobicContact CE2-CG 3.43Å; F393-Y397 VanDerWaalsContact CE2-CG 3.43Å; F393-Y397 HydrophobicContact CG-CD2 4.07Å; F393-Y397 HydrophobicContact CZ-CD1 4.45Å; F393-Y397 HydrophobicContact CZ-CG 4.11Å; F393-Y397 WeakPolarHBondContact O-CB 3.45Å; F393-Y397 WeakPolarHBondContact O-CD2 3.37Å; F393-Y397 PolarHBondContact O-N 3.11Å; F393-F401 HydrophobicContact CE2-CD2 4.27Å; F393-F401 AromaticContact CE2-CE2 3.93Å; F393-F401 HydrophobicContact CE2-CE2 3.93Å; F393-F401 AromaticContact CZ-CD2 3.68Å; F393-F401 HydrophobicContact CZ-CD2 3.68Å; F393-F401 AromaticContact CZ-CE2 3.7Å; F393-F401 HydrophobicContact CZ-CE2 3.7Å; F393-L403 HydrophobicContact CE1-CD1 4.35Å
394F96.3Very high96.6Very high24 Ų2466.2 Ų66.211%0.10531%0.314CS..Hα-helixtrans-50.3-49.6174.6-95-89.8000112.3I368 G372 F375 I378 V390 K391 R398 L403 L407I368-F394 HydrophobicContact CB-CZ 4.14Å; I368-F394 HydrophobicContact CD1-CD1 4.36Å; I368-F394 HydrophobicContact CD1-CD2 4.07Å; I368-F394 HydrophobicContact CD1-CE1 3.93Å; I368-F394 HydrophobicContact CD1-CE2 3.63Å; I368-F394 HydrophobicContact CD1-CG 4.45Å; I368-F394 HydrophobicContact CD1-CZ 3.59Å; I368-F394 HydrophobicContact CG1-CE1 4.13Å; I368-F394 HydrophobicContact CG1-CE2 3.61Å; I368-F394 HydrophobicContact CG1-CZ 3.41Å; I368-F394 VanDerWaalsContact CG1-CZ 3.41Å; I368-F394 HydrophobicContact CG2-CE1 3.8Å; I368-F394 HydrophobicContact CG2-CZ 3.67Å; G372-F394 WeakPolarHBondContact O-CZ 3.34Å; F375-F394 AromaticContact CD1-CD2 3.95Å; F375-F394 HydrophobicContact CD1-CD2 3.95Å; F375-F394 AromaticContact CD1-CE2 3.69Å; F375-F394 HydrophobicContact CD1-CE2 3.69Å; F375-F394 AromaticContact CE1-CD2 3.56Å; F375-F394 HydrophobicContact CE1-CD2 3.56Å; F375-F394 AromaticContact CE1-CE2 3.46Å; F375-F394 HydrophobicContact CE1-CE2 3.46Å; F375-F394 VanDerWaalsContact CE1-CE2 3.46Å; F375-F394 HydrophobicContact CE1-CG 4.21Å; F375-F394 HydrophobicContact CE1-CZ 4.04Å; I378-F394 HydrophobicContact CD1-CE2 4.05Å; I378-F394 HydrophobicContact CD1-CZ 4.31Å; V390-F394 HydrophobicContact CG1-CD2 4.28Å; V390-F394 HydrophobicContact CG1-CE2 4.25Å; V390-F394 PolarHBondContact O-N 2.82Å; K391-F394 WeakPolarHBondContact O-CB 3.28Å; K391-F394 PolarHBondContact O-N 2.96Å; F394-R398 WeakPolarHBondContact O-CA 3.5Å; F394-R398 VanDerWaalsContact O-CB 3.29Å; F394-R398 WeakPolarHBondContact O-CB 3.25Å; F394-R398 PolarHBondContact O-N 2.83Å; F394-L403 HydrophobicContact CD1-CD1 4.19Å; F394-L403 HydrophobicContact CG-CD1 4.5Å; F394-L407 HydrophobicContact CE1-CD1 3.91Å; F394-L407 HydrophobicContact CE1-CD2 4.21Å; F394-L407 HydrophobicContact CE1-CG 4.24Å
395V96.4Very high96.6Very high99 Ų9970.3 Ų70.360%0.633%0.333SS*.Hα-helixtrans-67.7-51.5179.3-178.90000111.3K391 F393 Y397K391-V395 PolarHBondContact O-N 3.39Å; F393-V395 VanDerWaalsContact C-N 3.31Å; F393-V395 PolarHBondContact O-N 2.84Å; V395-Y397 VanDerWaalsContact C-N 3.28Å; V395-Y397 PolarHBondContact O-N 3.21Å
