A0A087XZQ4_POEFO Loading...

WH2 domain-containing protein

AlphaFold DB , UniProt , Accession A0A087XZQ4, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 280 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
1N40.3Very low54Low228 Ų228137.8 Ų137.8100%1.21983%0.833SS**  0116.60-67.5-8.6000108.3
2G44Very low55.5Low74 Ų74141.8 Ų141.876%0.76384%0.836SS**  cis-158.4145.32.700000108.7
3T41.6Very low56.6Low137 Ų137139.4 Ų139.484%0.8483%0.827SS**  trans-67.9119.6176.1-54.80000109.4
4T50.4Low58Low139 Ų139137.6 Ų137.685%0.85382%0.821SS**  trans-78.7115.8166.718.10000108.9E6T4-E6 PolarHBondContact O-N 3.49Å
5E52.5Low59.3Low187 Ų187136.3 Ų136.387%0.87482%0.817SS**  trans-72.3119.9175.6-59.7-163113.600110.4S7E5-S7 PolarHBondContact O-N 3.4Å
6E53Low60.2Low175 Ų175135.1 Ų135.182%0.81881%0.813SS**  trans-81.5102169.1-174.8177100.700108.3T4 V8T4-E6 PolarHBondContact O-N 3.49Å; E6-V8 PolarHBondContact O-N 3.2Å
7S53.1Low61.1Low115 Ų115133.9 Ų133.980%0.80481%0.809SS**  trans-77.199176.8-171.90000110E5 S9E5-S7 PolarHBondContact O-N 3.4Å; S7-S9 PolarHBondContact O-N 3.4Å
8V58.9Low61.9Low118 Ų118133.4 Ų133.472%0.71581%0.81SS**PPolyproline II helixtrans-72.4116.6175.1179.80000109.1E6E6-V8 PolarHBondContact O-N 3.2Å
9S63.8Low62.2Low103 Ų103134.9 Ų134.972%0.7281%0.812SS**PPolyproline II helixtrans-65142173.6-69.90000111.2S7S7-S9 PolarHBondContact O-N 3.4Å
10P70.3Confident62.7Low114 Ų114133.6 Ų133.674%0.7481%0.806SS**PPolyproline II helixtrans-65.3151.4178.327-33.6000111.6
11P66.6Low62.9Low126 Ų126133 Ų13382%0.81881%0.805SS**PPolyproline II helixtrans-63.1137.6-179.826-33.1000111
12Q71.4Confident63.7Low186 Ų186127.9 Ų127.987%0.86979%0.788SS**PPolyproline II helixtrans-61.6144.3174.9-86.9-176.8-9.100111.1
13P70.2Confident64.5Low110 Ų110131.4 Ų131.471%0.71479%0.789SS**PPolyproline II helixtrans-64151.5174.327.6-33.6000110.9
14P75.6Confident65.4Low115 Ų115130.1 Ų130.175%0.74778%0.783SS**PPolyproline II helixtrans-63151177.927.3-34.4000111.2
15P77.2Confident65.8Low117 Ų117131.7 Ų131.776%0.7678%0.783SS**PPolyproline II helixtrans-63.5149.117727.1-34000111.1
16P74.1Confident66.2Low117 Ų117128.2 Ų128.276%0.7678%0.776SS**PPolyproline II helixtrans-63.6152.6176.727.4-34.2000111.3
17P76.1Confident66.8Low115 Ų115125.9 Ų125.975%0.74777%0.774SS**PPolyproline II helixtrans-64.2153.8177.127.7-34.4000111.5
18P75.9Confident67.3Low126 Ų126125.8 Ų125.882%0.81877%0.771SS**PPolyproline II helixtrans-63.2140.4176.826.4-33000110.9
19L67.2Low67.7Low162 Ų162125.6 Ų125.685%0.84877%0.772SS**PPolyproline II helixtrans-62.4143.8172.7-72164.7000110.1
20P72.5Confident68.2Low107 Ų107126.3 Ų126.370%0.69577%0.774SS**PPolyproline II helixtrans-61.1149.5175.226.8-33.7000110.4S22P20-S22 PolarHBondContact O-N 3.27Å
21P67.1Low68.2Low121 Ų121126.3 Ų126.379%0.78677%0.774SS**PPolyproline II helixtrans-57.8129.5177.224-32.4000109.7N23P21-N23 PolarHBondContact O-N 2.87Å
22S57.1Low68.4Low122 Ų122125.5 Ų125.585%0.85377%0.769SS**  trans-59.3101.7170.2-75.10000108.7P20P20-S22 PolarHBondContact O-N 3.27Å
23N59.9Low68.2Low148 Ų148122.7 Ų122.779%0.79177%0.767SS**PPolyproline II helixtrans-61.4125.5165.9-13441.6000106.5P21 M25P21-N23 PolarHBondContact O-N 2.87Å; N23-M25 PolarHBondContact O-N 3.12Å
24P61.5Low67.8Low109 Ų109124.9 Ų124.971%0.70877%0.772SS**PPolyproline II helixtrans-59.2120.1173.424.4-31.3000107.3
25M58.4Low66.9Low172 Ų172125.3 Ų125.385%0.84778%0.775SS**PPolyproline II helixtrans-51.8127.5171.2-166.8-179.8-59.900107.5N23 T27N23-M25 PolarHBondContact O-N 3.12Å; M25-T27 PolarHBondContact O-N 3.03Å; M25-T27 VanDerWaalsContact O-N 3.12Å
26P60.5Low65.7Low114 Ų114126.8 Ų126.874%0.7478%0.781SS**PPolyproline II helixtrans-58.4124.8173.721.7-29000107.6
27T64.8Low64.4Low127 Ų127124 Ų12478%0.77978%0.775SS**PPolyproline II helixtrans-50.5131.6171.538.20000108.7M25M25-T27 PolarHBondContact O-N 3.03Å; M25-T27 VanDerWaalsContact O-N 3.12Å
28P63.7Low62.8Low113 Ų113124.4 Ų124.473%0.73478%0.777SS**PPolyproline II helixtrans-57.6140.8175.925-33000109.1
29P67.4Low61.3Low114 Ų114127.4 Ų127.474%0.7478%0.78SS**PPolyproline II helixtrans-59.5147.2177.725.7-33.6000110.1
30P74.5Confident59.9Low117 Ų117125.6 Ų125.676%0.7678%0.776SS**PPolyproline II helixtrans-59.9149.5175.926.2-33.8000110.5
31P71.1Confident58.2Low115 Ų115126.8 Ų126.875%0.74778%0.782SS**PPolyproline II helixtrans-59.5146.117626.1-33.8000110.5
32P70.9Confident57.1Low108 Ų108129.8 Ų129.870%0.70179%0.785SS**PPolyproline II helixtrans-61.9145.717826.3-33.6000110.6L34P32-L34 PolarHBondContact O-N 3.4Å
33P67.7Low56Low127 Ų127131.7 Ų131.783%0.82579%0.786SS**PPolyproline II helixtrans-61.7134.3177.125-32.1000110.2
34L61.6Low55.3Low156 Ų156131.8 Ų131.882%0.81779%0.786SS**PPolyproline II helixtrans-58.3140.7171.6-97.970.2000109.6P32 T36P32-L34 PolarHBondContact O-N 3.4Å; L34-T36 PolarHBondContact O-N 3.09Å; L34-T36 VanDerWaalsContact O-N 3.09Å
35P55.7Low54.1Low125 Ų125132.7 Ų132.781%0.81279%0.79SS**  trans-66113.9172.426.4-30.9000109.3G37P35-G37 PolarHBondContact O-N 3Å
36T51.9Low53.8Low147 Ų147130.5 Ų130.590%0.90279%0.791SS**  trans-65.895.4162.432.30000108.5L34L34-T36 PolarHBondContact O-N 3.09Å; L34-T36 VanDerWaalsContact O-N 3.09Å
37G46.1Very low53Low60 Ų60129.9 Ų129.962%0.61979%0.79SS**PPolyproline II helixtrans-76.1149.5165.700000110.9P35P35-G37 PolarHBondContact O-N 3Å
38P44.3Very low52Low122 Ų122130.2 Ų130.279%0.79279%0.792SS**PPolyproline II helixtrans-66.8139.3176.427.5-31.7000110.8T40P38-T40 PolarHBondContact O-N 3.27Å
39Q43.3Very low51.6Low189 Ų189134.5 Ų134.588%0.88380%0.799SS**PPolyproline II helixtrans-55.5116.3169.1-72-105.620.100110.5
40T38.3Very low51Low124 Ų124134.1 Ų134.176%0.76180%0.799SS**  trans-146109.1153.9370000110.6P38P38-T40 PolarHBondContact O-N 3.27Å
41T35.6Very low49.7Very low133 Ų133137.6 Ų137.682%0.81680%0.802SS**  trans45.3115.8149.2-43.40000119.6N43T41-N43 PolarHBondContact O-N 3.48Å
42Q45.3Very low49.3Very low183 Ų183139.2 Ų139.286%0.85581%0.805SS**  trans-37.9129.3161.8-71.1172.6-54.900113.1
43N33.9Very low48.8Very low163 Ų163141.3 Ų141.387%0.87281%0.807SS**  trans-151.3133.7138-99.1-28.2000111.6T41T41-N43 PolarHBondContact O-N 3.48Å
44N44.8Very low48.4Very low150 Ų150142.6 Ų142.680%0.80280%0.804SS**  trans-30.7128.2175.3-117.1-49.2000115.8
45T36.3Very low47.9Very low128 Ų128139.9 Ų139.979%0.78580%0.798SS**  173.6125.5115.932.70000109.3S47T45-S47 PolarHBondContact O-N 3.38Å
46S51.3Low48Very low125 Ų125139.2 Ų139.287%0.87479%0.793SS**  trans-60.198.8172.451.50000110.9
47S43.6Very low48.3Very low101 Ų101136.8 Ų136.871%0.70678%0.778SS**  trans-128.186.4160-166.60000107.8T45 K49T45-S47 PolarHBondContact O-N 3.38Å; S47-K49 VanDerWaalsContact C-N 3.35Å; S47-K49 PolarHBondContact O-N 3.44Å
48T43.7Very low49Very low134 Ų134137 Ų13782%0.82278%0.781SS**  trans-51.5105.7156.436.80000106.8S50T48-S50 PolarHBondContact O-N 2.88Å
49K55.8Low49.9Very low203 Ų203136.7 Ų136.788%0.88377%0.773SS**  trans-46.8106.7170.1-81.5-179.6177.4-177.40107.5S47 F51S47-K49 VanDerWaalsContact C-N 3.35Å; S47-K49 PolarHBondContact O-N 3.44Å; K49-F51 PolarHBondContact O-N 3.13Å
50S54.9Low50.9Low106 Ų106130.7 Ų130.774%0.74175%0.747SS**  trans-57.9124.2173.532.40000107.5T48T48-S50 PolarHBondContact O-N 2.88Å
51F47.1Very low52.5Low191 Ų191128.8 Ų128.884%0.83874%0.738SS**  trans-45.4143.1159.4-130.2-104.3000108K49 M53K49-F51 PolarHBondContact O-N 3.13Å; F51-M53 VanDerWaalsContact C-N 3.28Å; F51-M53 WeakPolarHBondContact O-CG 3.04Å; F51-M53 PolarHBondContact O-N 2.68Å
52N63Low54.1Low148 Ų148129.7 Ų129.779%0.79173%0.734SS**  trans-50.888.1179.7-177.958.8000111.4M54N52-M54 PolarHBondContact O-N 3.4Å
53M61.3Low55.1Low153 Ų153125.6 Ų125.675%0.75472%0.717SS**  trans-80.3108.7174.5-72.8-63-65.200105.7F51 S55F51-M53 VanDerWaalsContact C-N 3.28Å; F51-M53 WeakPolarHBondContact O-CG 3.04Å; F51-M53 PolarHBondContact O-N 2.68Å; M53-S55 PolarHBondContact O-N 2.83Å; M53-S55 VanDerWaalsContact O-N 3.14Å
54M57.5Low56.8Low154 Ų154123.2 Ų123.276%0.75970%0.704SS**PPolyproline II helixtrans-53.2121.9160.6-161.776.976.400106.3N52N52-M54 PolarHBondContact O-N 3.4Å
55S52.5Low58.2Low98 Ų98118.8 Ų118.869%0.68569%0.688SS**PPolyproline II helixtrans-51.5135.7172.5-61.70000108.4M53 T57M53-S55 PolarHBondContact O-N 2.83Å; M53-S55 VanDerWaalsContact O-N 3.14Å; S55-T57 PolarHBondContact O-N 2.98Å; S55-T57 VanDerWaalsContact O-N 3.09Å
56P56.8Low59.8Low111 Ų111117.6 Ų117.672%0.72167%0.674SS**PPolyproline II helixtrans-57.3124.1177.524-31.9000108G58P56-G58 PolarHBondContact O-N 2.64Å
57T58.9Low60.6Low96 Ų96118.1 Ų118.159%0.58967%0.665SS**PPolyproline II helixtrans-53.4138.8-179.9-32.60000108.8S55 D59 N60S55-T57 PolarHBondContact O-N 2.98Å; S55-T57 VanDerWaalsContact O-N 3.09Å; T57-D59 PolarHBondContact O-N 3.24Å; T57-N60 PolarHBondContact O-N 2.78Å; T57-N60 PolarHBondContact O-ND2 3.11Å
58G59.9Low61.8Low66 Ų66122.6 Ų122.668%0.6867%0.672SS**G310 helixtrans-62-2.5-170.100000115.8P56 N60P56-G58 PolarHBondContact O-N 2.64Å; G58-N60 VanDerWaalsContact C-N 3.29Å; G58-N60 PolarHBondContact O-N 3.07Å
59D64.1Low62.5Low114 Ų114118.8 Ų118.861%0.6165%0.654SS**G310 helixtrans-83-2-177.9-49.8-50.7000113.2T57 S61T57-D59 PolarHBondContact O-N 3.24Å; D59-S61 PolarHBondContact O-N 2.86Å
60N63.4Low62.7Low63 Ų63112.5 Ų112.534%0.33765%0.646SS.*G310 helixtrans-77.50.5178.5-69-58.4000114.5T57 G58 E62 L63 L64T57-N60 PolarHBondContact O-N 2.78Å; T57-N60 PolarHBondContact O-ND2 3.11Å; G58-N60 VanDerWaalsContact C-N 3.29Å; G58-N60 PolarHBondContact O-N 3.07Å; N60-E62 PolarHBondContact O-N 3.09Å; N60-L63 PolarHBondContact O-N 3.05Å; N60-L64 HydrophobicContact CB-CD1 4.41Å; N60-L64 WeakPolarHBondContact O-CB 3.34Å; N60-L64 VanDerWaalsContact O-CG 3.27Å; N60-L64 WeakPolarHBondContact O-CG 3.43Å; N60-L64 PolarHBondContact O-N 3.01Å
61S72.5Confident63.3Low84 Ų84114.4 Ų114.459%0.58764%0.641SS**Hα-helixtrans-64.4-35.7-171.851.30000113.6D59 A65D59-S61 PolarHBondContact O-N 2.86Å; S61-A65 VanDerWaalsContact O-CB 3.32Å; S61-A65 WeakPolarHBondContact O-CB 3.15Å; S61-A65 PolarHBondContact O-N 2.92Å
62E69.4Low63.8Low153 Ų153109.9 Ų109.972%0.71563%0.633SS**Hα-helixtrans-71.9-44.7177.5-172.6173.1-163.300112.1N60 L64 A65 E66N60-E62 PolarHBondContact O-N 3.09Å; E62-L64 VanDerWaalsContact C-N 3.31Å; E62-L64 PolarHBondContact O-N 3.22Å; E62-A65 CarbonylContact O-C 3.55Å; E62-A65 WeakPolarHBondContact O-CA 3.26Å; E62-A65 WeakPolarHBondContact O-CB 3.49Å; E62-A65 PolarHBondContact O-N 3.3Å; E62-A65 VanDerWaalsContact O-N 3.08Å; E62-E66 WeakPolarHBondContact O-CB 3.32Å; E62-E66 PolarHBondContact O-N 3.21Å
63L65.8Low63.1Low97 Ų97111.2 Ų111.251%0.50864%0.64SS.*Hα-helixtrans-60.4-42175.2-68.4172000111.5N60 A65 E66 I67N60-L63 PolarHBondContact O-N 3.05Å; L63-A65 VanDerWaalsContact C-N 3.34Å; L63-E66 PolarHBondContact O-N 2.95Å; L63-I67 WeakPolarHBondContact O-CB 3.45Å; L63-I67 WeakPolarHBondContact O-CD1 3.42Å; L63-I67 WeakPolarHBondContact O-CG1 3.39Å; L63-I67 PolarHBondContact O-N 3.22Å
