A0A075BJP4_DROME Loading...

Nanos

AlphaFold DB , UniProt , Accession A0A075BJP4, Species DROME (Drosophila melanogaster, Fruit fly), Gene nos, Length 348 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
1P34.6Very low34.5Very low175 Ų175147.2 Ų147.2100%1.13682%0.819SS**  0135.2027.2-7.9000111.8
2S33.7Very low34.5Very low104 Ų104149.3 Ų149.373%0.72783%0.826SS**  cis170.3159.6-16.7320000106.7
3L35.1Very low34.4Very low156 Ų156151.2 Ų151.282%0.81783%0.825SS**  trans89.5107.2-175-53.6165.9000112.6
4T39.2Very low34.3Very low117 Ų117150.9 Ų150.972%0.71882%0.822SS**  76.9140.562.365.40000113.1
5Q38.4Very low34.1Very low169 Ų169151.1 Ų151.179%0.7982%0.822SS**  cis-159.51638.3-141.6-179.34.600110.8
6S32.8Very low34Very low113 Ų113153.4 Ų153.479%0.7982%0.822SS**  trans52.9142.6155.1-57.80000120.3
7G31.9Very low34Very low72 Ų72151 Ų15174%0.74282%0.82SS**  cis135.7113.7300000111
8K32.6Very low34Very low197 Ų197146.8 Ų146.886%0.85781%0.809SS**  trans-150.1118171.9-103.6173.3-177.4174.80110.3
9I34Very low34Very low156 Ų156150.4 Ų150.480%0.882%0.816SS**  trans-91.3138.2166.9-65.3168.8000107Q11I9-Q11 HydrophobicContact CG2-CG 4.42Å
10F34.2Very low34.3Very low186 Ų186152.1 Ų152.182%0.81682%0.818SS**  trans-118.1113163.7-108.3-85.9000109
11Q32.8Very low34.6Very low174 Ų174149.2 Ų149.281%0.81382%0.815SS**  trans-80.5147.7161.8-67.5171.9-16.600108I9I9-Q11 HydrophobicContact CG2-CG 4.42Å
12L35Very low34.8Very low172 Ų172153 Ų15390%0.90181%0.807SS**  trans-121.3105.8168.9-101.7168.1000110
13Q33.4Very low34.7Very low174 Ų174152 Ų15281%0.81381%0.813SS**  trans-25.2126.3177.4-151.470.53500117.1
14D32.4Very low34.7Very low148 Ų148147.7 Ų147.779%0.79181%0.807SS**  trans-61.2134.2157.8-61.2-83.5000110.7
15N31.7Very low34.5Very low153 Ų153150.3 Ų150.382%0.81882%0.815SS**  trans-109.490176.4-163.3-18.9000110.9
16F32.4Very low34.6Very low188 Ų188148.2 Ų148.283%0.82581%0.81SS**  trans-92131.7173.9-124.1-88.8000110.2
17S34Very low35.1Very low113 Ų113150.9 Ų150.979%0.7981%0.813SS**  trans-149111.3165.5-81.80000109.1
18A34.2Very low35.6Very low75 Ų75155.1 Ų155.162%0.6282%0.818SS**  trans-100.1146.4-176.700000111.3
19F33.4Very low35.6Very low216 Ų216149.2 Ų149.295%0.94781%0.813SS**  trans-129.8136161.3-101.6-89.5000109.7
20H40Very low36Very low184 Ų184149.8 Ų149.885%0.85282%0.817SS**  trans-84.8153-173.8-94.3-108.2000113.3
21A40.6Very low36Very low91 Ų91149 Ų14975%0.75282%0.816SS**  trans-56.7147.9-179.200000115.5
22R38.6Very low36.2Very low254 Ų254147.9 Ų147.996%0.95882%0.815SS**  trans-162.3151.1131-81-139.8171.4-177.3-3111
23G31.4Very low36.4Very low84 Ų84148.3 Ų148.387%0.86682%0.815SS**  trans107.4134.116900000114.4