396N96.1Very high96.5Very high105 Ų10571.3 Ų71.356%0.56134%0.339SS*.Hα-helixtrans-72-17.4-172-69.3-37.8000114.4N392 F393 R400N392-N396 VanDerWaalsContact O-CB 3.26Å; N392-N396 WeakPolarHBondContact O-CB 3.43Å; N392-N396 VanDerWaalsContact O-CG 3.24Å; N392-N396 PolarHBondContact O-N 3.31Å; N392-N396 PolarHBondContact O-ND2 3.21Å; F393-N396 PolarHBondContact O-N 3.03Å; N396-R400 PolarHBondContact O-NH2 2.84Å
397Y95.7Very high96.4Very high35 Ų3570 Ų7014%0.13733%0.33CS..Hα-helixtrans-120.1-1-178-68-102.9000113.9Q361 F393 V395 R399 R400 F401Q361-Y397 HydrophobicContact CG-CE1 4.41Å; F393-Y397 HydrophobicContact CD2-CD1 4.37Å; F393-Y397 AromaticContact CD2-CD2 3.27Å; F393-Y397 HydrophobicContact CD2-CD2 3.27Å; F393-Y397 AromaticContact CD2-CE2 3.6Å; F393-Y397 HydrophobicContact CD2-CE2 3.6Å; F393-Y397 AromaticContact CD2-CG 3.7Å; F393-Y397 HydrophobicContact CD2-CG 3.7Å; F393-Y397 AromaticContact CE2-CD1 3.76Å; F393-Y397 HydrophobicContact CE2-CD1 3.76Å; F393-Y397 AromaticContact CE2-CD2 3.52Å; F393-Y397 HydrophobicContact CE2-CD2 3.52Å; F393-Y397 HydrophobicContact CE2-CE1 4.09Å; F393-Y397 AromaticContact CE2-CE2 3.91Å; F393-Y397 HydrophobicContact CE2-CE2 3.91Å; F393-Y397 AromaticContact CE2-CG 3.43Å; F393-Y397 HydrophobicContact CE2-CG 3.43Å; F393-Y397 VanDerWaalsContact CE2-CG 3.43Å; F393-Y397 HydrophobicContact CG-CD2 4.07Å; F393-Y397 HydrophobicContact CZ-CD1 4.45Å; F393-Y397 HydrophobicContact CZ-CG 4.11Å; F393-Y397 WeakPolarHBondContact O-CB 3.45Å; F393-Y397 WeakPolarHBondContact O-CD2 3.37Å; F393-Y397 PolarHBondContact O-N 3.11Å; V395-Y397 VanDerWaalsContact C-N 3.28Å; V395-Y397 PolarHBondContact O-N 3.21Å; Y397-R399 PolarHBondContact O-N 3.42Å; Y397-R399 VanDerWaalsContact O-N 3.14Å; Y397-R400 VanDerWaalsContact CD1-NH2 3.25Å; Y397-R400 VanDerWaalsContact CE1-CZ 3.42Å; Y397-R400 VanDerWaalsContact CE1-NH1 3.26Å; Y397-R400 PolarHBondContact O-N 3.22Å; Y397-F401 AromaticContact CD1-CD2 3.87Å; Y397-F401 HydrophobicContact CD1-CD2 3.87Å; Y397-F401 AromaticContact CD1-CE2 3.33Å; Y397-F401 HydrophobicContact CD1-CE2 3.33Å; Y397-F401 HydrophobicContact CD1-CZ 4.09Å; Y397-F401 AromaticContact CE1-CE2 3.99Å; Y397-F401 HydrophobicContact CE1-CE2 3.99Å; Y397-F401 HydrophobicContact CE1-CZ 4.47Å; Y397-F401 HydrophobicContact CG-CD2 4.26Å; Y397-F401 HydrophobicContact CG-CE2 4.09Å; Y397-F401 PolarHBondContact O-N 3.11Å; Y397-F401 VanDerWaalsContact O-N 3.16Å
398R95.1Very high96.2Very high131 Ų13174.2 Ų74.249%0.49435%0.346SS..THydrogen-bonded Turntrans-38.2-57.1-178.7-167.6173.3174.8134.31.2114.4F394 N402 L403 D404F394-R398 WeakPolarHBondContact O-CA 3.5Å; F394-R398 VanDerWaalsContact O-CB 3.29Å; F394-R398 WeakPolarHBondContact O-CB 3.25Å; F394-R398 PolarHBondContact O-N 2.83Å; R398-N402 PolarHBondContact O-N 3.26Å; R398-L403 PolarHBondContact O-N 3.35Å; R398-D404 VanDerWaalsContact CZ-CG 3.49Å; R398-D404 IonicContact CZ-OD1 3.15Å; R398-D404 IonicContact CZ-OD2 3.68Å; R398-D404 VanDerWaalsContact NE-CG 3.29Å; R398-D404 IonicContact NE-OD1 2.99Å; R398-D404 PolarHBondContact NE-OD1 3.42Å; R398-D404 IonicContact NE-OD2 2.6Å; R398-D404 PolarHBondContact NE-OD2 2.9Å; R398-D404 IonicContact NH1-OD1 2.75Å; R398-D404 IonicContact NH2-OD1 2.78Å; R398-D404 PolarHBondContact NH2-OD1 3.26Å; R398-D404 IonicContact NH2-OD2 3.17Å; R398-D404 PolarHBondContact NH2-OD2 3.28Å