64L70.7Confident63Low112 Ų112112.1 Ų112.159%0.58664%0.639SS**Hα-helixtrans-66.9-36.1175.1-70.7171.9000111.9N60 E62 K68N60-L64 HydrophobicContact CB-CD1 4.41Å; N60-L64 WeakPolarHBondContact O-CB 3.34Å; N60-L64 VanDerWaalsContact O-CG 3.27Å; N60-L64 WeakPolarHBondContact O-CG 3.43Å; N60-L64 PolarHBondContact O-N 3.01Å; E62-L64 VanDerWaalsContact C-N 3.31Å; E62-L64 PolarHBondContact O-N 3.22Å; L64-K68 WeakPolarHBondContact O-CB 3.16Å; L64-K68 PolarHBondContact O-N 3.43Å
65A74.3Confident62.7Low57 Ų57110.6 Ų110.647%0.47164%0.641SS.*Hα-helixtrans-68.4-37.9175.300000111.8S61 E62 L63 K68 A69S61-A65 VanDerWaalsContact O-CB 3.32Å; S61-A65 WeakPolarHBondContact O-CB 3.15Å; S61-A65 PolarHBondContact O-N 2.92Å; E62-A65 CarbonylContact O-C 3.55Å; E62-A65 WeakPolarHBondContact O-CA 3.26Å; E62-A65 WeakPolarHBondContact O-CB 3.49Å; E62-A65 PolarHBondContact O-N 3.3Å; E62-A65 VanDerWaalsContact O-N 3.08Å; L63-A65 VanDerWaalsContact C-N 3.34Å; A65-K68 PolarHBondContact O-N 2.76Å; A65-A69 WeakPolarHBondContact O-CB 3.4Å; A65-A69 PolarHBondContact O-N 2.95Å
66E68.2Low62.5Low104 Ų104111.6 Ų111.649%0.48664%0.643SS.*Hα-helixtrans-70.2-43.2177.5-170.9172.9-172.800111.9E62 L63 A69 G70E62-E66 WeakPolarHBondContact O-CB 3.32Å; E62-E66 PolarHBondContact O-N 3.21Å; L63-E66 PolarHBondContact O-N 2.95Å; E66-A69 PolarHBondContact O-N 3.3Å; E66-G70 PolarHBondContact O-N 2.99Å
67I69.9Low62.1Low136 Ų136112.3 Ų112.370%0.69765%0.648SS**Hα-helixtrans-62.7-43.4173.4-67.4165.3000110.5L63 G70L63-I67 WeakPolarHBondContact O-CB 3.45Å; L63-I67 WeakPolarHBondContact O-CD1 3.42Å; L63-I67 WeakPolarHBondContact O-CG1 3.39Å; L63-I67 PolarHBondContact O-N 3.22Å; I67-G70 PolarHBondContact O-N 3.21Å
68K67.1Low61.6Low194 Ų194114.6 Ų114.684%0.84365%0.651SS**Hα-helixtrans-72.9-28.3179.2-177.1165.9-92.2-165.50112.8L64 A65L64-K68 WeakPolarHBondContact O-CB 3.16Å; L64-K68 PolarHBondContact O-N 3.43Å; A65-K68 PolarHBondContact O-N 2.76Å
69A59.9Low61Low55 Ų55116.3 Ų116.346%0.45565%0.653SS.*Hα-helixtrans-90.2-2.5177.100000113.8A65 E66 K71A65-A69 WeakPolarHBondContact O-CB 3.4Å; A65-A69 PolarHBondContact O-N 2.95Å; E66-A69 PolarHBondContact O-N 3.3Å; A69-K71 VanDerWaalsContact C-N 3.32Å; A69-K71 HydrophobicContact CB-CG 4.2Å; A69-K71 PolarHBondContact O-N 3.37Å; A69-K71 VanDerWaalsContact O-N 3.15Å
70G59.9Low60.4Low70 Ų70121 Ų12172%0.72267%0.668SS**THydrogen-bonded Turntrans50.744.1166.100000114.5E66 I67E66-G70 PolarHBondContact O-N 2.99Å; I67-G70 PolarHBondContact O-N 3.21Å
71K67.5Low59.9Low146 Ų146120.2 Ų120.264%0.63568%0.675SS**  trans-127.1121-174.749172164.7-174.80113.2A69A69-K71 VanDerWaalsContact C-N 3.32Å; A69-K71 HydrophobicContact CB-CG 4.2Å; A69-K71 PolarHBondContact O-N 3.37Å; A69-K71 VanDerWaalsContact O-N 3.15Å
72S57.7Low58.9Low96 Ų96126.6 Ų126.667%0.67169%0.688SS**  trans84.942163.6-159.40000118.5
73L48.5Very low57.6Low176 Ų176125 Ų12592%0.92169%0.689SS**  trans-87.893.9142.5-92.4157.5000107.9P75L73-P75 WeakPolarHBondContact O-CD 3.31Å
74K58.2Low57Low172 Ų172126 Ų12675%0.74870%0.699SS**  trans-61.7123.7163.4-65.6174.9-176.6171.40106.4T76K74-T76 PolarHBondContact O-N 3.08Å
75P51.3Low56Low123 Ų123126.3 Ų126.380%0.79971%0.705SS**  trans-63108.8163.325.1-29000106.5L73L73-P75 WeakPolarHBondContact O-CD 3.31Å
76T47.7Very low54.4Low119 Ų119132.1 Ų132.173%0.7372%0.72SS**  trans-51.3130.8164.8-45.20000106.9K74 H78K74-T76 PolarHBondContact O-N 3.08Å; T76-H78 PolarHBondContact O-N 3.44Å
77P48.3Very low53.5Low125 Ų125132.3 Ų132.381%0.81273%0.733SS**  trans-56.9106.3171.8-19.130.3000107.4S79P77-S79 PolarHBondContact O-N 2.9Å; P77-S79 VanDerWaalsContact O-N 3.16Å
78H48.3Very low52.1Low144 Ų144131.9 Ų131.967%0.66773%0.732SS**  trans-52.1117.6-175.4177.469.4000109.7T76 K80T76-H78 PolarHBondContact O-N 3.44Å; H78-K80 PolarHBondContact O-N 3.44Å; H78-K80 VanDerWaalsContact O-N 3.11Å
79S47.4Very low50.9Low102 Ų102129.3 Ų129.371%0.71373%0.733SS**  trans-55.4114.8161.751.50000107.7P77 G81P77-S79 PolarHBondContact O-N 2.9Å; P77-S79 VanDerWaalsContact O-N 3.16Å; S79-G81 PolarHBondContact O-N 2.99Å; S79-G81 VanDerWaalsContact O-N 3.08Å
80K53.4Low50Low213 Ų213130 Ų13093%0.92675%0.746SS**SBendtrans-44114170.4-83.1167.4173.4168.50110H78H78-K80 PolarHBondContact O-N 3.44Å; H78-K80 VanDerWaalsContact O-N 3.11Å
81G51.4Low48.9Very low47 Ų47133.6 Ų133.649%0.48575%0.754SS.*  trans169.683.4171.400000113.8S79S79-G81 PolarHBondContact O-N 2.99Å; S79-G81 VanDerWaalsContact O-N 3.08Å
82Y51.7Low47.4Very low217 Ų217133.2 Ų133.285%0.85176%0.764SS**  trans42.597.4153.1-64.4-83.9000119
83T42.3Very low46.3Very low120 Ų120132 Ų13274%0.73677%0.767SS**  trans-126101.9142.5-66.80000107.7V85T83-V85 HydrophobicContact CG2-CG1 4.2Å; T83-V85 PolarHBondContact O-N 2.88Å
84T54.2Low45.8Very low118 Ų118131.4 Ų131.472%0.72476%0.764SS**  trans-73109.7170.9-61.70000108.3
85V48.8Very low44.6Very low119 Ų119131 Ų13172%0.72177%0.771SS**  trans-108.2116.5159.1-70.30000107.8T83T83-V85 HydrophobicContact CG2-CG1 4.2Å; T83-V85 PolarHBondContact O-N 2.88Å
86F40.8Very low43.9Very low178 Ų178131.8 Ų131.878%0.78177%0.773SS**  trans-86.8110.9177-153.4-99000107.8N88F86-N88 WeakPolarHBondContact CD1-OD1 3.5Å; F86-N88 WeakPolarHBondContact CE1-OD1 3.5Å
87S49.2Very low43.6Very low109 Ų109129.1 Ų129.176%0.76277%0.769SS**  trans-118.4107.4170.9-67.70000108.8T89S87-T89 PolarHBondContact O-N 3.06Å
88N41.1Very low43.3Very low127 Ų127129.2 Ų129.268%0.67977%0.769SS**  trans-70.7112.5166.3-74.163.9000109.5F86F86-N88 WeakPolarHBondContact CD1-OD1 3.5Å; F86-N88 WeakPolarHBondContact CE1-OD1 3.5Å
89T42.1Very low43.2Very low140 Ų140130.6 Ų130.686%0.85977%0.773SS**  trans-173.4130.1135.939.50000109S87S87-T89 PolarHBondContact O-N 3.06Å
90G39.3Very low43Very low70 Ų70131.8 Ų131.872%0.72278%0.779SS**  trans-59.2149.6175.200000111
91T37.3Very low42.1Very low145 Ų145130.3 Ų130.389%0.8977%0.773SS**  -167.3141.881.5-47.60000109.4
92T35.8Very low41.3Very low137 Ų137131.8 Ų131.884%0.8479%0.788SS**  trans-70.1148.6178.6480000113.7
93G35.5Very low40.4Very low72 Ų72125.8 Ų125.874%0.74278%0.783SS**  trans168.273.1161.900000117.7
94N36.7Very low40Very low162 Ų162128.8 Ų128.887%0.86679%0.786SS**  trans50.1118.5146.7-632.2000122.4
95N34Very low38.9Very low165 Ų165130.3 Ų130.388%0.88279%0.785SS**  trans-77.6131.4160.7-85.2-110.7000110.7
96V37.1Very low38.3Very low138 Ų138132.8 Ų132.884%0.83679%0.787SS**  trans-131105150.8-161.80000106.6
97G40.2Very low38.1Very low63 Ų63131.8 Ų131.865%0.64979%0.788SS**  trans-68.1163.8169.400000110.8
98P41.8Very low37.8Very low127 Ų127136.1 Ų136.183%0.82579%0.789SS**  -136.8149.3118.526-8.5000113.5
99K46.4Very low37.4Very low173 Ų173139.9 Ų139.975%0.75280%0.799SS**  trans-57.2162.5163.8-55.9173.9-178.4173.90109.7F101K99-F101 HydrophobicContact CD-CE2 4.15Å
100P43.1Very low36.9Very low127 Ų127139.2 Ų139.283%0.82580%0.795SS**  -138.2144116.926.4-9.1000115
101F34.3Very low36.7Very low183 Ų183142 Ų14280%0.80380%0.798SS**  trans-65.4151.3161.8-79.5-103.9000110.6K99K99-F101 HydrophobicContact CD-CE2 4.15Å
102G36.2Very low36.4Very low77 Ų77141.9 Ų141.979%0.79479%0.791SS**  trans-82.7167.3173.400000114
103A32.6Very low36.1Very low91 Ų91142.5 Ų142.575%0.75279%0.79SS**  trans173143.4141.900000110.2
104F32.9Very low36Very low184 Ų184143.7 Ų143.781%0.80779%0.792SS**  trans64.1145.2146.8-100.1-117.8000117.8
105E31Very low36Very low150 Ų150143 Ų14370%0.70178%0.784SS**  cis-163.4156.819.9-160.6171.1-141.100109.7
106F37Very low36.7Very low171 Ų171141.2 Ų141.275%0.7578%0.781SS**  trans-71.2134.3168.1-104.9-107.7000111Y108F106-Y108 HydrophobicContact CD1-CE2 4.36Å
107I37Very low36.6Very low157 Ų157141.8 Ų141.881%0.80578%0.775SS**  trans-129.5123.1161-63.9-174.8000109.1
108Y42.9Very low36.4Very low199 Ų199145.5 Ų145.578%0.7879%0.785SS**  trans-80.2142.9170.8-73.8-92.1000111.5F106F106-Y108 HydrophobicContact CD1-CE2 4.36Å
109K31.8Very low36.7Very low207 Ų207145.2 Ų145.290%0.978%0.783SS**  trans-159.9147.9136.2-153.2150.7176.9-177.50113.6
110T31.2Very low36.2Very low125 Ų125141.9 Ų141.977%0.76779%0.788SS**  trans-93.7160.3-160.8-19.50000114.7
111V36.1Very low35.9Very low129 Ų129139.3 Ų139.378%0.78279%0.785SS**  trans149.1139.7138.2-680000108
112D30.6Very low36.7Very low142 Ų142136.7 Ų136.776%0.75979%0.786SS**  cis-151.3137.830.3-94.2-83.7000107.6
113D30.1Very low36.9Very low151 Ų151144.9 Ų144.981%0.80779%0.793SS**  78.2114.383.8-147.2-83.1000115.7
114A33Very low36.9Very low96 Ų96147 Ų14779%0.79379%0.792SS**  trans147105.9142.500000113.1
115E37.8Very low37.2Very low149 Ų149145.4 Ų145.470%0.69679%0.788SS**  trans-112.2161.2160.2-155.5-162.3136.100108.4Q117E115-Q117 WeakPolarHBondContact OE1-CA 3.49Å; E115-Q117 WeakPolarHBondContact OE1-CG 3.45Å; E115-Q117 PolarHBondContact OE1-N 3.12Å
116P48.4Very low37.4Very low126 Ų126144 Ų14482%0.81880%0.795SS**  -145.1131.6103.834.4-17.6000116.5
117Q33.9Very low37.3Very low151 Ų151139.7 Ų139.771%0.70680%0.799SS**  trans10139.7147.1-62.9-179.519.500121.4E115E115-Q117 WeakPolarHBondContact OE1-CA 3.49Å; E115-Q117 WeakPolarHBondContact OE1-CG 3.45Å; E115-Q117 PolarHBondContact OE1-N 3.12Å
118T36.6Very low37.3Very low140 Ų140137.5 Ų137.586%0.85980%0.798SS**  -168.3158102.929.90000112.8
119P48.3Very low37Very low121 Ų121132.4 Ų132.479%0.78680%0.797SS**  trans-114.6155.3-159.839.2-26.9000114.7
120A35.7Very low37Very low104 Ų104128.8 Ų128.886%0.8680%0.797SS**  trans-154.2122.4155.300000111.1
121G36.8Very low37.1Very low73 Ų73131.4 Ų131.475%0.75379%0.794SS**  trans-80.3-177.5-17800000115.4
122P50.9Low37.1Very low127 Ų127130.3 Ų130.383%0.82578%0.781SS**  trans-99.7146.8-166.436.6-30.6000113.3
123R39.4Very low37.2Very low249 Ų249130 Ų13094%0.9477%0.774SS**  trans-149102.7160.6-80.3-167.2165.2135.9-4.5112.8
124N34.4Very low37.8Very low137 Ų137129.9 Ų129.973%0.73377%0.773SS**  52.9134.6115.1-117.4-9.7000123.3
125M37.7Very low38.6Very low149 Ų149130 Ų13073%0.73477%0.766SS**  trans92104.3148.1-54.7-48.7-178.900121.8
126S35.8Very low38.7Very low121 Ų121128.5 Ų128.585%0.84677%0.772SS**  74.8118.1113.7-133.60000120.8
127G34.1Very low38.5Very low80 Ų80130.3 Ų130.383%0.82578%0.775SS**  trans-161.995.5157.100000107.9
128S38Very low38.7Very low112 Ų112128 Ų12878%0.78378%0.775SS**  trans-86.4149.4-171.1-163.30000113
129A35.7Very low38.6Very low92 Ų92127.1 Ų127.176%0.7677%0.769SS**  trans61.9118.3143.500000121.2
130S31.6Very low38.2Very low130 Ų130127.1 Ų127.191%0.90977%0.767SS**  -146.1127.5122.3-167.60000110.6
131Y33.2Very low38.2Very low181 Ų181129.6 Ų129.671%0.7177%0.766SS**  trans-122.6128.4-178.7163-99.4000102.9
132E36Very low38.2Very low105 Ų105129.7 Ų129.749%0.49177%0.767SS.*  173.6131.978.7-130.7179.6160.700103.7
133Q34.4Very low37.6Very low135 Ų135132.1 Ų132.163%0.63177%0.773SS**  84.4121.690.3-174.6-160.16600114.8
134L42.5Very low37.6Very low149 Ų149123.7 Ų123.778%0.7876%0.763SS**  178.2165.4109.5-88.5178.3000110.6
135P49.1Very low37.5Very low99 Ų99120.7 Ų120.764%0.64376%0.764SS**  trans-122.6-175.4-148.143-28.4000114.7
136S39.1Very low37.8Very low117 Ų117118.9 Ų118.982%0.81877%0.773SS**  trans83.3133.4147-61.20000121.3
137N45Very low37.7Very low165 Ų165116.6 Ų116.688%0.88277%0.769SS**  trans-46.1150.2170.6-73.8-23.6000115.3