24G35.1Very low36.5Very low66 Ų66150.7 Ų150.768%0.6882%0.818SS**  trans-130.2-165.7168.400000110
25L36.1Very low36.7Very low171 Ų171150.4 Ų150.490%0.89582%0.816SS**  trans73.5145.2-162.6-48.9169.9000111.6
26N40Very low36.8Very low126 Ų126149.5 Ų149.567%0.67481%0.811SS**  cis-146.1148.1-4.6-154.8-16000109.7
27I43.4Very low36.9Very low168 Ų168146.6 Ų146.686%0.86281%0.809SS**  trans-136.775.917239.2171.1000111.2
28L42.2Very low36.9Very low162 Ų162146.1 Ų146.185%0.84881%0.805SS**  trans-129.9127.4152.6-80.697.5000108.1
29G33.3Very low36.8Very low73 Ų73146.6 Ų146.675%0.75382%0.817SS**  trans-172.692.4179.900000111.7
30L40.9Very low36.7Very low167 Ų167141.2 Ų141.287%0.87481%0.813SS**  trans160.560.8150.6-88.3167000110.9
31Q35.6Very low36.3Very low170 Ų170140 Ų14079%0.79481%0.813SS**  trans-119.7141.4156.7-111.780.388.100108.3
32D37.2Very low35.9Very low150 Ų150141.4 Ų141.480%0.80282%0.817SS**  trans54.490.6160-49.3-33.2000119.1
33M38.1Very low35.7Very low182 Ų182135.1 Ų135.190%0.89781%0.812SS**  trans-119.1107.6134.7-81.4-145.5-59.300109.4
34Y36.3Very low35.7Very low223 Ų223135.3 Ų135.388%0.87581%0.806SS**  trans-121.4108.8166.2-167.1-88.1000108.4
35L37Very low35.6Very low143 Ų143138 Ų13875%0.74981%0.809SS**  trans-133.5154.7170.5-86.284.8000107.8
36D32.2Very low35.5Very low133 Ų133137.3 Ų137.371%0.71181%0.805SS**  cis-167.8142.1-28.9-1768.5000105.1
37T35.1Very low35.4Very low128 Ų128136.2 Ų136.279%0.78581%0.807SS**  trans-14572-179.4-34.60000113
38S35.2Very low35.5Very low102 Ų102134.3 Ų134.371%0.71381%0.806SS**  trans46.593.3146.263.20000117.3
39G30.5Very low35.7Very low85 Ų85131.9 Ų131.988%0.87680%0.8SS**  trans-72.7176.2171.600000114.9
40A31.3Very low35.7Very low103 Ų103136.1 Ų136.185%0.85180%0.804SS**  trans-135.2137.9168.600000110.4
41N32.3Very low35.6Very low160 Ų160134.1 Ų134.186%0.85680%0.799SS**  trans-63.3142.6-170.4-51-49.5000113.9
42S32.6Very low36.5Very low119 Ų119131 Ų13183%0.83279%0.793SS**  169.1146.5107-72.10000113.3
43S33.4Very low36.4Very low122 Ų122130.7 Ų130.785%0.85380%0.796SS**  trans-88.4146.5173.3-47.20000111.7
44A31.6Very low36.5Very low89 Ų89127.5 Ų127.574%0.73679%0.787SS**  trans175.9139.3134.800000115.5
45T33.5Very low37.3Very low122 Ų122122.9 Ų122.975%0.74878%0.784SS**  trans41114.4141.860.60000123.3
46L34.3Very low37.2Very low157 Ų157121.9 Ų121.982%0.82278%0.78SS**  44.5120.6117.5-64.5166.6000121.4
47S38.1Very low37.9Very low103 Ų103121.3 Ų121.372%0.7278%0.783SS**  trans68.1122.1143.4-57.50000120.4
48P44Very low38Very low127 Ų127119.7 Ų119.783%0.82578%0.777SS**  trans-84.8153.2165.736.2-33.8000112
49P47.5Very low38Very low112 Ų112121.2 Ų121.273%0.72778%0.782SS**  trans-144.5173.2137.538.1-23000115.1