399R96.2Very high96Very high234 Ų23474.6 Ų74.688%0.88334%0.342SS*.THydrogen-bonded Turntrans-82.3-9.8-178.1-61.9-173.9-177-179.50.9114.9Y397Y397-R399 PolarHBondContact O-N 3.42Å; Y397-R399 VanDerWaalsContact O-N 3.14Å
400R94.9Very high95.9Very high148 Ų14875.1 Ų75.156%0.55834%0.342SS*.THydrogen-bonded Turntrans-96.5-21.5-176.8-74-171.7-73.1150.4-3.3113.5N396 Y397N396-R400 PolarHBondContact O-NH2 2.84Å; Y397-R400 VanDerWaalsContact CD1-NH2 3.25Å; Y397-R400 VanDerWaalsContact CE1-CZ 3.42Å; Y397-R400 VanDerWaalsContact CE1-NH1 3.26Å; Y397-R400 PolarHBondContact O-N 3.22Å
401F95.8Very high95.7Very high60 Ų6079 Ų7926%0.26336%0.36SS..THydrogen-bonded Turntrans-127.924.2175.1-59.5-47.1000111.9Q361 V365 F393 Y397 L403Q361-F401 HydrophobicContact CB-CE2 4.02Å; Q361-F401 HydrophobicContact CB-CZ 4.11Å; Q361-F401 HydrophobicContact CG-CE2 4.48Å; V365-F401 HydrophobicContact CG2-CB 3.71Å; V365-F401 HydrophobicContact CG2-CD1 4.43Å; V365-F401 HydrophobicContact CG2-CD2 3.63Å; V365-F401 HydrophobicContact CG2-CE2 4.32Å; V365-F401 HydrophobicContact CG2-CG 3.7Å; F393-F401 HydrophobicContact CE2-CD2 4.27Å; F393-F401 AromaticContact CE2-CE2 3.93Å; F393-F401 HydrophobicContact CE2-CE2 3.93Å; F393-F401 AromaticContact CZ-CD2 3.68Å; F393-F401 HydrophobicContact CZ-CD2 3.68Å; F393-F401 AromaticContact CZ-CE2 3.7Å; F393-F401 HydrophobicContact CZ-CE2 3.7Å; Y397-F401 AromaticContact CD1-CD2 3.87Å; Y397-F401 HydrophobicContact CD1-CD2 3.87Å; Y397-F401 AromaticContact CD1-CE2 3.33Å; Y397-F401 HydrophobicContact CD1-CE2 3.33Å; Y397-F401 HydrophobicContact CD1-CZ 4.09Å; Y397-F401 AromaticContact CE1-CE2 3.99Å; Y397-F401 HydrophobicContact CE1-CE2 3.99Å; Y397-F401 HydrophobicContact CE1-CZ 4.47Å; Y397-F401 HydrophobicContact CG-CD2 4.26Å; Y397-F401 HydrophobicContact CG-CE2 4.09Å; Y397-F401 PolarHBondContact O-N 3.11Å; Y397-F401 VanDerWaalsContact O-N 3.16Å; F401-L403 HydrophobicContact CB-CD2 3.81Å; F401-L403 HydrophobicContact CB-CG 4.26Å; F401-L403 PolarHBondContact O-N 2.93Å
402N95.8Very high95.4Very high77 Ų7778.5 Ų78.541%0.41237%0.374SS..THydrogen-bonded Turntrans42.345.7178.3-65.952.3000113.6R398 D404 E405 V406R398-N402 PolarHBondContact O-N 3.26Å; N402-D404 PolarHBondContact O-N 2.99Å; N402-E405 HydrophobicContact CB-CB 4.42Å; N402-E405 HydrophobicContact CB-CG 4.5Å; N402-E405 PolarHBondContact ND2-OE1 3.18Å; N402-E405 PolarHBondContact ND2-OE2 3.43Å; N402-E405 WeakPolarHBondContact O-CB 3.36Å; N402-E405 PolarHBondContact O-N 2.9Å; N402-V406 PolarHBondContact O-N 2.76Å