138S37.4Very low37.8Very low101 Ų101117.1 Ų117.171%0.70677%0.765SS**  162.7143.6115-171.70000113.4
139V36.2Very low37.8Very low123 Ų123116.4 Ų116.475%0.74577%0.766SS**  trans74.2115.6152.2-76.70000124
140V39.6Very low37.7Very low121 Ų121119.5 Ų119.573%0.73377%0.765SS**  80.3142.611888.90000121.4
141N35.8Very low38.2Very low156 Ų156118.4 Ų118.483%0.83476%0.755SS**  trans88.1117.5-177.7-60.1-16.7000113.5
142G36.8Very low38.3Very low75 Ų75117.1 Ų117.177%0.77376%0.755SS**  cis123.3120.620.500000107.7
143D38.2Very low38.8Very low178 Ų178118.2 Ų118.295%0.95277%0.774SS**  trans97.5134166.3-156.445.5000119.3
144G40Very low39.3Very low72 Ų72114.9 Ų114.974%0.74278%0.777SS**  trans93.376.4157.300000117.9
145G32Very low39.5Very low73 Ų73118.3 Ų118.375%0.75378%0.779SS**  trans-177.395163.200000113.6G147G145-G147 PolarHBondContact O-N 3.4Å
146A44.2Very low39.6Very low112 Ų112122.7 Ų122.793%0.92679%0.788SS**  trans-56.487.6164.900000109.7A148A146-A148 PolarHBondContact O-N 2.89Å; A146-A148 VanDerWaalsContact O-N 3.11Å
147G33.6Very low40.5Very low72 Ų72120.4 Ų120.474%0.74277%0.769SS**  trans-72.897.7169.300000107.9G145 A149G145-G147 PolarHBondContact O-N 3.4Å; G147-A149 PolarHBondContact O-N 3.09Å; G147-A149 VanDerWaalsContact O-N 3.15Å
148A35.5Very low41.7Very low91 Ų91115.4 Ų115.475%0.75275%0.747SS**  trans-42.3121.4163.500000109A146 Q150A146-A148 PolarHBondContact O-N 2.89Å; A146-A148 VanDerWaalsContact O-N 3.11Å; A148-Q150 VanDerWaalsContact C-N 3.31Å; A148-Q150 PolarHBondContact O-N 2.91Å
149A37.5Very low43.4Very low98 Ų98115.5 Ų115.581%0.8174%0.739SS**  trans-57.599.1167.300000107.8G147 P151G147-A149 PolarHBondContact O-N 3.09Å; G147-A149 VanDerWaalsContact O-N 3.15Å; A149-P151 WeakPolarHBondContact O-CD 3.36Å
150Q33.6Very low45.3Very low156 Ų156112.5 Ų112.573%0.72973%0.727SS**  trans-59.9118.9156.4-95.7-76.6-77.300106.6A148 E152A148-Q150 VanDerWaalsContact C-N 3.31Å; A148-Q150 PolarHBondContact O-N 2.91Å; Q150-E152 VanDerWaalsContact C-N 3.32Å; Q150-E152 PolarHBondContact O-N 3.42Å
151P43.5Very low47.4Very low107 Ų107111.5 Ų111.570%0.69572%0.718SS**  trans-72.8100.316230.1-26.5000105.9A149 S153A149-P151 WeakPolarHBondContact O-CD 3.36Å; P151-S153 PolarHBondContact O-N 3.47Å
152E33.9Very low49.4Very low154 Ų154104.5 Ų104.572%0.7268%0.681SS**  trans-44.8102163.6-71.9-82.1144.600109Q150 G154Q150-E152 VanDerWaalsContact C-N 3.32Å; Q150-E152 PolarHBondContact O-N 3.42Å; E152-G154 PolarHBondContact O-N 3.19Å
153S47.4Very low51.6Low128 Ų128106.1 Ų106.190%0.89567%0.668SS**THydrogen-bonded Turntrans-68.166.3171.8167.50000109.6P151P151-S153 PolarHBondContact O-N 3.47Å
154G45.4Very low53.7Low66 Ų66101.5 Ų101.568%0.6865%0.654SS**THydrogen-bonded Turntrans-159.87.717700000112.8E152 K156E152-G154 PolarHBondContact O-N 3.19Å; G154-K156 VanDerWaalsContact C-N 3.28Å; G154-K156 PolarHBondContact O-N 2.86Å
155R46.6Very low55.9Low220 Ų220104.1 Ų104.183%0.8365%0.651SS**  trans-70.194.9166-73-174.9-177.3173.42.1107.1T157R155-T157 PolarHBondContact O-N 3.34Å
156K49.8Very low58.5Low192 Ų192101 Ų10184%0.83562%0.617SS**  trans-18.3105.2143.754.4-161.5170.6-1670107.7G154 S158G154-K156 VanDerWaalsContact C-N 3.28Å; G154-K156 PolarHBondContact O-N 2.86Å; K156-S158 PolarHBondContact O-N 2.67Å
157T58.3Low60.6Low68 Ų6899.3 Ų99.342%0.41760%0.597SS.*  trans-49113-176.339.10000107.2R155 L159 M192R155-T157 PolarHBondContact O-N 3.34Å; T157-L159 PolarHBondContact O-N 3.44Å; T157-M192 WeakPolarHBondContact CB-SD 3.24Å; T157-M192 HydrophobicContact CG2-CE 4.33Å; T157-M192 HydrophobicContact CG2-SD 3.44Å; T157-M192 WeakPolarHBondContact CG2-SD 2.86Å; T157-M192 WeakPolarHBondContact OG1-CE 3.24Å; T157-M192 PolarHBondContact OG1-SD 2.93Å
158S71.5Confident63.1Low60 Ų6099.7 Ų99.742%0.4259%0.585SS.*  trans-63.7141.6-169.2-1790000107.9K156 A160 D161 I162K156-S158 PolarHBondContact O-N 2.67Å; S158-A160 PolarHBondContact O-N 3.37Å; S158-D161 WeakPolarHBondContact CB-OD2 3.43Å; S158-D161 WeakPolarHBondContact O-CA 3.48Å; S158-D161 WeakPolarHBondContact O-CB 3.33Å; S158-D161 PolarHBondContact O-N 3.4Å; S158-I162 PolarHBondContact O-N 3.08Å; S158-I162 VanDerWaalsContact O-N 3.15Å
159L72.6Confident65.4Low103 Ų103100.2 Ų100.254%0.53957%0.572SS.*Hα-helixtrans-51.4-35.7179-177.965000111.7T157 I162 E163T157-L159 PolarHBondContact O-N 3.44Å; L159-I162 PolarHBondContact O-N 3.11Å; L159-E163 WeakPolarHBondContact O-CG 3.11Å; L159-E163 PolarHBondContact O-N 3.15Å
160A76Confident67.6Low60 Ų6098 Ų9850%0.49655%0.546SS..Hα-helixtrans-65.2-36.2175.300000113.6S158 I162 E163 A164S158-A160 PolarHBondContact O-N 3.37Å; A160-I162 VanDerWaalsContact C-N 3.32Å; A160-E163 PolarHBondContact O-N 3.37Å; A160-A164 WeakPolarHBondContact O-CB 3.45Å; A160-A164 PolarHBondContact O-N 2.87Å
161D83.8Confident69.8Low101 Ų10199.9 Ų99.954%0.5456%0.555SS.*Hα-helixtrans-69.6-34.6176.4-63.3-25.1000110.7S158 L165S158-D161 WeakPolarHBondContact CB-OD2 3.43Å; S158-D161 WeakPolarHBondContact O-CA 3.48Å; S158-D161 WeakPolarHBondContact O-CB 3.33Å; S158-D161 PolarHBondContact O-N 3.4Å; D161-L165 PolarHBondContact O-N 3.03Å
162I78.4Confident71.5Confident9 Ų9101.5 Ų101.55%0.04655%0.553CS.*Hα-helixtrans-70.5-42.9176.3-55.2171.9000110.4S158 L159 A160 A164 L165 V185 L188 Q189 M192S158-I162 PolarHBondContact O-N 3.08Å; S158-I162 VanDerWaalsContact O-N 3.15Å; L159-I162 PolarHBondContact O-N 3.11Å; A160-I162 VanDerWaalsContact C-N 3.32Å; I162-A164 VanDerWaalsContact C-N 3.33Å; I162-A164 PolarHBondContact O-N 2.82Å; I162-L165 PolarHBondContact O-N 3.49Å; I162-V185 HydrophobicContact CG2-CG1 3.94Å; I162-L188 HydrophobicContact CG2-CB 4.4Å; I162-L188 HydrophobicContact CG2-CD2 3.91Å; I162-L188 HydrophobicContact CG2-CG 4.24Å; I162-Q189 HydrophobicContact CD1-CG 4.47Å; I162-M192 HydrophobicContact CD1-CE 3.81Å; I162-M192 HydrophobicContact CG1-CE 4.36Å; I162-M192 HydrophobicContact CG1-SD 4.48Å
163E82Confident73.8Confident108 Ų10896.7 Ų96.751%0.50554%0.544SS..Hα-helixtrans-65.1-34.8177.1-75.3178.3-174.100112.4L159 A160 V166 V185L159-E163 WeakPolarHBondContact O-CG 3.11Å; L159-E163 PolarHBondContact O-N 3.15Å; A160-E163 PolarHBondContact O-N 3.37Å; E163-V166 PolarHBondContact O-N 3.29Å; E163-V185 HydrophobicContact CG-CG2 4.11Å
164A83.4Confident75.4Confident81 Ų8197.2 Ų97.267%0.66953%0.531SS*.Hα-helixtrans-71.2-27.5177.400000113.8A160 I162 V166A160-A164 WeakPolarHBondContact O-CB 3.45Å; A160-A164 PolarHBondContact O-N 2.87Å; I162-A164 VanDerWaalsContact C-N 3.33Å; I162-A164 PolarHBondContact O-N 2.82Å; A164-V166 VanDerWaalsContact C-N 3.3Å
165L84.9Confident77.3Confident127 Ų12797.3 Ų97.367%0.66553%0.525SS*.Hα-helixtrans-75.9-19.4175.3-108.166.2000112.9D161 I162 P167 L188D161-L165 PolarHBondContact O-N 3.03Å; I162-L165 PolarHBondContact O-N 3.49Å; L165-P167 WeakPolarHBondContact O-CD 3.22Å; L165-L188 HydrophobicContact CB-CD2 3.48Å; L165-L188 VanDerWaalsContact CB-CD2 3.48Å; L165-L188 HydrophobicContact CD2-CD1 4.48Å; L165-L188 HydrophobicContact CD2-CD2 4.05Å; L165-L188 HydrophobicContact CG-CD2 4.42Å
166V86.6Confident79.1Confident8 Ų887.3 Ų87.35%0.04849%0.488CS..SBendtrans-77.3126.2177.9172.70000109.4E163 A164 T168 R181 M184 V185 L188E163-V166 PolarHBondContact O-N 3.29Å; A164-V166 VanDerWaalsContact C-N 3.3Å; V166-T168 PolarHBondContact O-N 3.05Å; V166-R181 HydrophobicContact CG1-CB 4.35Å; V166-R181 HydrophobicContact CG1-CG 4.34Å; V166-M184 HydrophobicContact CG1-CB 3.74Å; V166-M184 HydrophobicContact CG1-CE 3.53Å; V166-M184 HydrophobicContact CG1-SD 4.36Å; V166-M184 HydrophobicContact CG2-CB 4.05Å; V166-V185 HydrophobicContact CB-CG2 4.26Å; V166-V185 HydrophobicContact CG2-CB 4.32Å; V166-V185 HydrophobicContact CG2-CG2 3.6Å; V166-L188 HydrophobicContact CG2-CD2 4.19Å
167P88.7Confident81Confident76 Ų7681.4 Ų81.449%0.49447%0.469SS..  trans-53128.5175-27.535.5000110.9L165 I176L165-P167 WeakPolarHBondContact O-CD 3.22Å; P167-I176 HydrophobicContact CB-CD1 3.99Å; P167-I176 WeakPolarHBondContact O-CD1 3.36Å
168T85.4Confident82.3Confident81 Ų8182.7 Ų82.750%0.49747%0.47SS..SBendtrans-82.9-27.5178.952.60000111.8V166 I176V166-T168 PolarHBondContact O-N 3.05Å; T168-I176 PolarHBondContact O-N 3.33Å
169H85.2Confident83.3Confident102 Ų10287.9 Ų87.947%0.47248%0.481SS..BIsolated β-bridgetrans-125.7147.6-178.6-60.577.5000110.9G173 K174 I176H169-G173 PolarHBondContact CD2-O 3.26Å; H169-K174 CarbonylContact C-O 3.54Å; H169-K174 VanDerWaalsContact CA-O 3.26Å; H169-K174 WeakPolarHBondContact CA-O 3.38Å; H169-I176 WeakPolarHBondContact O-CD1 3.48Å
170D82.4Confident84.3Confident51 Ų5187.8 Ų87.827%0.27348%0.476SS..  trans-78.5177.617468.315.2000111.7Q172 G173 K174 I176D170-Q172 PolarHBondContact O-N 3.36Å; D170-Q172 VanDerWaalsContact O-N 3.09Å; D170-Q172 WeakPolarHBondContact OD1-CA 3.48Å; D170-Q172 PolarHBondContact OD1-N 3.48Å; D170-G173 PolarHBondContact O-N 2.95Å; D170-G173 PolarHBondContact OD1-N 3.49Å; D170-G173 VanDerWaalsContact OD1-N 3.13Å; D170-K174 PolarHBondContact N-O 3.43Å; D170-K174 WeakPolarHBondContact OD1-CA 3.27Å; D170-K174 WeakPolarHBondContact OD1-CB 3.26Å; D170-K174 PolarHBondContact OD1-N 2.77Å; D170-I176 HydrophobicContact CB-CG1 4.08Å
171E79.6Confident85Confident196 Ų19688.3 Ų88.392%0.91647%0.465SS*.THydrogen-bonded Turntrans-60.7-19.5-178.1-48175.4-172.500112.6
172Q79.7Confident85.4Confident141 Ų14187.5 Ų87.566%0.65946%0.458SS*.THydrogen-bonded Turntrans-97.97.8175.8-61.8105.6-13.200113D170 K174D170-Q172 PolarHBondContact O-N 3.36Å; D170-Q172 VanDerWaalsContact O-N 3.09Å; D170-Q172 WeakPolarHBondContact OD1-CA 3.48Å; D170-Q172 PolarHBondContact OD1-N 3.48Å; Q172-K174 VanDerWaalsContact C-N 3.27Å; Q172-K174 PolarHBondContact O-N 3.35Å
173G82.8Confident86.1Confident52 Ų5291 Ų9154%0.53648%0.48SS..SBendtrans73.412.8-179.800000114.3H169 D170H169-G173 PolarHBondContact CD2-O 3.26Å; D170-G173 PolarHBondContact O-N 2.95Å; D170-G173 PolarHBondContact OD1-N 3.49Å; D170-G173 VanDerWaalsContact OD1-N 3.13Å
174K80.9Confident86.5Confident140 Ų14088.2 Ų88.261%0.60947%0.467SS*.PPolyproline II helixtrans-84.6141.6175.3-59.3175179.8-750109.7H169 D170 Q172 I176H169-K174 CarbonylContact C-O 3.54Å; H169-K174 VanDerWaalsContact CA-O 3.26Å; H169-K174 WeakPolarHBondContact CA-O 3.38Å; D170-K174 PolarHBondContact N-O 3.43Å; D170-K174 WeakPolarHBondContact OD1-CA 3.27Å; D170-K174 WeakPolarHBondContact OD1-CB 3.26Å; D170-K174 PolarHBondContact OD1-N 2.77Å; Q172-K174 VanDerWaalsContact C-N 3.27Å; Q172-K174 PolarHBondContact O-N 3.35Å; K174-I176 PolarHBondContact O-N 3.24Å
175A85.3Confident86.9Confident68 Ų6885.2 Ų85.256%0.56244%0.441SS*.BIsolated β-bridgetrans-59.7125.4176.100000110.1
176I84.8Confident87.1Confident10 Ų1086.8 Ų86.85%0.05144%0.438CS..PPolyproline II helixtrans-66.8133.7179.2-71.1166.1000108.3P167 T168 H169 D170 K174 K180 R181 M184P167-I176 HydrophobicContact CB-CD1 3.99Å; P167-I176 WeakPolarHBondContact O-CD1 3.36Å; T168-I176 PolarHBondContact O-N 3.33Å; H169-I176 WeakPolarHBondContact O-CD1 3.48Å; D170-I176 HydrophobicContact CB-CG1 4.08Å; K174-I176 PolarHBondContact O-N 3.24Å; I176-K180 HydrophobicContact CG2-CB 3.77Å; I176-K180 HydrophobicContact CG2-CD 4.11Å; I176-K180 HydrophobicContact CG2-CG 3.91Å; I176-R181 HydrophobicContact CB-CG 4.2Å; I176-R181 HydrophobicContact CG2-CG 3.85Å; I176-R181 PolarHBondContact O-NH1 3.22Å; I176-M184 HydrophobicContact CD1-CE 3.94Å; I176-M184 HydrophobicContact CG2-CE 3.89Å