50I32.8Very low38.3Very low162 Ų162122 Ų12283%0.83178%0.775SS**  trans68.6131.3164.8-5.9179.1000120.3
51T39.7Very low39.1Very low125 Ų125122 Ų12277%0.76777%0.774SS**  trans-85.7-162.5159.553.20000109.1
52P53.7Low39.2Very low104 Ų104123.3 Ų123.368%0.67578%0.776SS**  cis-136.8173.1-5.743.1-26.9000116.1
53V34.4Very low39.5Very low144 Ų144123.2 Ų123.287%0.87378%0.775SS**  trans-144.9137.3145.5-174.50000109.4
54T40.5Very low40Very low114 Ų114123.3 Ų123.370%0.69977%0.77SS**  trans-127.7159.4170.2-20.30000108.3
55P53Low40.3Very low126 Ų126126.3 Ų126.382%0.81877%0.769SS**  -147.7172.692.136.6-17.6000117.1
56D35.9Very low40.6Very low122 Ų122128.6 Ų128.665%0.65277%0.769SS**  trans-66168.9178.6-119.3-79.9000114.2S58D56-S58 PolarHBondContact OD1-N 3.39Å; D56-S58 PolarHBondContact OD1-OG 2.92Å
57P47.3Very low41.6Very low122 Ų122126 Ų12679%0.79276%0.761SS**  -144.9120.962.335.9-13.9000118.7
58S37.1Very low41.8Very low93 Ų93130 Ų13065%0.6577%0.766SS**  47.9105116.5-62.20000121.1D56D56-S58 PolarHBondContact OD1-N 3.39Å; D56-S58 PolarHBondContact OD1-OG 2.92Å
59T34.9Very low42.4Very low134 Ų134131.9 Ų131.982%0.82277%0.768SS**  trans-153.4145.3134.1-23.80000113.7
60S36.3Very low42.5Very low103 Ų103130 Ų13072%0.7276%0.762SS**  trans47110151.457.80000120.1
61A47.3Very low43.4Very low102 Ų102128 Ų12884%0.84375%0.753SS**  trans-40.8135.816600000115.9
62Q35.4Very low44.5Very low188 Ų188125.6 Ų125.688%0.87974%0.742SS**  trans-123.3126.6148.3-70.6-168.6-4.300108.8T64Q62-T64 PolarHBondContact O-N 3.28Å
63S38.8Very low44.9Very low117 Ų117124.1 Ų124.182%0.81874%0.738SS**  trans-72110.2179.351.60000110.5H65S63-H65 VanDerWaalsContact C-N 3.3Å; S63-H65 PolarHBondContact O-N 3.18Å
64T43Very low46.4Very low124 Ų124120.1 Ų120.176%0.76172%0.72SS**  trans-68.987.9169.438.10000110.1Q62 F66Q62-T64 PolarHBondContact O-N 3.28Å; T64-F66 PolarHBondContact O-N 2.81Å
65H39.2Very low47.9Very low151 Ų151118.2 Ų118.270%0.69971%0.709SS**  trans-61.5101169.6173.143.5000109.2S63 P67S63-H65 VanDerWaalsContact C-N 3.3Å; S63-H65 PolarHBondContact O-N 3.18Å; H65-P67 VanDerWaalsContact O-CD 3.28Å; H65-P67 WeakPolarHBondContact O-CD 3.32Å
66F40Very low48.9Very low170 Ų170114.5 Ų114.575%0.74669%0.688SS**PPolyproline II helixtrans-61.3120.1163.8-85.2-95.8000108.5T64 F68T64-F66 PolarHBondContact O-N 2.81Å; F66-F68 PolarHBondContact O-N 3.49Å
67P54.4Low51.1Low103 Ų103113.6 Ų113.667%0.66968%0.683SS**PPolyproline II helixtrans-62.3126.1169.8-19.933.8000108.7H65 L69H65-P67 VanDerWaalsContact O-CD 3.28Å; H65-P67 WeakPolarHBondContact O-CD 3.32Å; P67-L69 PolarHBondContact O-N 3.44Å
68F42.4Very low52.9Low186 Ų186111 Ų11182%0.81667%0.668SS**PPolyproline II helixtrans-61.7134.8-177.7-104.1-113.9000111.2F66 A70F66-F68 PolarHBondContact O-N 3.49Å; F68-A70 HydrophobicContact CB-CB 4.32Å; F68-A70 PolarHBondContact O-N 3.45Å