403L95.9Very high95Very high1 Ų180.2 Ų80.21%0.00538%0.379CS..Hα-helixtrans-62.3-17.9-166.9-62.6-177.5000113.7V365 I368 F393 F394 R398 F401 L407V365-L403 HydrophobicContact CG2-CD2 4.13Å; I368-L403 HydrophobicContact CD1-CD1 4.16Å; I368-L403 HydrophobicContact CD1-CD2 3.9Å; F393-L403 HydrophobicContact CE1-CD1 4.35Å; F394-L403 HydrophobicContact CD1-CD1 4.19Å; F394-L403 HydrophobicContact CG-CD1 4.5Å; R398-L403 PolarHBondContact O-N 3.35Å; F401-L403 HydrophobicContact CB-CD2 3.81Å; F401-L403 HydrophobicContact CB-CG 4.26Å; F401-L403 PolarHBondContact O-N 2.93Å; L403-L407 WeakPolarHBondContact O-CB 3.3Å; L403-L407 WeakPolarHBondContact O-CD1 3.36Å; L403-L407 WeakPolarHBondContact O-CG 3.44Å; L403-L407 PolarHBondContact O-N 3.14Å
404D95.3Very high94.3Very high70 Ų7085 Ų8537%0.37440%0.401SS..Hα-helixtrans-73.2-40.4174.5-64.1-26.5000112.1R398 N402 L407 Q408R398-D404 VanDerWaalsContact CZ-CG 3.49Å; R398-D404 IonicContact CZ-OD1 3.15Å; R398-D404 IonicContact CZ-OD2 3.68Å; R398-D404 VanDerWaalsContact NE-CG 3.29Å; R398-D404 IonicContact NE-OD1 2.99Å; R398-D404 PolarHBondContact NE-OD1 3.42Å; R398-D404 IonicContact NE-OD2 2.6Å; R398-D404 PolarHBondContact NE-OD2 2.9Å; R398-D404 IonicContact NH1-OD1 2.75Å; R398-D404 IonicContact NH2-OD1 2.78Å; R398-D404 PolarHBondContact NH2-OD1 3.26Å; R398-D404 IonicContact NH2-OD2 3.17Å; R398-D404 PolarHBondContact NH2-OD2 3.28Å; N402-D404 PolarHBondContact O-N 2.99Å; D404-L407 PolarHBondContact O-N 2.6Å; D404-Q408 WeakPolarHBondContact O-CB 3.45Å; D404-Q408 PolarHBondContact O-N 3.4Å
405E96.1Very high92.8Very high108 Ų10885.5 Ų85.551%0.50541%0.414SS..Hα-helixtrans-66.9-43.5172.9-67.5153.9-133.500110.2N402 L407 Q408 E409N402-E405 HydrophobicContact CB-CB 4.42Å; N402-E405 HydrophobicContact CB-CG 4.5Å; N402-E405 PolarHBondContact ND2-OE1 3.18Å; N402-E405 PolarHBondContact ND2-OE2 3.43Å; N402-E405 WeakPolarHBondContact O-CB 3.36Å; N402-E405 PolarHBondContact O-N 2.9Å; E405-L407 VanDerWaalsContact C-N 3.28Å; E405-L407 PolarHBondContact O-N 3.45Å; E405-Q408 WeakPolarHBondContact O-CB 3.47Å; E405-Q408 PolarHBondContact O-N 3.33Å; E405-Q408 VanDerWaalsContact O-N 3.08Å; E405-E409 PolarHBondContact O-N 3.07Å
406V95.9Very high90.8Very high20 Ų2089.2 Ų89.212%0.12143%0.427CS..Hα-helixtrans-60.6-36.5176.8-1780000112V365 I368 R369 N402 W410V365-V406 HydrophobicContact CG1-CG2 4.47Å; I368-V406 HydrophobicContact CB-CG1 4.45Å; I368-V406 HydrophobicContact CG2-CG1 4.01Å; R369-V406 HydrophobicContact CB-CG1 3.62Å; R369-V406 HydrophobicContact CG-CG1 4.27Å; N402-V406 PolarHBondContact O-N 2.76Å; V406-W410 PolarHBondContact O-N 3.42Å
407L94.7Very high88.6Confident8 Ų892.7 Ų92.74%0.04244%0.44CS..Hα-helixtrans-71.9-40.9172.3-78.8170.2000112.2I368 R373 F394 L403 D404 E405 E409 W410 E411I368-L407 HydrophobicContact CG2-CD2 4.05Å; I368-L407 HydrophobicContact CG2-CG 4.18Å; R373-L407 HydrophobicContact CG-CD2 3.72Å; F394-L407 HydrophobicContact CE1-CD1 3.91Å; F394-L407 HydrophobicContact CE1-CD2 4.21Å; F394-L407 HydrophobicContact CE1-CG 4.24Å; L403-L407 WeakPolarHBondContact O-CB 3.3Å; L403-L407 WeakPolarHBondContact O-CD1 3.36Å; L403-L407 WeakPolarHBondContact O-CG 3.44Å; L403-L407 PolarHBondContact O-N 3.14Å; D404-L407 PolarHBondContact O-N 2.6Å; E405-L407 VanDerWaalsContact C-N 3.28Å; E405-L407 PolarHBondContact O-N 3.45Å; L407-E409 VanDerWaalsContact C-N 3.33Å; L407-E409 PolarHBondContact O-N 3.25Å; L407-W410 PolarHBondContact O-N 3.47Å; L407-E411 WeakPolarHBondContact O-CG 3.43Å; L407-E411 PolarHBondContact O-N 2.94Å