177P89.8Confident87.3Confident67 Ų6793.4 Ų93.444%0.43547%0.466SS..PPolyproline II helixtrans-58.3145.9176.2-27.535.9000112.5W179 K180 R181P177-W179 VanDerWaalsContact C-N 3.3Å; P177-W179 HydrophobicContact CB-CG 4.48Å; P177-W179 PolarHBondContact O-N 2.8Å; P177-K180 PolarHBondContact O-N 2.82Å; P177-R181 PolarHBondContact O-N 3.25Å
178E85.4Confident87.3Confident96 Ų9692.2 Ų92.245%0.44946%0.455SS..Hα-helixtrans-55.6-40.8-175.5-177.251.2-140.900113.3K180 R181 Q182E178-K180 VanDerWaalsContact C-N 3.28Å; E178-K180 PolarHBondContact O-N 3.25Å; E178-R181 WeakPolarHBondContact O-CB 3.3Å; E178-R181 PolarHBondContact O-N 2.86Å; E178-R181 IonicContact OE2-CZ 3.16Å; E178-R181 IonicContact OE2-NE 2.83Å; E178-R181 PolarHBondContact OE2-NE 2.74Å; E178-R181 IonicContact OE2-NH2 2.68Å; E178-R181 PolarHBondContact OE2-NH2 3.47Å; E178-Q182 WeakPolarHBondContact O-CG 3.23Å; E178-Q182 PolarHBondContact O-N 3.13Å; E178-Q182 PolarHBondContact OE1-NE2 3.26Å; E178-Q182 VanDerWaalsContact OE1-NE2 3.11Å
179W91.9Very high87.4Confident169 Ų16992.2 Ų92.264%0.6445%0.45SS*.Hα-helixtrans-61.6-35.717770.7-95.8000112.7P177 Q182 V183P177-W179 VanDerWaalsContact C-N 3.3Å; P177-W179 HydrophobicContact CB-CG 4.48Å; P177-W179 PolarHBondContact O-N 2.8Å; W179-Q182 PolarHBondContact O-N 2.89Å; W179-V183 HydrophobicContact CE3-CG2 4.37Å; W179-V183 WeakPolarHBondContact O-CG2 3.28Å; W179-V183 PolarHBondContact O-N 3.48Å
180K93.2Very high87.4Confident100 Ų10090 Ų9044%0.43545%0.449SS..Hα-helixtrans-76.5-35.2179.5-174171.6176.7-176.50110.5I176 P177 E178 V183 M184I176-K180 HydrophobicContact CG2-CB 3.77Å; I176-K180 HydrophobicContact CG2-CD 4.11Å; I176-K180 HydrophobicContact CG2-CG 3.91Å; P177-K180 PolarHBondContact O-N 2.82Å; E178-K180 VanDerWaalsContact C-N 3.28Å; E178-K180 PolarHBondContact O-N 3.25Å; K180-V183 PolarHBondContact O-N 3.07Å; K180-M184 HydrophobicContact CG-CE 4.36Å; K180-M184 WeakPolarHBondContact O-CG 3.24Å; K180-M184 PolarHBondContact O-N 3.48Å
181R90.7Very high87.4Confident71 Ų7193.8 Ų93.827%0.26846%0.463SS..Hα-helixtrans-57.2-50.2167.3-71.6-168.7-73.1-101.6-4.8110.6V166 I176 P177 E178 V183 M184 V185V166-R181 HydrophobicContact CG1-CB 4.35Å; V166-R181 HydrophobicContact CG1-CG 4.34Å; I176-R181 HydrophobicContact CB-CG 4.2Å; I176-R181 HydrophobicContact CG2-CG 3.85Å; I176-R181 PolarHBondContact O-NH1 3.22Å; P177-R181 PolarHBondContact O-N 3.25Å; E178-R181 WeakPolarHBondContact O-CB 3.3Å; E178-R181 PolarHBondContact O-N 2.86Å; E178-R181 IonicContact OE2-CZ 3.16Å; E178-R181 IonicContact OE2-NE 2.83Å; E178-R181 PolarHBondContact OE2-NE 2.74Å; E178-R181 IonicContact OE2-NH2 2.68Å; E178-R181 PolarHBondContact OE2-NH2 3.47Å; R181-V183 PolarHBondContact O-N 3.28Å; R181-M184 CarbonylContact O-C 3.54Å; R181-M184 WeakPolarHBondContact O-CA 3.41Å; R181-M184 WeakPolarHBondContact O-CB 3.49Å; R181-M184 PolarHBondContact O-N 3.42Å; R181-M184 VanDerWaalsContact O-N 3.08Å; R181-V185 VanDerWaalsContact O-CG2 3.31Å; R181-V185 WeakPolarHBondContact O-CG2 3.48Å; R181-V185 PolarHBondContact O-N 2.96Å
182Q91.8Very high87.5Confident85 Ų8586.7 Ų86.740%0.39743%0.43SS..Hα-helixtrans-62.1-38.5179.3-69.5174.518.500113.9E178 W179 M184 V185 R186E178-Q182 WeakPolarHBondContact O-CG 3.23Å; E178-Q182 PolarHBondContact O-N 3.13Å; E178-Q182 PolarHBondContact OE1-NE2 3.26Å; E178-Q182 VanDerWaalsContact OE1-NE2 3.11Å; W179-Q182 PolarHBondContact O-N 2.89Å; Q182-M184 VanDerWaalsContact C-N 3.34Å; Q182-V185 PolarHBondContact O-N 3.36Å; Q182-R186 WeakPolarHBondContact O-CB 3.24Å; Q182-R186 WeakPolarHBondContact O-CG 3.46Å; Q182-R186 PolarHBondContact O-N 3.49Å
183V93.1Very high87.5Confident81 Ų8184.8 Ų84.849%0.49142%0.421SS..Hα-helixtrans-64-42.1174168.90000110.5W179 K180 R181 K187W179-V183 HydrophobicContact CE3-CG2 4.37Å; W179-V183 WeakPolarHBondContact O-CG2 3.28Å; W179-V183 PolarHBondContact O-N 3.48Å; K180-V183 PolarHBondContact O-N 3.07Å; R181-V183 PolarHBondContact O-N 3.28Å; V183-K187 VanDerWaalsContact O-CB 3.24Å; V183-K187 WeakPolarHBondContact O-CB 3.35Å; V183-K187 PolarHBondContact O-N 2.9Å
184M91.1Very high87Confident51 Ų5188.5 Ų88.525%0.25143%0.425SS..Hα-helixtrans-67.7-40.4175.5-71.2-168.3-68.400112.3V166 I176 K180 R181 Q182 K187 L188V166-M184 HydrophobicContact CG1-CB 3.74Å; V166-M184 HydrophobicContact CG1-CE 3.53Å; V166-M184 HydrophobicContact CG1-SD 4.36Å; V166-M184 HydrophobicContact CG2-CB 4.05Å; I176-M184 HydrophobicContact CD1-CE 3.94Å; I176-M184 HydrophobicContact CG2-CE 3.89Å; K180-M184 HydrophobicContact CG-CE 4.36Å; K180-M184 WeakPolarHBondContact O-CG 3.24Å; K180-M184 PolarHBondContact O-N 3.48Å; R181-M184 CarbonylContact O-C 3.54Å; R181-M184 WeakPolarHBondContact O-CA 3.41Å; R181-M184 WeakPolarHBondContact O-CB 3.49Å; R181-M184 PolarHBondContact O-N 3.42Å; R181-M184 VanDerWaalsContact O-N 3.08Å; Q182-M184 VanDerWaalsContact C-N 3.34Å; M184-K187 PolarHBondContact O-N 3.42Å; M184-L188 VanDerWaalsContact O-CB 3.23Å; M184-L188 WeakPolarHBondContact O-CB 3.44Å; M184-L188 PolarHBondContact O-N 3.13Å
185V91.5Very high86.4Confident18 Ų1888.3 Ų88.311%0.10943%0.426CS..Hα-helixtrans-58.2-50.7174.1169.70000109.6I162 E163 V166 R181 Q182 K187 L188 Q189I162-V185 HydrophobicContact CG2-CG1 3.94Å; E163-V185 HydrophobicContact CG-CG2 4.11Å; V166-V185 HydrophobicContact CB-CG2 4.26Å; V166-V185 HydrophobicContact CG2-CB 4.32Å; V166-V185 HydrophobicContact CG2-CG2 3.6Å; R181-V185 VanDerWaalsContact O-CG2 3.31Å; R181-V185 WeakPolarHBondContact O-CG2 3.48Å; R181-V185 PolarHBondContact O-N 2.96Å; Q182-V185 PolarHBondContact O-N 3.36Å; V185-K187 VanDerWaalsContact C-N 3.35Å; V185-K187 PolarHBondContact O-N 2.98Å; V185-L188 PolarHBondContact O-N 3.3Å; V185-Q189 VanDerWaalsContact O-CB 3.3Å; V185-Q189 WeakPolarHBondContact O-CB 3.44Å; V185-Q189 PolarHBondContact O-N 2.83Å
186R89.9Confident85.7Confident160 Ų16091.7 Ų91.760%0.60443%0.43SS*.Hα-helixtrans-62.1-40.5176.3-77.9-171.2179.390.3-1.7112.5Q182 L188 Q189 A190Q182-R186 WeakPolarHBondContact O-CB 3.24Å; Q182-R186 WeakPolarHBondContact O-CG 3.46Å; Q182-R186 PolarHBondContact O-N 3.49Å; R186-L188 VanDerWaalsContact C-N 3.34Å; R186-Q189 PolarHBondContact O-N 2.92Å; R186-A190 VanDerWaalsContact O-CB 3.28Å; R186-A190 WeakPolarHBondContact O-CB 3.39Å; R186-A190 PolarHBondContact O-N 3.26Å
187K91.1Very high84.9Confident147 Ų14795.7 Ų95.764%0.63945%0.448SS*.Hα-helixtrans-66.2-37.7177.5-173.9174.4-1791760111.7V183 M184 V185 K191V183-K187 VanDerWaalsContact O-CB 3.24Å; V183-K187 WeakPolarHBondContact O-CB 3.35Å; V183-K187 PolarHBondContact O-N 2.9Å; M184-K187 PolarHBondContact O-N 3.42Å; V185-K187 VanDerWaalsContact C-N 3.35Å; V185-K187 PolarHBondContact O-N 2.98Å; K187-K191 WeakPolarHBondContact O-CB 3.33Å; K187-K191 PolarHBondContact O-N 3.14Å
188L88.4Confident83.4Confident51 Ų5199 Ų9927%0.26746%0.458SS..Hα-helixtrans-70.4-44.2176.4-177.663.5000110.9I162 L165 V166 M184 V185 R186 A190 K191 M192I162-L188 HydrophobicContact CG2-CB 4.4Å; I162-L188 HydrophobicContact CG2-CD2 3.91Å; I162-L188 HydrophobicContact CG2-CG 4.24Å; L165-L188 HydrophobicContact CB-CD2 3.48Å; L165-L188 VanDerWaalsContact CB-CD2 3.48Å; L165-L188 HydrophobicContact CD2-CD1 4.48Å; L165-L188 HydrophobicContact CD2-CD2 4.05Å; L165-L188 HydrophobicContact CG-CD2 4.42Å; V166-L188 HydrophobicContact CG2-CD2 4.19Å; M184-L188 VanDerWaalsContact O-CB 3.23Å; M184-L188 WeakPolarHBondContact O-CB 3.44Å; M184-L188 PolarHBondContact O-N 3.13Å; V185-L188 PolarHBondContact O-N 3.3Å; R186-L188 VanDerWaalsContact C-N 3.34Å; L188-A190 VanDerWaalsContact C-N 3.33Å; L188-A190 PolarHBondContact O-N 3.16Å; L188-K191 PolarHBondContact O-N 2.81Å; L188-M192 VanDerWaalsContact O-CB 3.32Å; L188-M192 WeakPolarHBondContact O-CB 3.39Å; L188-M192 PolarHBondContact O-N 2.93Å
189Q87.2Confident82.5Confident81 Ų81101.3 Ų101.338%0.37947%0.466SS..Hα-helixtrans-58.5-45.4173.3-174.91791.800111.1I162 V185 R186 M192 Q193I162-Q189 HydrophobicContact CD1-CG 4.47Å; V185-Q189 VanDerWaalsContact O-CB 3.3Å; V185-Q189 WeakPolarHBondContact O-CB 3.44Å; V185-Q189 PolarHBondContact O-N 2.83Å; R186-Q189 PolarHBondContact O-N 2.92Å; Q189-M192 PolarHBondContact O-N 3.48Å; Q189-Q193 WeakPolarHBondContact O-CB 2.79Å; Q189-Q193 PolarHBondContact O-N 3.01Å
190A85.8Confident81.2Confident55 Ų55100.9 Ų100.946%0.45547%0.465SS..Hα-helixtrans-62.5-42.6175.300000112.1R186 L188 Q193 E194R186-A190 VanDerWaalsContact O-CB 3.28Å; R186-A190 WeakPolarHBondContact O-CB 3.39Å; R186-A190 PolarHBondContact O-N 3.26Å; L188-A190 VanDerWaalsContact C-N 3.33Å; L188-A190 PolarHBondContact O-N 3.16Å; A190-Q193 PolarHBondContact O-N 2.85Å; A190-E194 VanDerWaalsContact O-CB 3.24Å; A190-E194 WeakPolarHBondContact O-CB 3.32Å; A190-E194 PolarHBondContact O-N 3.39Å
191K81.9Confident79.8Confident131 Ų131102.4 Ų102.457%0.5747%0.471SS*.Hα-helixtrans-63.4-40.3176.6-91.8-128.2168.6175.70113.4K187 L188 E195K187-K191 WeakPolarHBondContact O-CB 3.33Å; K187-K191 PolarHBondContact O-N 3.14Å; L188-K191 PolarHBondContact O-N 2.81Å; K191-E195 WeakPolarHBondContact O-CB 3.42Å; K191-E195 PolarHBondContact O-N 2.88Å
192M81.3Confident78.6Confident46 Ų46101.1 Ų101.123%0.22748%0.476CS..Hα-helixtrans-73.3-35.7179.7177.3-169.972.900111.4T157 I162 L188 Q189 E195 E196T157-M192 WeakPolarHBondContact CB-SD 3.24Å; T157-M192 HydrophobicContact CG2-CE 4.33Å; T157-M192 HydrophobicContact CG2-SD 3.44Å; T157-M192 WeakPolarHBondContact CG2-SD 2.86Å; T157-M192 WeakPolarHBondContact OG1-CE 3.24Å; T157-M192 PolarHBondContact OG1-SD 2.93Å; I162-M192 HydrophobicContact CD1-CE 3.81Å; I162-M192 HydrophobicContact CG1-CE 4.36Å; I162-M192 HydrophobicContact CG1-SD 4.48Å; L188-M192 VanDerWaalsContact O-CB 3.32Å; L188-M192 WeakPolarHBondContact O-CB 3.39Å; L188-M192 PolarHBondContact O-N 2.93Å; Q189-M192 PolarHBondContact O-N 3.48Å; M192-E195 PolarHBondContact O-N 3.21Å; M192-E196 WeakPolarHBondContact O-CB 3.4Å; M192-E196 PolarHBondContact O-N 3.46Å
193Q79.3Confident77.4Confident102 Ų102102 Ų10248%0.47748%0.48SS..Hα-helixtrans-68.1-40.2172-172.2174.9-8.600111.7Q189 A190 E196 E197Q189-Q193 WeakPolarHBondContact O-CB 2.79Å; Q189-Q193 PolarHBondContact O-N 3.01Å; A190-Q193 PolarHBondContact O-N 2.85Å; Q193-E196 PolarHBondContact O-N 2.84Å; Q193-E197 WeakPolarHBondContact O-CB 3.22Å; Q193-E197 PolarHBondContact O-N 2.9Å
194E72.4Confident75.9Confident130 Ų130104.4 Ų104.461%0.60749%0.486SS*.Hα-helixtrans-63.1-41.1173.1-179.6178.4-151.500111.3A190 H198A190-E194 VanDerWaalsContact O-CB 3.24Å; A190-E194 WeakPolarHBondContact O-CB 3.32Å; A190-E194 PolarHBondContact O-N 3.39Å; E194-H198 WeakPolarHBondContact O-CB 3.47Å; E194-H198 PolarHBondContact O-N 3.29Å