69L56.8Low55.4Low167 Ų167111.6 Ų111.687%0.87466%0.664SS**SBendtrans-7570.7171.8-71.4172.8000110.5P67P67-L69 PolarHBondContact O-N 3.44Å
70A49.8Very low58Low72 Ų72109 Ų10960%0.59564%0.644SS**  trans-132.525.6-173.800000113.6F68F68-A70 HydrophobicContact CB-CB 4.32Å; F68-A70 PolarHBondContact O-N 3.45Å
71D50.9Low60.6Low121 Ų121110.1 Ų110.165%0.64764%0.64SS**  trans-152.239.5171.1-113.2-32.4000112.5A73 A74 T75D71-A73 VanDerWaalsContact C-N 3.3Å; D71-A73 PolarHBondContact O-N 2.88Å; D71-A74 PolarHBondContact O-N 3.38Å; D71-T75 PolarHBondContact O-N 3.08Å; D71-T75 PolarHBondContact O-OG1 3.08Å
72S62.5Low62.8Low75 Ų75111.5 Ų111.552%0.52463%0.629SS.*Hα-helixtrans-65.3-23.7-162.2-44.30000115.2A76S72-A76 WeakPolarHBondContact O-CB 3.45Å; S72-A76 PolarHBondContact O-N 2.93Å
73A62.8Low65.6Low72 Ų72110.2 Ų110.260%0.59562%0.616SS**Hα-helixtrans-86.3-39.3-178.400000113D71 N77D71-A73 VanDerWaalsContact C-N 3.3Å; D71-A73 PolarHBondContact O-N 2.88Å; A73-N77 PolarHBondContact O-N 2.93Å; A73-N77 VanDerWaalsContact O-N 3.16Å; A73-N77 PolarHBondContact O-ND2 2.99Å
74A65.7Low68.2Low61 Ų61110.4 Ų110.450%0.50460%0.604SS.*Hα-helixtrans-70.7-44.4179.700000111.2D71 N77 S78D71-A74 PolarHBondContact O-N 3.38Å; A74-N77 PolarHBondContact O-N 3.44Å; A74-S78 PolarHBondContact O-N 2.86Å
75T72.9Confident70.7Confident74 Ų74111.7 Ų111.745%0.45460%0.596SS.*Hα-helixtrans-66.8-37.417749.70000113D71 N77 S78 L79D71-T75 PolarHBondContact O-N 3.08Å; D71-T75 PolarHBondContact O-OG1 3.08Å; T75-N77 VanDerWaalsContact C-N 3.35Å; T75-S78 PolarHBondContact O-OG 2.97Å; T75-S78 VanDerWaalsContact O-OG 3.04Å; T75-L79 WeakPolarHBondContact O-CG 3.26Å; T75-L79 PolarHBondContact O-N 3.12Å; T75-L79 VanDerWaalsContact O-N 3.15Å
76A73.4Confident73.4Confident47 Ų47110.4 Ų110.439%0.38859%0.59SS.*Hα-helixtrans-65-37.6172.100000112.6S72 L80S72-A76 WeakPolarHBondContact O-CB 3.45Å; S72-A76 PolarHBondContact O-N 2.93Å; A76-L80 WeakPolarHBondContact O-CB 3.48Å; A76-L80 PolarHBondContact O-N 2.93Å
77N82.4Confident76.1Confident103 Ų103109.9 Ų109.955%0.55158%0.584SS**Hα-helixtrans-68.8-41.7176.3-88.6-79.2000112.8A73 A74 T75 L79 L80 M81A73-N77 PolarHBondContact O-N 2.93Å; A73-N77 VanDerWaalsContact O-N 3.16Å; A73-N77 PolarHBondContact O-ND2 2.99Å; A74-N77 PolarHBondContact O-N 3.44Å; T75-N77 VanDerWaalsContact C-N 3.35Å; N77-L79 PolarHBondContact O-N 3.11Å; N77-L80 PolarHBondContact O-N 3.43Å; N77-M81 PolarHBondContact O-N 3.48Å