408Q94.6Very high86.3Confident131 Ų13193.1 Ų93.161%0.61245%0.454SS*.Hα-helixtrans-62.6-39.2178.3-173.8177.61.600111.9D404 E405 E411 A412D404-Q408 WeakPolarHBondContact O-CB 3.45Å; D404-Q408 PolarHBondContact O-N 3.4Å; E405-Q408 WeakPolarHBondContact O-CB 3.47Å; E405-Q408 PolarHBondContact O-N 3.33Å; E405-Q408 VanDerWaalsContact O-N 3.08Å; Q408-E411 PolarHBondContact O-N 3.24Å; Q408-A412 WeakPolarHBondContact O-CB 3.42Å; Q408-A412 PolarHBondContact O-N 3.19Å
409E93.4Very high84Confident102 Ų10290.1 Ų90.148%0.47746%0.457SS..Hα-helixtrans-62.9-41.4172.3-72.5-173-150.600112.4R369 E405 L407 A412 E413R369-E409 IonicContact CZ-OE2 2.65Å; R369-E409 VanDerWaalsContact CZ-OE2 3.27Å; R369-E409 VanDerWaalsContact NE-CB 3.31Å; R369-E409 IonicContact NE-OE2 3.34Å; R369-E409 PolarHBondContact NE-OE2 3.02Å; R369-E409 IonicContact NH2-OE2 3.64Å; R369-E409 PolarHBondContact NH2-OE2 3.06Å; E405-E409 PolarHBondContact O-N 3.07Å; L407-E409 VanDerWaalsContact C-N 3.33Å; L407-E409 PolarHBondContact O-N 3.25Å; E409-A412 PolarHBondContact O-N 3.29Å; E409-E413 PolarHBondContact O-N 2.94Å; E409-E413 VanDerWaalsContact O-N 3.14Å
410W94.6Very high81.5Confident43 Ų4383.5 Ų83.516%0.16345%0.453CS..Hα-helixtrans-64.2-42.3175.8178.584.2000111.8K370 G372 V406 L407 A412 E413 H414K370-W410 VanDerWaalsContact C-CD1 3.5Å; K370-W410 PolarHBondContact O-NE1 3.08Å; K370-W410 VanDerWaalsContact O-NE1 3.11Å; G372-W410 VanDerWaalsContact CA-CD2 3.41Å; V406-W410 PolarHBondContact O-N 3.42Å; L407-W410 PolarHBondContact O-N 3.47Å; W410-A412 VanDerWaalsContact C-N 3.33Å; W410-A412 PolarHBondContact O-N 2.81Å; W410-E413 PolarHBondContact O-N 2.86Å; W410-H414 AromaticContact CD1-CE1 3.39Å; W410-H414 AromaticContact CD1-ND1 3.35Å; W410-H414 AromaticContact CE2-CG 3.78Å; W410-H414 AromaticContact CE2-ND1 3.76Å; W410-H414 AromaticContact CG-ND1 3.82Å; W410-H414 HydrophobicContact CZ2-CB 4.2Å; W410-H414 AromaticContact NE1-CD2 3.84Å; W410-H414 AromaticContact NE1-CE1 3.34Å; W410-H414 PolarHBondContact NE1-CE1 2.96Å; W410-H414 VanDerWaalsContact NE1-CE1 3.34Å; W410-H414 AromaticContact NE1-CG 3.65Å; W410-H414 AromaticContact NE1-ND1 3.31Å; W410-H414 PolarHBondContact NE1-ND1 3.11Å; W410-H414 AromaticContact NE1-NE2 3.65Å; W410-H414 WeakPolarHBondContact O-CB 3.46Å; W410-H414 PolarHBondContact O-N 3.15Å; W410-H414 PolarHBondContact O-ND1 3.39Å
411E93.4Very high79.1Confident81 Ų8186 Ų8638%0.37947%0.468SS..Hα-helixtrans-63.6-36.3175.9-72.2172.3-163.500112.3R373 L407 Q408 G415R373-E411 IonicContact CZ-OE1 2.78Å; R373-E411 IonicContact NH1-OE1 3.69Å; R373-E411 PolarHBondContact NH1-OE1 2.92Å; R373-E411 IonicContact NH2-OE1 2.56Å; R373-E411 PolarHBondContact NH2-OE1 3.26Å; L407-E411 WeakPolarHBondContact O-CG 3.43Å; L407-E411 PolarHBondContact O-N 2.94Å; Q408-E411 PolarHBondContact O-N 3.24Å; E411-G415 WeakPolarHBondContact O-CA 3.37Å; E411-G415 PolarHBondContact O-N 3.15Å