195E67.8Low74.2Confident136 Ų136107 Ų10764%0.63650%0.497SS*.Hα-helixtrans-65.3-41.8174.7-175179.1-17000111.9K191 M192 H198 K199K191-E195 WeakPolarHBondContact O-CB 3.42Å; K191-E195 PolarHBondContact O-N 2.88Å; M192-E195 PolarHBondContact O-N 3.21Å; E195-H198 PolarHBondContact O-N 3.43Å; E195-K199 WeakPolarHBondContact O-CB 2.95Å; E195-K199 PolarHBondContact O-N 3.48Å
196E70.8Confident73Confident138 Ų138108.7 Ų108.765%0.64551%0.513SS*.Hα-helixtrans-65.9-42.3177.5-170.9175.3-162.200111.7M192 Q193 K199 R200M192-E196 WeakPolarHBondContact O-CB 3.4Å; M192-E196 PolarHBondContact O-N 3.46Å; Q193-E196 PolarHBondContact O-N 2.84Å; E196-K199 PolarHBondContact O-N 3.35Å; E196-R200 VanDerWaalsContact O-CB 3.28Å; E196-R200 WeakPolarHBondContact O-CB 3.4Å; E196-R200 PolarHBondContact O-N 3.19Å
197E69Low72.3Confident94 Ų94107.1 Ų107.144%0.43951%0.511SS..Hα-helixtrans-69.1-39.1174.6-76.3-173.9173.900112.3Q193 K199 R200 K201Q193-E197 WeakPolarHBondContact O-CB 3.22Å; Q193-E197 PolarHBondContact O-N 2.9Å; E197-K199 VanDerWaalsContact C-N 3.34Å; E197-R200 PolarHBondContact O-N 3.3Å; E197-K201 WeakPolarHBondContact O-CB 3.25Å; E197-K201 PolarHBondContact O-N 3.17Å
198H57.4Low71Confident136 Ų136108.7 Ų108.763%0.6351%0.513SS*.Hα-helixtrans-65.7-38.9174.3-175.8-87000111.2E194 E195 K201 A202E194-H198 WeakPolarHBondContact O-CB 3.47Å; E194-H198 PolarHBondContact O-N 3.29Å; E195-H198 PolarHBondContact O-N 3.43Å; H198-K201 PolarHBondContact O-N 2.83Å; H198-A202 WeakPolarHBondContact O-CB 3.46Å; H198-A202 PolarHBondContact O-N 2.84Å
199K67.3Low69.6Low145 Ų145109.2 Ų109.263%0.6352%0.516SS*.Hα-helixtrans-68.4-40.6175.3-172.1176179.2-174.20111.4E195 E196 E197 A202 E203E195-K199 WeakPolarHBondContact O-CB 2.95Å; E195-K199 PolarHBondContact O-N 3.48Å; E196-K199 PolarHBondContact O-N 3.35Å; E197-K199 VanDerWaalsContact C-N 3.34Å; K199-A202 PolarHBondContact O-N 3.34Å; K199-E203 WeakPolarHBondContact O-CB 3.01Å; K199-E203 PolarHBondContact O-N 3.09Å
200R64.3Low68.7Low160 Ų160108.2 Ų108.260%0.60452%0.521SS*.Hα-helixtrans-64-43.7173.5-169-178.877-157.8-1.3111.5E196 E197 E203 E204E196-R200 VanDerWaalsContact O-CB 3.28Å; E196-R200 WeakPolarHBondContact O-CB 3.4Å; E196-R200 PolarHBondContact O-N 3.19Å; E197-R200 PolarHBondContact O-N 3.3Å; R200-E203 PolarHBondContact O-N 3.16Å; R200-E204 WeakPolarHBondContact O-CB 3.46Å; R200-E204 PolarHBondContact O-N 3.4Å
201K64.6Low68.3Low133 Ų133110.4 Ų110.458%0.57853%0.533SS*.Hα-helixtrans-66.6-39.3177.3-168.2170.2-174.6174.50111.7E197 H198 E205E197-K201 WeakPolarHBondContact O-CB 3.25Å; E197-K201 PolarHBondContact O-N 3.17Å; H198-K201 PolarHBondContact O-N 2.83Å; K201-E205 VanDerWaalsContact O-CB 3.23Å; K201-E205 WeakPolarHBondContact O-CB 3.47Å; K201-E205 PolarHBondContact O-N 2.99Å
202A64.4Low68.2Low44 Ų44106.7 Ų106.736%0.36452%0.518SS..Hα-helixtrans-68.4-36.3174.800000112.4H198 K199 A206H198-A202 WeakPolarHBondContact O-CB 3.46Å; H198-A202 PolarHBondContact O-N 2.84Å; K199-A202 PolarHBondContact O-N 3.34Å; A202-A206 WeakPolarHBondContact O-CB 3.48Å; A202-A206 PolarHBondContact O-N 2.87Å
203E66Low68.3Low104 Ų104108 Ų10849%0.48653%0.53SS..Hα-helixtrans-71.1-39.7175.5-166.1-168.7148.900111.8K199 R200 A206 K207K199-E203 WeakPolarHBondContact O-CB 3.01Å; K199-E203 PolarHBondContact O-N 3.09Å; R200-E203 PolarHBondContact O-N 3.16Å; E203-A206 PolarHBondContact O-N 3.46Å; E203-K207 WeakPolarHBondContact O-CG 3.28Å; E203-K207 PolarHBondContact O-N 2.95Å; E203-K207 VanDerWaalsContact OE1-CE 3.25Å; E203-K207 WeakPolarHBondContact OE1-CE 3.41Å; E203-K207 IonicContact OE1-NZ 3.61Å; E203-K207 PolarHBondContact OE1-NZ 2.89Å
204E62.8Low68.1Low130 Ų130106.1 Ų106.161%0.60753%0.532SS*.Hα-helixtrans-65.2-42173.3-172.9176.9176.500111.4R200 A206 K207 R208R200-E204 WeakPolarHBondContact O-CB 3.46Å; R200-E204 PolarHBondContact O-N 3.4Å; E204-A206 VanDerWaalsContact C-N 3.33Å; E204-A206 PolarHBondContact O-N 2.9Å; E204-K207 PolarHBondContact O-N 2.91Å; E204-R208 WeakPolarHBondContact O-CB 3.42Å; E204-R208 PolarHBondContact O-N 3.42Å
205E55.1Low68.7Low106 Ų106108 Ų10850%0.49553%0.533SS..Hα-helixtrans-66.1-35172.7-170.7175.1-164.300111.8K201 R208 L209K201-E205 VanDerWaalsContact O-CB 3.23Å; K201-E205 WeakPolarHBondContact O-CB 3.47Å; K201-E205 PolarHBondContact O-N 2.99Å; E205-R208 CarbonylContact O-C 3.55Å; E205-R208 WeakPolarHBondContact O-CB 3.39Å; E205-R208 PolarHBondContact O-N 2.93Å; E205-L209 HydrophobicContact CG-CD1 4.03Å; E205-L209 VanDerWaalsContact O-CD1 3.29Å; E205-L209 WeakPolarHBondContact O-CD1 3.08Å; E205-L209 PolarHBondContact O-N 3.44Å
206A67Low69.5Low53 Ų53105.5 Ų105.544%0.43852%0.518SS..Hα-helixtrans-68-37.9173.400000111.9A202 E203 E204 R208 L209 A210A202-A206 WeakPolarHBondContact O-CB 3.48Å; A202-A206 PolarHBondContact O-N 2.87Å; E203-A206 PolarHBondContact O-N 3.46Å; E204-A206 VanDerWaalsContact C-N 3.33Å; E204-A206 PolarHBondContact O-N 2.9Å; A206-R208 VanDerWaalsContact C-N 3.32Å; A206-L209 CarbonylContact O-C 3.56Å; A206-L209 PolarHBondContact O-N 2.88Å; A206-A210 WeakPolarHBondContact O-CB 3.47Å; A206-A210 PolarHBondContact O-N 2.8Å
207K73.9Confident70Confident128 Ų128103.6 Ų103.656%0.55751%0.505SS*.Hα-helixtrans-65-38.1170.3-75.2170-172.6162.60110.8E203 E204 A210 S211E203-K207 WeakPolarHBondContact O-CG 3.28Å; E203-K207 PolarHBondContact O-N 2.95Å; E203-K207 VanDerWaalsContact OE1-CE 3.25Å; E203-K207 WeakPolarHBondContact OE1-CE 3.41Å; E203-K207 IonicContact OE1-NZ 3.61Å; E203-K207 PolarHBondContact OE1-NZ 2.89Å; E204-K207 PolarHBondContact O-N 2.91Å; K207-A210 CarbonylContact O-C 3.58Å; K207-A210 PolarHBondContact O-N 2.86Å; K207-S211 WeakPolarHBondContact O-CB 3.15Å; K207-S211 PolarHBondContact O-N 3.38Å
208R63.4Low70.6Confident180 Ų180104.2 Ų104.268%0.67951%0.511SS*.Hα-helixtrans-64.8-41.9174.1-159.5176.884.9147.21111.7E204 E205 A206 S211 M212E204-R208 WeakPolarHBondContact O-CB 3.42Å; E204-R208 PolarHBondContact O-N 3.42Å; E205-R208 CarbonylContact O-C 3.55Å; E205-R208 WeakPolarHBondContact O-CB 3.39Å; E205-R208 PolarHBondContact O-N 2.93Å; A206-R208 VanDerWaalsContact C-N 3.32Å; R208-S211 PolarHBondContact O-N 2.83Å; R208-M212 WeakPolarHBondContact O-CG 2.89Å; R208-M212 PolarHBondContact O-N 2.89Å
209L59.3Low72Confident62 Ų62102.1 Ų102.133%0.32550%0.503SS..Hα-helixtrans-67.1-38.7171.7-98.378.1000111.7E205 A206 S211 M212 R217E205-L209 HydrophobicContact CG-CD1 4.03Å; E205-L209 VanDerWaalsContact O-CD1 3.29Å; E205-L209 WeakPolarHBondContact O-CD1 3.08Å; E205-L209 PolarHBondContact O-N 3.44Å; A206-L209 CarbonylContact O-C 3.56Å; A206-L209 PolarHBondContact O-N 2.88Å; L209-S211 VanDerWaalsContact C-N 3.25Å; L209-S211 PolarHBondContact O-N 3.42Å; L209-M212 HydrophobicContact CG-SD 4.46Å; L209-M212 VanDerWaalsContact O-CB 3.31Å; L209-M212 WeakPolarHBondContact O-CB 3.33Å; L209-M212 PolarHBondContact O-N 2.99Å; L209-R217 VanDerWaalsContact O-CD 3.26Å; L209-R217 WeakPolarHBondContact O-CD 3.42Å; L209-R217 VanDerWaalsContact O-CG 3.31Å; L209-R217 WeakPolarHBondContact O-CG 3.44Å; L209-R217 PolarHBondContact O-NE 3.44Å
210A69.4Low72.7Confident59 Ų5998.1 Ų98.149%0.48849%0.487SS..Hα-helixtrans-71.9-18.7176.400000112.3A206 K207 M212 R217A206-A210 WeakPolarHBondContact O-CB 3.47Å; A206-A210 PolarHBondContact O-N 2.8Å; K207-A210 CarbonylContact O-C 3.58Å; K207-A210 PolarHBondContact O-N 2.86Å; A210-M212 VanDerWaalsContact C-N 3.3Å; A210-R217 PolarHBondContact O-NH2 2.84Å
211S77.3Confident73.6Confident101 Ų10196.6 Ų96.671%0.70649%0.485SS*.THydrogen-bonded Turntrans-78.7-16.6168.7-172.60000112.2K207 R208 L209K207-S211 WeakPolarHBondContact O-CB 3.15Å; K207-S211 PolarHBondContact O-N 3.38Å; R208-S211 PolarHBondContact O-N 2.83Å; L209-S211 VanDerWaalsContact C-N 3.25Å; L209-S211 PolarHBondContact O-N 3.42Å
212M79.9Confident74.7Confident54 Ų5497.3 Ų97.327%0.26649%0.488SS..SBendtrans-78.5144.7-179.6-55-176.296.900111.4R208 L209 A210 R216 R217R208-M212 WeakPolarHBondContact O-CG 2.89Å; R208-M212 PolarHBondContact O-N 2.89Å; L209-M212 HydrophobicContact CG-SD 4.46Å; L209-M212 VanDerWaalsContact O-CB 3.31Å; L209-M212 WeakPolarHBondContact O-CB 3.33Å; L209-M212 PolarHBondContact O-N 2.99Å; A210-M212 VanDerWaalsContact C-N 3.3Å; M212-R216 HydrophobicContact CB-CB 4.23Å; M212-R216 HydrophobicContact CB-CG 4.39Å; M212-R216 HydrophobicContact CE-CG 3.51Å; M212-R216 HydrophobicContact SD-CG 4.3Å; M212-R217 HydrophobicContact CB-CG 4.17Å; M212-R217 PolarHBondContact O-NE 2.87Å; M212-R217 PolarHBondContact O-NH1 3Å; M212-R217 PolarHBondContact O-NH2 3.4Å
213P83.2Confident75.8Confident74 Ų74102.3 Ų102.348%0.48150%0.502SS..  trans-56.4153.8174.8-25.835.1000113.5W215 R216 R217P213-W215 VanDerWaalsContact C-N 3.35Å; P213-W215 PolarHBondContact O-N 3.22Å; P213-R216 WeakPolarHBondContact O-CA 3.47Å; P213-R216 WeakPolarHBondContact O-CB 3.39Å; P213-R216 PolarHBondContact O-N 3.44Å; P213-R217 PolarHBondContact O-N 3.05Å
214A75.3Confident76.2Confident61 Ų61102.6 Ų102.650%0.50450%0.504SS..Hα-helixtrans-53.8-45.3-175.500000113.6R216 R217 D218A214-R216 PolarHBondContact O-N 2.86Å; A214-R217 PolarHBondContact O-N 2.94Å; A214-R217 VanDerWaalsContact O-N 3.16Å; A214-D218 PolarHBondContact O-N 3.39Å
215W84.1Confident77Confident170 Ų170100 Ų10064%0.64450%0.495SS*.Hα-helixtrans-61.7-30.2176.872.7-91.1000113.1P213 M219P213-W215 VanDerWaalsContact C-N 3.35Å; P213-W215 PolarHBondContact O-N 3.22Å; W215-M219 HydrophobicContact CZ3-CE 3.95Å; W215-M219 WeakPolarHBondContact O-CB 3.47Å; W215-M219 PolarHBondContact O-N 2.95Å
216R84.9Confident78.5Confident84 Ų84100 Ų10032%0.31749%0.494SS..Hα-helixtrans-79.2-35.1178.4-161.767.7-178.797.9-9.2111.5M212 P213 A214 M219 M220M212-R216 HydrophobicContact CB-CB 4.23Å; M212-R216 HydrophobicContact CB-CG 4.39Å; M212-R216 HydrophobicContact CE-CG 3.51Å; M212-R216 HydrophobicContact SD-CG 4.3Å; P213-R216 WeakPolarHBondContact O-CA 3.47Å; P213-R216 WeakPolarHBondContact O-CB 3.39Å; P213-R216 PolarHBondContact O-N 3.44Å; A214-R216 PolarHBondContact O-N 2.86Å; R216-M219 VanDerWaalsContact CZ-CE 3.47Å; R216-M220 WeakPolarHBondContact O-CB 3.18Å; R216-M220 VanDerWaalsContact O-CG 3.28Å; R216-M220 WeakPolarHBondContact O-CG 3.39Å; R216-M220 PolarHBondContact O-N 3.42Å
217R81.8Confident79.2Confident97 Ų97102.5 Ų102.537%0.36650%0.497SS..Hα-helixtrans-65.8-44.8169.9-61.2-167.3-154.798-2.2111.5L209 A210 M212 P213 A214 M219 M220 K221L209-R217 VanDerWaalsContact O-CD 3.26Å; L209-R217 WeakPolarHBondContact O-CD 3.42Å; L209-R217 VanDerWaalsContact O-CG 3.31Å; L209-R217 WeakPolarHBondContact O-CG 3.44Å; L209-R217 PolarHBondContact O-NE 3.44Å; A210-R217 PolarHBondContact O-NH2 2.84Å; M212-R217 HydrophobicContact CB-CG 4.17Å; M212-R217 PolarHBondContact O-NE 2.87Å; M212-R217 PolarHBondContact O-NH1 3Å; M212-R217 PolarHBondContact O-NH2 3.4Å; P213-R217 PolarHBondContact O-N 3.05Å; A214-R217 PolarHBondContact O-N 2.94Å; A214-R217 VanDerWaalsContact O-N 3.16Å; R217-M219 PolarHBondContact O-N 2.79Å; R217-M220 PolarHBondContact O-N 3.27Å; R217-K221 VanDerWaalsContact O-CB 3.25Å; R217-K221 WeakPolarHBondContact O-CB 3.13Å; R217-K221 PolarHBondContact O-N 3.39Å
218D81.7Confident79.6Confident107 Ų107104.6 Ų104.657%0.57250%0.502SS*.Hα-helixtrans-64-40.1177.9-82.3-7000112A214 K221 K222A214-D218 PolarHBondContact O-N 3.39Å; D218-K221 PolarHBondContact O-N 2.96Å; D218-K222 VanDerWaalsContact O-CB 3.24Å; D218-K222 WeakPolarHBondContact O-CB 3.1Å; D218-K222 PolarHBondContact O-N 3.35Å
219M87.3Confident80.6Confident92 Ų92101.5 Ų101.545%0.45350%0.495SS..Hα-helixtrans-66.4-38.4174.8-171165.17000112.6W215 R216 R217 K223W215-M219 HydrophobicContact CZ3-CE 3.95Å; W215-M219 WeakPolarHBondContact O-CB 3.47Å; W215-M219 PolarHBondContact O-N 2.95Å; R216-M219 VanDerWaalsContact CZ-CE 3.47Å; R217-M219 PolarHBondContact O-N 2.79Å; M219-K223 WeakPolarHBondContact O-CB 3.28Å; M219-K223 PolarHBondContact O-N 2.93Å
220M81.4Confident81.8Confident62 Ų62104.1 Ų104.131%0.30551%0.506SS..Hα-helixtrans-70.8-40.2174.8-73.8-71.3-74.600111.9R216 R217 K223 M224R216-M220 WeakPolarHBondContact O-CB 3.18Å; R216-M220 VanDerWaalsContact O-CG 3.28Å; R216-M220 WeakPolarHBondContact O-CG 3.39Å; R216-M220 PolarHBondContact O-N 3.42Å; R217-M220 PolarHBondContact O-N 3.27Å; M220-K223 CarbonylContact O-C 3.58Å; M220-K223 WeakPolarHBondContact O-CA 3.42Å; M220-K223 WeakPolarHBondContact O-CB 3.27Å; M220-K223 PolarHBondContact O-N 3.4Å; M220-K223 VanDerWaalsContact O-N 3.13Å; M220-M224 WeakPolarHBondContact O-CG 3.16Å; M220-M224 PolarHBondContact O-N 3.47Å
221K82.1Confident82.7Confident128 Ų128108.6 Ų108.656%0.55751%0.514SS*.Hα-helixtrans-61.3-46.2174.4-178.1179.4177.6-1740110.7R217 D218 K223 M224 D225R217-K221 VanDerWaalsContact O-CB 3.25Å; R217-K221 WeakPolarHBondContact O-CB 3.13Å; R217-K221 PolarHBondContact O-N 3.39Å; D218-K221 PolarHBondContact O-N 2.96Å; K221-K223 PolarHBondContact O-N 3.5Å; K221-M224 PolarHBondContact O-N 3.03Å; K221-M224 VanDerWaalsContact O-N 3.14Å; K221-D225 WeakPolarHBondContact O-CB 3.36Å; K221-D225 PolarHBondContact O-N 2.86Å
222K88.3Confident83.1Confident147 Ų147110.6 Ų110.664%0.63951%0.506SS*.Hα-helixtrans-56.8-41.1172.7-173.2169.1-176.7170.50111.3D218 E226D218-K222 VanDerWaalsContact O-CB 3.24Å; D218-K222 WeakPolarHBondContact O-CB 3.1Å; D218-K222 PolarHBondContact O-N 3.35Å; K222-E226 WeakPolarHBondContact O-CB 3.25Å; K222-E226 PolarHBondContact O-N 3.36Å
223K87.2Confident83.6Confident149 Ų149114.2 Ų114.265%0.64852%0.52SS*.Hα-helixtrans-66.5-40.3175.9-168.8171.5-178.9175.10113.1M219 M220 K221 E227M219-K223 WeakPolarHBondContact O-CB 3.28Å; M219-K223 PolarHBondContact O-N 2.93Å; M220-K223 CarbonylContact O-C 3.58Å; M220-K223 WeakPolarHBondContact O-CA 3.42Å; M220-K223 WeakPolarHBondContact O-CB 3.27Å; M220-K223 PolarHBondContact O-N 3.4Å; M220-K223 VanDerWaalsContact O-N 3.13Å; K221-K223 PolarHBondContact O-N 3.5Å; K223-E227 WeakPolarHBondContact O-CB 3.45Å; K223-E227 PolarHBondContact O-N 2.82Å
224M75.9Confident83.9Confident111 Ų111113.1 Ų113.155%0.54752%0.517SS..Hα-helixtrans-71.3-36.2177.1-67.3-59-68.600112.3M220 K221 E227 R228M220-M224 WeakPolarHBondContact O-CG 3.16Å; M220-M224 PolarHBondContact O-N 3.47Å; K221-M224 PolarHBondContact O-N 3.03Å; K221-M224 VanDerWaalsContact O-N 3.14Å; M224-E227 PolarHBondContact O-N 3.42Å; M224-R228 VanDerWaalsContact O-CB 3.3Å; M224-R228 WeakPolarHBondContact O-CB 3.26Å; M224-R228 PolarHBondContact O-N 2.8Å
225D78.9Confident84.5Confident75 Ų75116.4 Ų116.440%0.40152%0.522SS..Hα-helixtrans-69.9-40.5175.3-75.3-24.2000110.8K221 R228 E229K221-D225 WeakPolarHBondContact O-CB 3.36Å; K221-D225 PolarHBondContact O-N 2.86Å; D225-R228 PolarHBondContact O-N 3.39Å; D225-E229 WeakPolarHBondContact O-CB 3.19Å; D225-E229 PolarHBondContact O-N 2.8Å
226E86Confident84.6Confident105 Ų105114 Ų11449%0.49152%0.519SS..Hα-helixtrans-63.5-41171.2-170.7101.8-140.300111.5K222 E229 Q230K222-E226 WeakPolarHBondContact O-CB 3.25Å; K222-E226 PolarHBondContact O-N 3.36Å; E226-E229 PolarHBondContact O-N 2.83Å; E226-Q230 WeakPolarHBondContact O-CB 3.49Å; E226-Q230 VanDerWaalsContact O-CG 3.28Å; E226-Q230 WeakPolarHBondContact O-CG 3.32Å; E226-Q230 PolarHBondContact O-N 3.4Å
227E82.4Confident84.5Confident107 Ų107115.6 Ų115.650%0.553%0.529SS..Hα-helixtrans-64.5-40.1173.6-178.4-179.9-174.500111.8K223 M224 E229 Q230 K231K223-E227 WeakPolarHBondContact O-CB 3.45Å; K223-E227 PolarHBondContact O-N 2.82Å; M224-E227 PolarHBondContact O-N 3.42Å; E227-E229 VanDerWaalsContact C-N 3.31Å; E227-E229 PolarHBondContact O-N 2.76Å; E227-Q230 CarbonylContact O-C 3.58Å; E227-Q230 PolarHBondContact O-N 3.43Å; E227-K231 WeakPolarHBondContact O-CB 3.44Å; E227-K231 PolarHBondContact O-N 2.81Å
228R80.8Confident84.9Confident171 Ų171113.8 Ų113.865%0.64554%0.535SS*.Hα-helixtrans-64.8-37.1174.7-176.8180-97.7154.9-9.3111.1M224 D225 K231 R232M224-R228 VanDerWaalsContact O-CB 3.3Å; M224-R228 WeakPolarHBondContact O-CB 3.26Å; M224-R228 PolarHBondContact O-N 2.8Å; D225-R228 PolarHBondContact O-N 3.39Å; R228-K231 PolarHBondContact O-N 3.42Å; R228-R232 WeakPolarHBondContact O-CG 3.32Å; R228-R232 PolarHBondContact O-N 3.41Å
229E85.1Confident85.2Confident115 Ų115116 Ų11654%0.53754%0.54SS..Hα-helixtrans-68.7-42.6172.9-169.4120.8-109.200111.7D225 E226 E227 K231 R232 K233D225-E229 WeakPolarHBondContact O-CB 3.19Å; D225-E229 PolarHBondContact O-N 2.8Å; E226-E229 PolarHBondContact O-N 2.83Å; E227-E229 VanDerWaalsContact C-N 3.31Å; E227-E229 PolarHBondContact O-N 2.76Å; E229-K231 VanDerWaalsContact C-N 3.3Å; E229-K231 PolarHBondContact O-N 3.48Å; E229-R232 PolarHBondContact O-N 3.08Å; E229-R232 IonicContact OE1-NH1 3.61Å; E229-K233 WeakPolarHBondContact O-CB 3.21Å; E229-K233 PolarHBondContact O-N 2.91Å
230Q84.9Confident85.1Confident118 Ų118118.1 Ų118.155%0.55155%0.548SS*.Hα-helixtrans-60.6-39.5172.2-75.6178.914.100111.5E226 E227 K233 A234E226-Q230 WeakPolarHBondContact O-CB 3.49Å; E226-Q230 VanDerWaalsContact O-CG 3.28Å; E226-Q230 WeakPolarHBondContact O-CG 3.32Å; E226-Q230 PolarHBondContact O-N 3.4Å; E227-Q230 CarbonylContact O-C 3.58Å; E227-Q230 PolarHBondContact O-N 3.43Å; Q230-K233 PolarHBondContact O-N 2.77Å; Q230-A234 WeakPolarHBondContact O-CB 3.32Å; Q230-A234 PolarHBondContact O-N 3.13Å
231K88.2Confident85.4Confident152 Ų152117.5 Ų117.566%0.66155%0.553SS**Hα-helixtrans-63.9-44.2175.6-174.3178179.3-177.90111.2E227 R228 E229 K233 A234 E235E227-K231 WeakPolarHBondContact O-CB 3.44Å; E227-K231 PolarHBondContact O-N 2.81Å; R228-K231 PolarHBondContact O-N 3.42Å; E229-K231 VanDerWaalsContact C-N 3.3Å; E229-K231 PolarHBondContact O-N 3.48Å; K231-K233 VanDerWaalsContact C-N 3.33Å; K231-K233 PolarHBondContact O-N 3.43Å; K231-A234 PolarHBondContact O-N 2.73Å; K231-E235 VanDerWaalsContact O-CB 3.25Å; K231-E235 WeakPolarHBondContact O-CB 3.38Å; K231-E235 PolarHBondContact O-N 2.81Å
232R86.6Confident85.7Confident144 Ų144118.4 Ų118.454%0.54356%0.557SS.*Hα-helixtrans-61.8-41.7174.4-71.1173.870.2-149.23.4111.6R228 E229 E235 Q236R228-R232 WeakPolarHBondContact O-CG 3.32Å; R228-R232 PolarHBondContact O-N 3.41Å; E229-R232 PolarHBondContact O-N 3.08Å; E229-R232 IonicContact OE1-NH1 3.61Å; R232-E235 PolarHBondContact O-N 2.82Å; R232-Q236 WeakPolarHBondContact O-CG 3.5Å; R232-Q236 PolarHBondContact O-N 3.48Å
233K90.4Very high85.6Confident129 Ų129117.4 Ų117.456%0.56156%0.555SS**Hα-helixtrans-68-42.1177.4-171.3175.1-178.3178.10112.1E229 Q230 K231 Q236 Q237E229-K233 WeakPolarHBondContact O-CB 3.21Å; E229-K233 PolarHBondContact O-N 2.91Å; Q230-K233 PolarHBondContact O-N 2.77Å; K231-K233 VanDerWaalsContact C-N 3.33Å; K231-K233 PolarHBondContact O-N 3.43Å; K233-Q236 PolarHBondContact O-N 2.93Å; K233-Q237 WeakPolarHBondContact O-CB 3.42Å; K233-Q237 WeakPolarHBondContact O-CG 3.06Å; K233-Q237 PolarHBondContact O-N 3.37Å
234A88.4Confident85.6Confident51 Ų51113.1 Ų113.142%0.42154%0.544SS..Hα-helixtrans-67.2-36.6176.200000111.2Q230 K231 Q237 A238Q230-A234 WeakPolarHBondContact O-CB 3.32Å; Q230-A234 PolarHBondContact O-N 3.13Å; K231-A234 PolarHBondContact O-N 2.73Å; A234-Q237 CarbonylContact O-C 3.57Å; A234-Q237 PolarHBondContact O-N 2.98Å; A234-A238 WeakPolarHBondContact O-CB 3.37Å; A234-A238 PolarHBondContact O-N 3.15Å
235E87.2Confident86.1Confident130 Ų130113.4 Ų113.461%0.60754%0.544SS*.Hα-helixtrans-66.1-42.1173.6-178176.7-176.800111.4K231 R232 Q237 A238 K239K231-E235 VanDerWaalsContact O-CB 3.25Å; K231-E235 WeakPolarHBondContact O-CB 3.38Å; K231-E235 PolarHBondContact O-N 2.81Å; R232-E235 PolarHBondContact O-N 2.82Å; E235-Q237 VanDerWaalsContact C-N 3.35Å; E235-A238 PolarHBondContact O-N 3.15Å; E235-K239 WeakPolarHBondContact O-CB 3.23Å; E235-K239 PolarHBondContact O-N 2.83Å
236Q86.1Confident86.4Confident121 Ų121114.6 Ų114.657%0.56555%0.547SS*.Hα-helixtrans-62.3-43172.1-74.4174.50.300111.6R232 K233 K239 Q240R232-Q236 WeakPolarHBondContact O-CG 3.5Å; R232-Q236 PolarHBondContact O-N 3.48Å; K233-Q236 PolarHBondContact O-N 2.93Å; Q236-K239 PolarHBondContact O-N 3.45Å; Q236-Q240 WeakPolarHBondContact O-CG 3.18Å; Q236-Q240 PolarHBondContact O-N 2.99Å
237Q83.8Confident86.5Confident117 Ų117116.7 Ų116.755%0.54755%0.554SS.*Hα-helixtrans-66.7-37.2175.3-75.6-175.42.500112.3K233 A234 E235 K239 Q240 A241K233-Q237 WeakPolarHBondContact O-CB 3.42Å; K233-Q237 WeakPolarHBondContact O-CG 3.06Å; K233-Q237 PolarHBondContact O-N 3.37Å; A234-Q237 CarbonylContact O-C 3.57Å; A234-Q237 PolarHBondContact O-N 2.98Å; E235-Q237 VanDerWaalsContact C-N 3.35Å; Q237-K239 VanDerWaalsContact C-N 3.35Å; Q237-Q240 PolarHBondContact O-N 3.36Å; Q237-A241 WeakPolarHBondContact O-CB 3.25Å; Q237-A241 PolarHBondContact O-N 2.82Å
238A89.1Confident86.7Confident58 Ų58116.8 Ų116.848%0.47956%0.555SS.*Hα-helixtrans-68.2-37.3175.700000111A234 E235 A241 K242A234-A238 WeakPolarHBondContact O-CB 3.37Å; A234-A238 PolarHBondContact O-N 3.15Å; E235-A238 PolarHBondContact O-N 3.15Å; A238-A241 PolarHBondContact O-N 2.92Å; A238-K242 VanDerWaalsContact O-CB 3.25Å; A238-K242 WeakPolarHBondContact O-CB 3.46Å; A238-K242 PolarHBondContact O-N 2.81Å
239K88.4Confident86.9Confident154 Ų154112.7 Ų112.767%0.6754%0.543SS*.Hα-helixtrans-63.6-46.6172.4-172.6178.5178.9-176.60111E235 Q236 Q237 A241 K242 E243E235-K239 WeakPolarHBondContact O-CB 3.23Å; E235-K239 PolarHBondContact O-N 2.83Å; Q236-K239 PolarHBondContact O-N 3.45Å; Q237-K239 VanDerWaalsContact C-N 3.35Å; K239-A241 VanDerWaalsContact C-N 3.35Å; K239-K242 PolarHBondContact O-N 2.7Å; K239-E243 WeakPolarHBondContact O-CB 3.25Å; K239-E243 PolarHBondContact O-N 2.82Å
240Q84.9Confident86.8Confident136 Ų136109.7 Ų109.764%0.63653%0.53SS*.Hα-helixtrans-64.9-38.2175.1-74.3-171.2900112.3Q236 Q237 E243 S244Q236-Q240 WeakPolarHBondContact O-CG 3.18Å; Q236-Q240 PolarHBondContact O-N 2.99Å; Q237-Q240 PolarHBondContact O-N 3.36Å; Q240-E243 PolarHBondContact O-N 2.73Å; Q240-S244 VanDerWaalsContact O-CB 3.26Å; Q240-S244 WeakPolarHBondContact O-CB 3.16Å; Q240-S244 PolarHBondContact O-N 2.93Å; Q240-S244 PolarHBondContact O-OG 2.86Å