412A92.1Very high76.3Confident84 Ų8486 Ų8669%0.69449%0.485SS*.Hα-helixtrans-68.2-35.8176.200000113Q408 E409 W410Q408-A412 WeakPolarHBondContact O-CB 3.42Å; Q408-A412 PolarHBondContact O-N 3.19Å; E409-A412 PolarHBondContact O-N 3.29Å; W410-A412 VanDerWaalsContact C-N 3.33Å; W410-A412 PolarHBondContact O-N 2.81Å
413E89.6Confident73.3Confident123 Ų12385.8 Ų85.858%0.57550%0.501SS*.Hα-helixtrans-78.2-38.3177.2-75.8177.8178.300113.7R369 E409 W410R369-E413 IonicContact CZ-OE1 3.81Å; R369-E413 IonicContact CZ-OE2 2.88Å; R369-E413 IonicContact NH1-OE1 2.67Å; R369-E413 PolarHBondContact NH1-OE1 2.79Å; R369-E413 IonicContact NH1-OE2 2.71Å; R369-E413 PolarHBondContact NH1-OE2 3.19Å; R369-E413 IonicContact NH2-OE1 3.15Å; R369-E413 PolarHBondContact NH2-OE1 3.08Å; R369-E413 IonicContact NH2-OE2 3.03Å; E409-E413 PolarHBondContact O-N 2.94Å; E409-E413 VanDerWaalsContact O-N 3.14Å; W410-E413 PolarHBondContact O-N 2.86Å
414H82.9Confident70.7Confident100 Ų10093.4 Ų93.446%0.46354%0.537SS..Hα-helixtrans-96.6-11.8-172.1-63.374.2000113.3W410W410-H414 AromaticContact CD1-CE1 3.39Å; W410-H414 AromaticContact CD1-ND1 3.35Å; W410-H414 AromaticContact CE2-CG 3.78Å; W410-H414 AromaticContact CE2-ND1 3.76Å; W410-H414 AromaticContact CG-ND1 3.82Å; W410-H414 HydrophobicContact CZ2-CB 4.2Å; W410-H414 AromaticContact NE1-CD2 3.84Å; W410-H414 AromaticContact NE1-CE1 3.34Å; W410-H414 PolarHBondContact NE1-CE1 2.96Å; W410-H414 VanDerWaalsContact NE1-CE1 3.34Å; W410-H414 AromaticContact NE1-CG 3.65Å; W410-H414 AromaticContact NE1-ND1 3.31Å; W410-H414 PolarHBondContact NE1-ND1 3.11Å; W410-H414 AromaticContact NE1-NE2 3.65Å; W410-H414 WeakPolarHBondContact O-CB 3.46Å; W410-H414 PolarHBondContact O-N 3.15Å; W410-H414 PolarHBondContact O-ND1 3.39Å
415G64.5Low68.1Low36 Ų3698.7 Ų98.737%0.37156%0.559SS.*  trans74.1171.3177.400000114.3E411 E417E411-G415 WeakPolarHBondContact O-CA 3.37Å; E411-G415 PolarHBondContact O-N 3.15Å; G415-E417 PolarHBondContact O-N 3.13Å
416M55.2Low65.4Low176 Ų176101.8 Ų101.887%0.86757%0.571SS**G310 helixtrans-74.89-168.9-155.4173.7178.300114.8G418 A419M416-G418 VanDerWaalsContact C-N 3.3Å; M416-G418 PolarHBondContact O-N 3.04Å; M416-A419 HydrophobicContact CG-CB 4.41Å
417E49.2Very low62.7Low179 Ų179108.7 Ų108.784%0.83660%0.604SS**G310 helixtrans-67.8-28.2177.5-64.1-158141.200113G415 A419G415-E417 PolarHBondContact O-N 3.13Å; E417-A419 VanDerWaalsContact C-N 3.32Å; E417-A419 PolarHBondContact O-N 3.1Å
418G47.8Very low60.1Low43 Ų43114.8 Ų114.844%0.44364%0.637SS.*G310 helixtrans-67.9-26.2-179.400000114.7M416 A420 K421M416-G418 VanDerWaalsContact C-N 3.3Å; M416-G418 PolarHBondContact O-N 3.04Å; G418-A420 VanDerWaalsContact C-N 3.26Å; G418-A420 PolarHBondContact O-N 3.21Å; G418-K421 PolarHBondContact O-N 3.34Å
419A46.4Very low57.3Low68 Ų68114.3 Ų114.356%0.56264%0.643SS**G310 helixtrans-64.3-28.6-173.700000113.3M416 E417 K421M416-A419 HydrophobicContact CG-CB 4.41Å; E417-A419 VanDerWaalsContact C-N 3.32Å; E417-A419 PolarHBondContact O-N 3.1Å; A419-K421 PolarHBondContact O-N 2.97Å
420A42.9Very low54.3Low96 Ų96114.5 Ų114.579%0.79366%0.656SS**G310 helixtrans-76.71.6-174.100000115.4G418G418-A420 VanDerWaalsContact C-N 3.26Å; G418-A420 PolarHBondContact O-N 3.21Å
421K44.1Very low51.5Low199 Ų199118 Ų11887%0.86568%0.684SS**G310 helixtrans-125.6-8.6178.9-77.1-177.4177.2172.90115.4G418 A419 G423G418-K421 PolarHBondContact O-N 3.34Å; A419-K421 PolarHBondContact O-N 2.97Å; K421-G423 PolarHBondContact O-N 3.25Å
422G38.7Very low48.4Very low60 Ų60119.4 Ų119.462%0.61970%0.702SS**SBendtrans-88.396.5171.700000110.7
423G32.8Very low45.9Very low74 Ų74121 Ų12176%0.76371%0.706SS**  trans-58.6139.3174.900000112K421 E425K421-G423 PolarHBondContact O-N 3.25Å; G423-E425 PolarHBondContact O-N 3.38Å
424E41.6Very low43.3Very low161 Ų161121.1 Ų121.175%0.75272%0.715SS**  trans-67.798.7-173.6-70-176.994.600113.2K426E424-K426 IonicContact OE1-NZ 3.34Å; E424-K426 PolarHBondContact OE1-NZ 3.07Å
425E40.5Very low41.1Very low180 Ų180125.5 Ų125.584%0.84174%0.736SS**  trans-96.178152.1-73.4-168.8141.200109.4G423 M427G423-E425 PolarHBondContact O-N 3.38Å; E425-M427 PolarHBondContact O-N 2.85Å
426K38.8Very low39.5Very low173 Ų173132 Ų13275%0.75276%0.762SS**  trans-66.293.9166.5-94.3178.4177.2152.50109.6E424 D428E424-K426 IonicContact OE1-NZ 3.34Å; E424-K426 PolarHBondContact OE1-NZ 3.07Å; K426-D428 VanDerWaalsContact C-N 3.32Å; K426-D428 PolarHBondContact O-N 2.92Å; K426-D428 VanDerWaalsContact O-N 3.07Å
427M37.9Very low38.3Very low165 Ų165127.5 Ų127.581%0.81376%0.76SS**  trans-81.180.7171.1-150.6174.1-154.800109.9E425 T429E425-M427 PolarHBondContact O-N 2.85Å; M427-T429 PolarHBondContact O-N 3.09Å
428D40.5Very low37.6Very low137 Ų137123.6 Ų123.673%0.73376%0.759SS**  trans-71119.2177.1-167.8-13000110.9K426 S430K426-D428 VanDerWaalsContact C-N 3.32Å; K426-D428 PolarHBondContact O-N 2.92Å; K426-D428 VanDerWaalsContact O-N 3.07Å; D428-S430 PolarHBondContact OD1-N 3.19Å
429T36.1Very low36.9Very low121 Ų121128.4 Ų128.474%0.74278%0.78SS**  trans-15263.9172.239.20000110.9M427 P431M427-T429 PolarHBondContact O-N 3.09Å; T429-P431 VanDerWaalsContact O-CD 3.27Å; T429-P431 WeakPolarHBondContact O-CD 3.42Å
430S29.9Very low36.3Very low106 Ų106132.5 Ų132.574%0.74179%0.792SS**  trans-87.3109.7163.6-68.50000111.1D428 S432D428-S430 PolarHBondContact OD1-N 3.19Å; S430-S432 PolarHBondContact O-N 3.33Å
431P37.1Very low36.3Very low117 Ų117133 Ų13376%0.7679%0.788SS**PPolyproline II helixtrans-74.5120.5167.430.5-31.9000109.3T429 P433T429-P431 VanDerWaalsContact O-CD 3.27Å; T429-P431 WeakPolarHBondContact O-CD 3.42Å; P431-P433 WeakPolarHBondContact O-CD 3.36Å
432S26.9Very low35.9Very low109 Ų109129.8 Ų129.876%0.76278%0.784SS**PPolyproline II helixtrans-82128177.3177.90000111.3S430S430-S432 PolarHBondContact O-N 3.33Å
433P40.9Very low36.6Very low119 Ų119132.1 Ų132.177%0.77379%0.788SS**PPolyproline II helixtrans-90.3132.415934.1-28.4000110.2P431P431-P433 WeakPolarHBondContact O-CD 3.36Å
434T35.7Very low37Very low125 Ų125134.6 Ų134.677%0.76779%0.791SS**PPolyproline II helixtrans-82.7134.516747.90000110.7