241A88.4Confident86.8Confident50 Ų50108.2 Ų108.241%0.41352%0.523SS..Hα-helixtrans-64.3-46.6176.700000110.4Q237 A238 K239 E243 S244 E245Q237-A241 WeakPolarHBondContact O-CB 3.25Å; Q237-A241 PolarHBondContact O-N 2.82Å; A238-A241 PolarHBondContact O-N 2.92Å; K239-A241 VanDerWaalsContact C-N 3.35Å; A241-E243 PolarHBondContact O-N 3.36Å; A241-S244 WeakPolarHBondContact CA-OG 3.2Å; A241-S244 CarbonylContact O-C 3.46Å; A241-S244 PolarHBondContact O-N 3.37Å; A241-S244 VanDerWaalsContact O-N 3.13Å; A241-S244 PolarHBondContact O-OG 3.32Å; A241-E245 WeakPolarHBondContact O-CB 3.44Å; A241-E245 PolarHBondContact O-N 2.85Å
242K88.9Confident86.7Confident147 Ų147106.1 Ų106.164%0.63951%0.511SS*.Hα-helixtrans-62-42.7176.5-173179.8178.5-176.80111.6A238 K239 S244 E245 E246A238-K242 VanDerWaalsContact O-CB 3.25Å; A238-K242 WeakPolarHBondContact O-CB 3.46Å; A238-K242 PolarHBondContact O-N 2.81Å; K239-K242 PolarHBondContact O-N 2.7Å; K242-S244 VanDerWaalsContact C-N 3.33Å; K242-E245 PolarHBondContact O-N 3.33Å; K242-E246 VanDerWaalsContact O-CB 3.28Å; K242-E246 WeakPolarHBondContact O-CB 3.3Å; K242-E246 PolarHBondContact O-N 2.73Å
243E86.4Confident86.7Confident126 Ų12699.4 Ų99.459%0.58949%0.486SS*.Hα-helixtrans-64.8-37174-174179.817300111.7K239 Q240 A241 K247K239-E243 WeakPolarHBondContact O-CB 3.25Å; K239-E243 PolarHBondContact O-N 2.82Å; Q240-E243 PolarHBondContact O-N 2.73Å; A241-E243 PolarHBondContact O-N 3.36Å; E243-K247 WeakPolarHBondContact O-CB 3.32Å; E243-K247 PolarHBondContact O-N 2.8Å
244S87Confident86.5Confident59 Ų59100.8 Ų100.841%0.41349%0.488SS..Hα-helixtrans-73.1-31.3176.979.40000113.2Q240 A241 K242 Q248Q240-S244 VanDerWaalsContact O-CB 3.26Å; Q240-S244 WeakPolarHBondContact O-CB 3.16Å; Q240-S244 PolarHBondContact O-N 2.93Å; Q240-S244 PolarHBondContact O-OG 2.86Å; A241-S244 WeakPolarHBondContact CA-OG 3.2Å; A241-S244 CarbonylContact O-C 3.46Å; A241-S244 PolarHBondContact O-N 3.37Å; A241-S244 VanDerWaalsContact O-N 3.13Å; A241-S244 PolarHBondContact O-OG 3.32Å; K242-S244 VanDerWaalsContact C-N 3.33Å; S244-Q248 PolarHBondContact O-N 3.45Å
245E86.4Confident86.4Confident117 Ų117103.4 Ų103.455%0.54750%0.499SS..Hα-helixtrans-72.4-47.9175-179.4174.7-151.900109.6A241 K242 K247 Q248 E249A241-E245 WeakPolarHBondContact O-CB 3.44Å; A241-E245 PolarHBondContact O-N 2.85Å; K242-E245 PolarHBondContact O-N 3.33Å; E245-K247 VanDerWaalsContact C-N 3.32Å; E245-K247 PolarHBondContact O-N 3.04Å; E245-Q248 CarbonylContact O-C 3.58Å; E245-Q248 WeakPolarHBondContact O-CA 3.39Å; E245-Q248 WeakPolarHBondContact O-CB 3.17Å; E245-Q248 PolarHBondContact O-N 2.75Å; E245-E249 WeakPolarHBondContact O-CG 3.34Å; E245-E249 PolarHBondContact O-N 3.11Å
246E84.4Confident86.2Confident100 Ų100100.3 Ų100.347%0.46749%0.485SS..Hα-helixtrans-55.3-49.5170.6-179.7166.9-169.600109.5K242 Q248 E249 L250K242-E246 VanDerWaalsContact O-CB 3.28Å; K242-E246 WeakPolarHBondContact O-CB 3.3Å; K242-E246 PolarHBondContact O-N 2.73Å; E246-Q248 VanDerWaalsContact C-N 3.27Å; E246-Q248 PolarHBondContact O-N 2.82Å; E246-E249 WeakPolarHBondContact O-CA 3.36Å; E246-E249 WeakPolarHBondContact O-CB 3.29Å; E246-E249 PolarHBondContact O-N 3.29Å; E246-L250 VanDerWaalsContact C-CD1 3.41Å; E246-L250 HydrophobicContact CB-CD1 4.32Å; E246-L250 HydrophobicContact CG-CD1 3.35Å; E246-L250 WeakPolarHBondContact O-CD1 3.34Å; E246-L250 PolarHBondContact O-N 3.5Å
247K88Confident86.2Confident149 Ų14997.9 Ų97.965%0.64849%0.492SS*.Hα-helixtrans-57.7-36.2175.3-171.7177.7178.7-178.30113.5E243 E245 L250 E251E243-K247 WeakPolarHBondContact O-CB 3.32Å; E243-K247 PolarHBondContact O-N 2.8Å; E245-K247 VanDerWaalsContact C-N 3.32Å; E245-K247 PolarHBondContact O-N 3.04Å; K247-L250 WeakPolarHBondContact O-CB 3.42Å; K247-E251 WeakPolarHBondContact O-CB 3.46Å; K247-E251 PolarHBondContact O-N 3.23Å
248Q86.2Confident86.3Confident108 Ų10897.8 Ų97.851%0.50549%0.488SS..Hα-helixtrans-69.6-37.1173.5-92-175.861.500112.5S244 E245 E246 E251 R252S244-Q248 PolarHBondContact O-N 3.45Å; E245-Q248 CarbonylContact O-C 3.58Å; E245-Q248 WeakPolarHBondContact O-CA 3.39Å; E245-Q248 WeakPolarHBondContact O-CB 3.17Å; E245-Q248 PolarHBondContact O-N 2.75Å; E246-Q248 VanDerWaalsContact C-N 3.27Å; E246-Q248 PolarHBondContact O-N 2.82Å; Q248-E251 PolarHBondContact O-N 3.3Å; Q248-R252 WeakPolarHBondContact O-CB 3.44Å; Q248-R252 WeakPolarHBondContact O-CG 3.43Å; Q248-R252 PolarHBondContact O-N 3.42Å
249E85.2Confident86.1Confident86 Ų8698.8 Ų98.840%0.40249%0.485SS..Hα-helixtrans-65.5-44.1173.8-69.7-174.416400111.3E245 E246 R252 L253 L272E245-E249 WeakPolarHBondContact O-CG 3.34Å; E245-E249 PolarHBondContact O-N 3.11Å; E246-E249 WeakPolarHBondContact O-CA 3.36Å; E246-E249 WeakPolarHBondContact O-CB 3.29Å; E246-E249 PolarHBondContact O-N 3.29Å; E249-R252 WeakPolarHBondContact O-CB 3.38Å; E249-R252 PolarHBondContact O-N 3.48Å; E249-L253 WeakPolarHBondContact O-CB 3.34Å; E249-L253 PolarHBondContact O-N 2.86Å; E249-L272 HydrophobicContact CB-CD1 4.08Å; E249-L272 HydrophobicContact CB-CD2 4.45Å; E249-L272 HydrophobicContact CG-CD1 4.08Å
250L82.8Confident85.8Confident51 Ų5193.8 Ų93.827%0.26746%0.464SS..Hα-helixtrans-55.3-51.1171.1-87.291.4000110.7E246 K247 R252 L253 R254 E260E246-L250 VanDerWaalsContact C-CD1 3.41Å; E246-L250 HydrophobicContact CB-CD1 4.32Å; E246-L250 HydrophobicContact CG-CD1 3.35Å; E246-L250 WeakPolarHBondContact O-CD1 3.34Å; E246-L250 PolarHBondContact O-N 3.5Å; K247-L250 WeakPolarHBondContact O-CB 3.42Å; L250-R252 PolarHBondContact O-N 2.79Å; L250-L253 PolarHBondContact O-N 3.23Å; L250-L253 VanDerWaalsContact O-N 3.17Å; L250-R254 WeakPolarHBondContact O-CB 3.4Å; L250-R254 PolarHBondContact O-N 3.48Å; L250-E260 VanDerWaalsContact CA-OE1 3.25Å; L250-E260 WeakPolarHBondContact CA-OE1 3.49Å; L250-E260 WeakPolarHBondContact CB-OE1 3.21Å; L250-E260 WeakPolarHBondContact CD2-OE1 3.15Å; L250-E260 WeakPolarHBondContact CD2-OE2 3.48Å; L250-E260 HydrophobicContact CG-CG 4.15Å; L250-E260 WeakPolarHBondContact CG-OE1 3.48Å; L250-E260 WeakPolarHBondContact CG-OE2 3.28Å
251E85.7Confident85.7Confident87 Ų8793 Ų9341%0.40747%0.469SS..Hα-helixtrans-63.7-38.7178.5-177.7156.1-133.100112.4K247 Q248 L253 R254 T255K247-E251 WeakPolarHBondContact O-CB 3.46Å; K247-E251 PolarHBondContact O-N 3.23Å; Q248-E251 PolarHBondContact O-N 3.3Å; E251-L253 VanDerWaalsContact C-N 3.34Å; E251-L253 PolarHBondContact O-N 3.3Å; E251-R254 WeakPolarHBondContact O-CB 3.33Å; E251-R254 PolarHBondContact O-N 3.29Å; E251-R254 IonicContact OE1-CZ 3.94Å; E251-R254 IonicContact OE1-NH1 3.57Å; E251-R254 IonicContact OE1-NH2 2.73Å; E251-R254 PolarHBondContact OE1-NH2 3.48Å; E251-T255 PolarHBondContact O-N 2.85Å; E251-T255 PolarHBondContact O-OG1 3.39Å
252R85.9Confident85.7Confident108 Ų10898.6 Ų98.641%0.40848%0.484SS..Hα-helixtrans-60.5-43.4172.3-86.8-165.2178.596.8-2.1111.8Q248 E249 L250 T255 M256 L272 D276Q248-R252 WeakPolarHBondContact O-CB 3.44Å; Q248-R252 WeakPolarHBondContact O-CG 3.43Å; Q248-R252 PolarHBondContact O-N 3.42Å; E249-R252 WeakPolarHBondContact O-CB 3.38Å; E249-R252 PolarHBondContact O-N 3.48Å; L250-R252 PolarHBondContact O-N 2.79Å; R252-T255 PolarHBondContact O-N 2.75Å; R252-M256 PolarHBondContact O-N 2.72Å; R252-M256 VanDerWaalsContact O-N 3.16Å; R252-L272 HydrophobicContact CB-CD2 3.75Å; R252-D276 IonicContact NE-OD1 2.79Å
253L86.7Confident85.5Confident4 Ų492.7 Ų92.72%0.02146%0.459CS..Hα-helixtrans-66.8-41.3179.3-164.460.4000110.8E249 L250 E251 M256 G257 Y258 E260 L263 R268 I271E249-L253 WeakPolarHBondContact O-CB 3.34Å; E249-L253 PolarHBondContact O-N 2.86Å; L250-L253 PolarHBondContact O-N 3.23Å; L250-L253 VanDerWaalsContact O-N 3.17Å; E251-L253 VanDerWaalsContact C-N 3.34Å; E251-L253 PolarHBondContact O-N 3.3Å; L253-M256 CarbonylContact O-C 3.58Å; L253-M256 PolarHBondContact O-N 2.87Å; L253-G257 PolarHBondContact O-N 3.31Å; L253-Y258 CarbonylContact C-O 3.6Å; L253-Y258 HydrophobicContact CD1-CD2 4.28Å; L253-Y258 HydrophobicContact CD1-CG 4.23Å; L253-Y258 PolarHBondContact O-N 3.27Å; L253-Y258 VanDerWaalsContact O-N 3.07Å; L253-E260 HydrophobicContact CD2-CB 4.47Å; L253-E260 HydrophobicContact CD2-CG 3.74Å; L253-L263 HydrophobicContact CD1-CD1 3.84Å; L253-L263 HydrophobicContact CD2-CD1 3.8Å; L253-L263 HydrophobicContact CG-CD1 4.12Å; L253-R268 HydrophobicContact CD2-CG 4.07Å; L253-I271 HydrophobicContact CD1-CB 3.98Å; L253-I271 HydrophobicContact CD1-CD1 4.25Å; L253-I271 HydrophobicContact CD1-CG2 3.41Å; L253-I271 VanDerWaalsContact CD1-CG2 3.41Å
254R85.8Confident85.7Confident157 Ų15788.3 Ų88.359%0.59245%0.445SS*.Hα-helixtrans-59.7-45.2172.6-167.4-17281.7-144.6-4.1112L250 E251 M256 G257L250-R254 WeakPolarHBondContact O-CB 3.4Å; L250-R254 PolarHBondContact O-N 3.48Å; E251-R254 WeakPolarHBondContact O-CB 3.33Å; E251-R254 PolarHBondContact O-N 3.29Å; E251-R254 IonicContact OE1-CZ 3.94Å; E251-R254 IonicContact OE1-NH1 3.57Å; E251-R254 IonicContact OE1-NH2 2.73Å; E251-R254 PolarHBondContact OE1-NH2 3.48Å; R254-M256 PolarHBondContact O-N 2.71Å; R254-G257 PolarHBondContact O-N 3.36Å
255T86.9Confident85.8Confident107 Ų10790.4 Ų90.466%0.65646%0.457SS*.Hα-helixtrans-61.9-32.9177.1-60.50000112.1E251 R252 G257E251-T255 PolarHBondContact O-N 2.85Å; E251-T255 PolarHBondContact O-OG1 3.39Å; R252-T255 PolarHBondContact O-N 2.75Å; T255-G257 PolarHBondContact O-N 2.77Å
256M83.8Confident86Confident64 Ų6492.4 Ų92.432%0.31546%0.459SS..THydrogen-bonded Turntrans-81.13.2174.6-69.1-171.4-76.700113.7R252 L253 R254 Y258 I271 L272R252-M256 PolarHBondContact O-N 2.72Å; R252-M256 VanDerWaalsContact O-N 3.16Å; L253-M256 CarbonylContact O-C 3.58Å; L253-M256 PolarHBondContact O-N 2.87Å; R254-M256 PolarHBondContact O-N 2.71Å; M256-Y258 HydrophobicContact CB-CD2 3.62Å; M256-Y258 HydrophobicContact CB-CE2 3.91Å; M256-Y258 VanDerWaalsContact O-CD2 3.24Å; M256-Y258 WeakPolarHBondContact O-CD2 3.38Å; M256-Y258 WeakPolarHBondContact O-CE2 3.4Å; M256-I271 HydrophobicContact CE-CG2 3.49Å; M256-I271 VanDerWaalsContact CE-CG2 3.49Å; M256-I271 HydrophobicContact SD-CG2 4.01Å; M256-L272 HydrophobicContact CE-CD2 4.45Å
257G86.1Confident86.2Confident70 Ų7090.6 Ų90.672%0.72245%0.451SS*.THydrogen-bonded Turntrans79.215.1176.200000114.8L253 R254 T255L253-G257 PolarHBondContact O-N 3.31Å; R254-G257 PolarHBondContact O-N 3.36Å; T255-G257 PolarHBondContact O-N 2.77Å
258Y86Confident86.2Confident116 Ų11687.4 Ų87.446%0.45544%0.435SS..  trans-102.3139.1-178.9-65.8-81.2000111.7L253 M256 L263 I271L253-Y258 CarbonylContact C-O 3.6Å; L253-Y258 HydrophobicContact CD1-CD2 4.28Å; L253-Y258 HydrophobicContact CD1-CG 4.23Å; L253-Y258 PolarHBondContact O-N 3.27Å; L253-Y258 VanDerWaalsContact O-N 3.07Å; M256-Y258 HydrophobicContact CB-CD2 3.62Å; M256-Y258 HydrophobicContact CB-CE2 3.91Å; M256-Y258 VanDerWaalsContact O-CD2 3.24Å; M256-Y258 WeakPolarHBondContact O-CD2 3.38Å; M256-Y258 WeakPolarHBondContact O-CE2 3.4Å; Y258-L263 HydrophobicContact CD1-CD1 4.26Å; Y258-L263 HydrophobicContact CG-CD1 4.2Å; Y258-I271 HydrophobicContact CD1-CD1 3.84Å; Y258-I271 HydrophobicContact CD2-CD1 4.29Å; Y258-I271 HydrophobicContact CD2-CG2 3.66Å; Y258-I271 HydrophobicContact CE1-CD1 4.02Å; Y258-I271 HydrophobicContact CE2-CD1 4.46Å; Y258-I271 HydrophobicContact CE2-CG2 3.79Å; Y258-I271 HydrophobicContact CG-CD1 3.99Å; Y258-I271 HydrophobicContact CG-CG2 4.33Å
259D84.4Confident86.3Confident79 Ų7989.1 Ų89.142%0.42244%0.443SS..  trans-91.8126.6176.6-177.4-11.2000110.6T261 K262 L263D259-T261 VanDerWaalsContact C-N 3.32Å; D259-T261 VanDerWaalsContact CG-OG1 3.31Å; D259-T261 PolarHBondContact O-N 3.37Å; D259-T261 PolarHBondContact OD1-N 2.85Å; D259-T261 PolarHBondContact OD1-OG1 3.14Å; D259-T261 PolarHBondContact OD2-OG1 3.13Å; D259-K262 HydrophobicContact CB-CB 4.44Å; D259-K262 HydrophobicContact CB-CG 4.25Å; D259-K262 PolarHBondContact O-N 3.45Å; D259-L263 WeakPolarHBondContact O-CG 3.25Å; D259-L263 PolarHBondContact O-N 2.91Å
260E81.1Confident86.5Confident49 Ų4989.4 Ų89.423%0.22945%0.446CS..G310 helixtrans-63.1-36.3-178.8-66152.6-154.400113.1L250 L253 K262 L263 R268L250-E260 VanDerWaalsContact CA-OE1 3.25Å; L250-E260 WeakPolarHBondContact CA-OE1 3.49Å; L250-E260 WeakPolarHBondContact CB-OE1 3.21Å; L250-E260 WeakPolarHBondContact CD2-OE1 3.15Å; L250-E260 WeakPolarHBondContact CD2-OE2 3.48Å; L250-E260 HydrophobicContact CG-CG 4.15Å; L250-E260 WeakPolarHBondContact CG-OE1 3.48Å; L250-E260 WeakPolarHBondContact CG-OE2 3.28Å; L253-E260 HydrophobicContact CD2-CB 4.47Å; L253-E260 HydrophobicContact CD2-CG 3.74Å; E260-K262 PolarHBondContact O-N 2.87Å; E260-L263 PolarHBondContact O-N 2.88Å; E260-R268 PolarHBondContact O-NH2 3.5Å
261T84.2Confident86.7Confident120 Ų12088 Ų8874%0.73644%0.439SS*.G310 helixtrans-70.6-17.4-176.764.70000111.9D259D259-T261 VanDerWaalsContact C-N 3.32Å; D259-T261 VanDerWaalsContact CG-OG1 3.31Å; D259-T261 PolarHBondContact O-N 3.37Å; D259-T261 PolarHBondContact OD1-N 2.85Å; D259-T261 PolarHBondContact OD1-OG1 3.14Å; D259-T261 PolarHBondContact OD2-OG1 3.13Å
262K87Confident86.7Confident166 Ų16685 Ų8572%0.72243%0.425SS*.G310 helixtrans-101.5-2.7179.5-56.2-153.9-179.7-172.40113.6D259 E260D259-K262 HydrophobicContact CB-CB 4.44Å; D259-K262 HydrophobicContact CB-CG 4.25Å; D259-K262 PolarHBondContact O-N 3.45Å; E260-K262 PolarHBondContact O-N 2.87Å
263L85.9Confident86.6Confident24 Ų2487.4 Ų87.413%0.12644%0.439CS..SBendtrans-115.1124.4-177.6-69.4174.6000111.8L253 Y258 D259 E260 Q267 R268 I271L253-L263 HydrophobicContact CD1-CD1 3.84Å; L253-L263 HydrophobicContact CD2-CD1 3.8Å; L253-L263 HydrophobicContact CG-CD1 4.12Å; Y258-L263 HydrophobicContact CD1-CD1 4.26Å; Y258-L263 HydrophobicContact CG-CD1 4.2Å; D259-L263 WeakPolarHBondContact O-CG 3.25Å; D259-L263 PolarHBondContact O-N 2.91Å; E260-L263 PolarHBondContact O-N 2.88Å; L263-Q267 HydrophobicContact CB-CB 4.35Å; L263-Q267 HydrophobicContact CD2-CB 3.92Å; L263-R268 HydrophobicContact CB-CG 3.97Å; L263-R268 PolarHBondContact O-NE 3.48Å; L263-R268 VanDerWaalsContact O-NE 3.13Å; L263-I271 HydrophobicContact CD1-CD1 3.48Å; L263-I271 VanDerWaalsContact CD1-CD1 3.48Å; L263-I271 HydrophobicContact CD2-CD1 3.86Å; L263-I271 HydrophobicContact CG-CD1 4.33Å
264A90.6Very high86.4Confident34 Ų3494.7 Ų94.728%0.28147%0.47SS..  trans-63.2152.7170.600000110.8W266 Q267 R268A264-W266 PolarHBondContact O-N 3.05Å; A264-Q267 HydrophobicContact CB-CG 4.33Å; A264-Q267 WeakPolarHBondContact O-CB 3.26Å; A264-Q267 PolarHBondContact O-N 2.82Å; A264-R268 PolarHBondContact O-N 2.77Å; A264-R268 VanDerWaalsContact O-N 3.12Å
265P88.5Confident85.7Confident102 Ų10288 Ų8866%0.66245%0.45SS*.Hα-helixtrans-52.4-35.7-176.7-29.635.7000114.8R268 Q269P265-R268 WeakPolarHBondContact O-CB 3.31Å; P265-R268 PolarHBondContact O-N 3.28Å; P265-Q269 PolarHBondContact O-N 3.16Å
266W89.8Confident84.7Confident159 Ų15987 Ų8760%0.60244%0.441SS*.Hα-helixtrans-71.4-33177.269.9-92.2000113A264 Q269 I270A264-W266 PolarHBondContact O-N 3.05Å; W266-Q269 PolarHBondContact O-N 3.42Å; W266-I270 HydrophobicContact CE3-CD1 3.5Å; W266-I270 VanDerWaalsContact CE3-CD1 3.5Å; W266-I270 HydrophobicContact CE3-CG1 4.46Å; W266-I270 HydrophobicContact CZ3-CD1 3.53Å; W266-I270 WeakPolarHBondContact O-CG1 3.31Å; W266-I270 PolarHBondContact O-N 2.64Å; W266-I270 VanDerWaalsContact O-N 3.09Å
267Q89.3Confident83.5Confident63 Ų6389.7 Ų89.729%0.29446%0.456SS..Hα-helixtrans-69.8-39.2175.7-62174.2-68.200110.5L263 A264 Q269 I270 I271L263-Q267 HydrophobicContact CB-CB 4.35Å; L263-Q267 HydrophobicContact CD2-CB 3.92Å; A264-Q267 HydrophobicContact CB-CG 4.33Å; A264-Q267 WeakPolarHBondContact O-CB 3.26Å; A264-Q267 PolarHBondContact O-N 2.82Å; Q267-Q269 VanDerWaalsContact C-N 3.31Å; Q267-Q269 PolarHBondContact O-N 2.81Å; Q267-I270 PolarHBondContact O-N 2.94Å; Q267-I271 WeakPolarHBondContact O-CB 3.48Å; Q267-I271 WeakPolarHBondContact O-CG1 3.24Å; Q267-I271 PolarHBondContact O-N 2.88Å
268R89.3Confident82.2Confident81 Ų8190.5 Ų90.531%0.30646%0.455SS..Hα-helixtrans-55.5-47.2172.8-59179.3-173.1-165.5-2.1110.5L253 E260 L263 A264 P265 I270 I271 L272L253-R268 HydrophobicContact CD2-CG 4.07Å; E260-R268 PolarHBondContact O-NH2 3.5Å; L263-R268 HydrophobicContact CB-CG 3.97Å; L263-R268 PolarHBondContact O-NE 3.48Å; L263-R268 VanDerWaalsContact O-NE 3.13Å; A264-R268 PolarHBondContact O-N 2.77Å; A264-R268 VanDerWaalsContact O-N 3.12Å; P265-R268 WeakPolarHBondContact O-CB 3.31Å; P265-R268 PolarHBondContact O-N 3.28Å; R268-I270 PolarHBondContact O-N 2.86Å; R268-I271 PolarHBondContact O-N 2.75Å; R268-L272 WeakPolarHBondContact O-CB 3.28Å; R268-L272 VanDerWaalsContact O-CG 3.24Å; R268-L272 WeakPolarHBondContact O-CG 3.42Å; R268-L272 PolarHBondContact O-N 3.24Å
269Q87.1Confident80.7Confident144 Ų14493.7 Ų93.767%0.67347%0.472SS*.Hα-helixtrans-60.7-44.3175.8-76.2-173.9-13.500113P265 W266 Q267 K273P265-Q269 PolarHBondContact O-N 3.16Å; W266-Q269 PolarHBondContact O-N 3.42Å; Q267-Q269 VanDerWaalsContact C-N 3.31Å; Q267-Q269 PolarHBondContact O-N 2.81Å; Q269-K273 WeakPolarHBondContact O-CB 3.33Å; Q269-K273 PolarHBondContact O-N 3.01Å
270I89.1Confident78.8Confident92 Ų92102.1 Ų102.147%0.47250%0.504SS..Hα-helixtrans-64.4-42178.7-68.6175.6000111.3W266 Q267 R268 K273 K274W266-I270 HydrophobicContact CE3-CD1 3.5Å; W266-I270 VanDerWaalsContact CE3-CD1 3.5Å; W266-I270 HydrophobicContact CE3-CG1 4.46Å; W266-I270 HydrophobicContact CZ3-CD1 3.53Å; W266-I270 WeakPolarHBondContact O-CG1 3.31Å; W266-I270 PolarHBondContact O-N 2.64Å; W266-I270 VanDerWaalsContact O-N 3.09Å; Q267-I270 PolarHBondContact O-N 2.94Å; R268-I270 PolarHBondContact O-N 2.86Å; I270-K273 PolarHBondContact O-N 3.33Å; I270-K274 WeakPolarHBondContact O-CB 3.36Å; I270-K274 PolarHBondContact O-N 3.05Å
271I87Confident78.7Confident23 Ų23104.8 Ų104.812%0.11852%0.518CS..Hα-helixtrans-69.4-45.3-178.8-68.7163.8000110.7L253 M256 Y258 L263 Q267 R268 K273 K274 G275L253-I271 HydrophobicContact CD1-CB 3.98Å; L253-I271 HydrophobicContact CD1-CD1 4.25Å; L253-I271 HydrophobicContact CD1-CG2 3.41Å; L253-I271 VanDerWaalsContact CD1-CG2 3.41Å; M256-I271 HydrophobicContact CE-CG2 3.49Å; M256-I271 VanDerWaalsContact CE-CG2 3.49Å; M256-I271 HydrophobicContact SD-CG2 4.01Å; Y258-I271 HydrophobicContact CD1-CD1 3.84Å; Y258-I271 HydrophobicContact CD2-CD1 4.29Å; Y258-I271 HydrophobicContact CD2-CG2 3.66Å; Y258-I271 HydrophobicContact CE1-CD1 4.02Å; Y258-I271 HydrophobicContact CE2-CD1 4.46Å; Y258-I271 HydrophobicContact CE2-CG2 3.79Å; Y258-I271 HydrophobicContact CG-CD1 3.99Å; Y258-I271 HydrophobicContact CG-CG2 4.33Å; L263-I271 HydrophobicContact CD1-CD1 3.48Å; L263-I271 VanDerWaalsContact CD1-CD1 3.48Å; L263-I271 HydrophobicContact CD2-CD1 3.86Å; L263-I271 HydrophobicContact CG-CD1 4.33Å; Q267-I271 WeakPolarHBondContact O-CB 3.48Å; Q267-I271 WeakPolarHBondContact O-CG1 3.24Å; Q267-I271 PolarHBondContact O-N 2.88Å; R268-I271 PolarHBondContact O-N 2.75Å; I271-K273 VanDerWaalsContact C-N 3.35Å; I271-K273 PolarHBondContact O-N 3.07Å; I271-K274 PolarHBondContact O-N 2.82Å; I271-G275 PolarHBondContact O-N 3.45Å
272L85.7Confident78.4Confident23 Ų23103.9 Ų103.912%0.1251%0.507CS..Hα-helixtrans-58.7-47.2173.5-71.2169.3000110.8E249 R252 M256 R268 K274 G275 D276E249-L272 HydrophobicContact CB-CD1 4.08Å; E249-L272 HydrophobicContact CB-CD2 4.45Å; E249-L272 HydrophobicContact CG-CD1 4.08Å; R252-L272 HydrophobicContact CB-CD2 3.75Å; M256-L272 HydrophobicContact CE-CD2 4.45Å; R268-L272 WeakPolarHBondContact O-CB 3.28Å; R268-L272 VanDerWaalsContact O-CG 3.24Å; R268-L272 WeakPolarHBondContact O-CG 3.42Å; R268-L272 PolarHBondContact O-N 3.24Å; L272-K274 VanDerWaalsContact C-N 3.33Å; L272-K274 PolarHBondContact O-N 3.04Å; L272-G275 PolarHBondContact O-N 3.26Å; L272-D276 PolarHBondContact O-N 3.24Å; L272-D276 VanDerWaalsContact O-N 3.13Å
273K85.2Confident78Confident158 Ų158100.5 Ų100.569%0.68750%0.495SS*.Hα-helixtrans-62.1-36.9177.6-164116.6176.8177.30112.8Q269 I270 I271 I277Q269-K273 WeakPolarHBondContact O-CB 3.33Å; Q269-K273 PolarHBondContact O-N 3.01Å; I270-K273 PolarHBondContact O-N 3.33Å; I271-K273 VanDerWaalsContact C-N 3.35Å; I271-K273 PolarHBondContact O-N 3.07Å; K273-I277 VanDerWaalsContact O-CD1 3.27Å; K273-I277 WeakPolarHBondContact O-CD1 3.16Å; K273-I277 VanDerWaalsContact O-CG1 3.26Å; K273-I277 WeakPolarHBondContact O-CG1 3.11Å
274K82.8Confident77.5Confident157 Ų157105 Ų10568%0.68352%0.516SS*.Hα-helixtrans-77.4-33.8178.7-168.1170.3176.6-175.40112.4I270 I271 L272 D276 I277 A278I270-K274 WeakPolarHBondContact O-CB 3.36Å; I270-K274 PolarHBondContact O-N 3.05Å; I271-K274 PolarHBondContact O-N 2.82Å; L272-K274 VanDerWaalsContact C-N 3.33Å; L272-K274 PolarHBondContact O-N 3.04Å; K274-D276 VanDerWaalsContact C-N 3.34Å; K274-I277 PolarHBondContact O-N 3.37Å; K274-A278 PolarHBondContact O-N 2.89Å
275G69.8Low76.7Confident17 Ų17109.4 Ų109.418%0.17553%0.531CS..Hα-helixtrans-65.4-34.1174.200000113.3I271 L272I271-G275 PolarHBondContact O-N 3.45Å; L272-G275 PolarHBondContact O-N 3.26Å
276D65.5Low75.9Confident87 Ų87109.9 Ų109.947%0.46552%0.522SS..Hα-helixtrans-71.9-30.1176-70.5-27.5000112.9R252 L272 K274 A278R252-D276 IonicContact NE-OD1 2.79Å; L272-D276 PolarHBondContact O-N 3.24Å; L272-D276 VanDerWaalsContact O-N 3.13Å; K274-D276 VanDerWaalsContact C-N 3.34Å; D276-A278 VanDerWaalsContact C-N 3.34Å
277I60Low74.9Confident120 Ų120106.4 Ų106.462%0.61552%0.517SS*.Hα-helixtrans-72.5-28.7178.6-62.5161.8000111.3K273 K274 K279K273-I277 VanDerWaalsContact O-CD1 3.27Å; K273-I277 WeakPolarHBondContact O-CD1 3.16Å; K273-I277 VanDerWaalsContact O-CG1 3.26Å; K273-I277 WeakPolarHBondContact O-CG1 3.11Å; K274-I277 PolarHBondContact O-N 3.37Å; I277-K279 VanDerWaalsContact C-N 3.28Å; I277-K279 PolarHBondContact O-N 2.71Å
278A57.1Low73.8Confident87 Ų87109.8 Ų109.872%0.71953%0.534SS*.THydrogen-bonded Turntrans-77.9-7.9-179.400000114.3K274 D276K274-A278 PolarHBondContact O-N 2.89Å; D276-A278 VanDerWaalsContact C-N 3.34Å
279K55.8Low72.5Confident183 Ų183112.2 Ų112.280%0.79655%0.553SS**THydrogen-bonded Turntrans-104.68.3-179.2-75.6-173.3177.6176.90114.2I277I277-K279 VanDerWaalsContact C-N 3.28Å; I277-K279 PolarHBondContact O-N 2.71Å
280K44.8Very low71.2Confident255 Ų255109.3 Ų109.3100%1.10954%0.542SS*.  trans-116.80178.2-134.4-176-172-176.20110.5

Retrieved 280 of 280 residues in 234.6 ms (Link to these results)