435E35.1Very low36.5Very low192 Ų192135.6 Ų135.690%0.89780%0.796SS**  -173.1162.1125.3-105.7174-170.100111.8
436D32.2Very low36.2Very low172 Ų172132.9 Ų132.992%0.9279%0.787SS**  trans-82155.9-172.1-68.3-79.8000114.4
437G29.5Very low35.9Very low81 Ų81133.5 Ų133.584%0.83579%0.793SS**  trans169.999.6168.900000113.9
438A34.8Very low35.7Very low97 Ų97133.6 Ų133.680%0.80279%0.788SS**  trans-101.1128.3-178.300000113.1
439T31.8Very low35.4Very low144 Ų144135.8 Ų135.888%0.88380%0.795SS**  trans-166.7132.1143.227.60000111.9
440N34Very low35.4Very low154 Ų154138 Ų13882%0.82480%0.796SS**  trans-86.4169.8150-91.1-44.3000108.3
441P44.1Very low35.7Very low108 Ų108138 Ų13870%0.70180%0.796SS**  cis-147.9174.42544-24.7000119.1
442V35.4Very low35.6Very low131 Ų131136.8 Ų136.879%0.79479%0.791SS**  trans70.1141.7141.6157.40000120.8
443P52.2Low36Very low108 Ų108138.9 Ų138.970%0.70179%0.793SS**  trans-101.7177.1179.641.6-38.1000114.4
444P41.5Very low35.8Very low127 Ų127138.7 Ų138.783%0.82579%0.789SS**  trans-116.1163.5156.838.1-28000114
445E32.1Very low35.8Very low182 Ų182140.9 Ų140.985%0.8579%0.791SS**  trans-102.4-173.9-179.2-61.9171.9106.100113
446D34.8Very low35.9Very low123 Ų123135.4 Ų135.466%0.65878%0.778SS**  trans62.8110.7151.4-92.8-0.9000121.2
447Q32.5Very low36.2Very low185 Ų185134.4 Ų134.486%0.86477%0.768SS**  -168.2135.298.1-91.4143.610100107.7
448K32.2Very low36.7Very low167 Ų167138.9 Ų138.973%0.72677%0.767SS**  cis83.79630.5-147.8-162.7-159.6-167.60114.8
449E35.7Very low37.7Very low184 Ų184139 Ų13986%0.8676%0.76SS**  trans-159.1120.5144.2-105.5171.1-163.200104.3
450E35.2Very low38.1Very low167 Ų167139.8 Ų139.878%0.7876%0.758SS**  47.4126.475.6-73.9-170.4-174.400112.6
451S36Very low38.6Very low105 Ų105136.5 Ų136.573%0.73475%0.751SS**  cis-163.4-1723.961.40000107.3
452S34.6Very low38.8Very low93 Ų93140.9 Ų140.965%0.6579%0.785SS**  cis-160.5152.213.9380000111.3
453L34.8Very low39Very low153 Ų153141.4 Ų141.480%0.80178%0.784SS**  trans50.3135.2156.1-76.985.4000120.8
454V38.5Very low38.3Very low115 Ų115143.1 Ų143.170%0.69779%0.789SS**  cis73.1124.344176.90000110.9
455E35.4Very low38.1Very low171 Ų171144 Ų14480%0.79979%0.787SS**  cis-148.6-172.510-138.2172.373.800108
456A37.5Very low38.4Very low76 Ų76141.8 Ų141.863%0.62878%0.783SS**  cis-159.2-169.610.100000114.1
457Q36.8Very low38.7Very low151 Ų151142.9 Ų142.971%0.70679%0.791SS**  trans-35137.7165.1-88.966.20.700115.2
458Q39.8Very low39.1Very low175 Ų175140.1 Ų140.182%0.81879%0.786SS**  56.6152.373.9-81.3-170.313.200115.6
459P56Low39.6Very low101 Ų101138.2 Ų138.266%0.65679%0.79SS**  cis-140.5-166.3-12.235.2-12.7000115
460L40.2Very low39.8Very low160 Ų160134.7 Ų134.784%0.83879%0.785SS**  trans79.8116.4149.5-81.2166.5000122.4
461A44.5Very low40.2Very low84 Ų84132 Ų13269%0.69479%0.785SS**  56.8115.7128.700000122.2
462S48.7Very low40.6Very low200 Ų200134.5 Ų134.5100%1.39979%0.79SS**  -147.10112.2-71.30000109.9

Retrieved 462 of 462 residues in 2233.9 ms (Link to these results)