78S85.3Confident78.1Confident69 Ų69110.8 Ų110.848%0.48358%0.579SS.*Hα-helixtrans-64.7-40.2177.463.40000112A74 T75 L80 M81 Q82A74-S78 PolarHBondContact O-N 2.86Å; T75-S78 PolarHBondContact O-OG 2.97Å; T75-S78 VanDerWaalsContact O-OG 3.04Å; S78-L80 PolarHBondContact O-N 2.69Å; S78-M81 PolarHBondContact O-N 3.16Å; S78-Q82 VanDerWaalsContact O-CB 3.32Å; S78-Q82 WeakPolarHBondContact O-CB 3.11Å; S78-Q82 PolarHBondContact O-N 3.32Å
79L88.2Confident80.7Confident105 Ų105105.4 Ų105.455%0.5556%0.558SS.*Hα-helixtrans-65.6-34.5173.2-69.7171.7000113T75 N77 R83T75-L79 WeakPolarHBondContact O-CG 3.26Å; T75-L79 PolarHBondContact O-N 3.12Å; T75-L79 VanDerWaalsContact O-N 3.15Å; N77-L79 PolarHBondContact O-N 3.11Å; L79-R83 WeakPolarHBondContact O-CB 3.46Å; L79-R83 PolarHBondContact O-N 3.3Å; L79-R83 VanDerWaalsContact O-N 3.1Å
80L90.4Very high82.6Confident78 Ų78101.8 Ų101.841%0.40854%0.539SS..Hα-helixtrans-65.8-48.4172.4-90.9163.7000112A76 N77 S78 R83 Q84A76-L80 WeakPolarHBondContact O-CB 3.48Å; A76-L80 PolarHBondContact O-N 2.93Å; N77-L80 PolarHBondContact O-N 3.43Å; S78-L80 PolarHBondContact O-N 2.69Å; L80-R83 VanDerWaalsContact CD2-NH2 3.32Å; L80-R83 PolarHBondContact O-N 3Å; L80-Q84 WeakPolarHBondContact O-CG 3.28Å; L80-Q84 PolarHBondContact O-N 3.37Å
81M90.9Very high84.8Confident128 Ų128102.6 Ų102.663%0.63153%0.533SS*.Hα-helixtrans-60.4-44.1175.7-85.9-72.6-17600112.1N77 S78 R83 Q84 Y85N77-M81 PolarHBondContact O-N 3.48Å; S78-M81 PolarHBondContact O-N 3.16Å; M81-R83 VanDerWaalsContact C-N 3.32Å; M81-R83 PolarHBondContact O-N 2.72Å; M81-Q84 PolarHBondContact O-N 2.79Å; M81-Y85 WeakPolarHBondContact O-CB 3.46Å; M81-Y85 PolarHBondContact O-N 2.65Å
82Q92.6Very high86.9Confident131 Ų131101.4 Ų101.461%0.61252%0.524SS*.Hα-helixtrans-61.3-40.7177.7-171.9177.69.300111.7S78 H86S78-Q82 VanDerWaalsContact O-CB 3.32Å; S78-Q82 WeakPolarHBondContact O-CB 3.11Å; S78-Q82 PolarHBondContact O-N 3.32Å; Q82-H86 WeakPolarHBondContact O-CB 3.41Å; Q82-H86 PolarHBondContact O-N 3.25Å
83R94.8Very high88.5Confident161 Ų161104 Ų10461%0.60853%0.527SS*.Hα-helixtrans-65.8-42.8173.6170.5166.648.9-148.7-9112.4L79 L80 M81 H86 Y87L79-R83 WeakPolarHBondContact O-CB 3.46Å; L79-R83 PolarHBondContact O-N 3.3Å; L79-R83 VanDerWaalsContact O-N 3.1Å; L80-R83 VanDerWaalsContact CD2-NH2 3.32Å; L80-R83 PolarHBondContact O-N 3Å; M81-R83 VanDerWaalsContact C-N 3.32Å; M81-R83 PolarHBondContact O-N 2.72Å; R83-H86 PolarHBondContact O-N 2.92Å; R83-Y87 WeakPolarHBondContact O-CB 3.49Å; R83-Y87 PolarHBondContact O-N 3.1Å
84Q94.4Very high90Very high120 Ų120107.2 Ų107.256%0.56153%0.53SS*.Hα-helixtrans-63-43.9176.1-74.9176-45.800111.8L80 M81 Y87 H88L80-Q84 WeakPolarHBondContact O-CG 3.28Å; L80-Q84 PolarHBondContact O-N 3.37Å; M81-Q84 PolarHBondContact O-N 2.79Å; Q84-Y87 PolarHBondContact O-N 2.84Å; Q84-H88 PolarHBondContact O-N 3.41Å
85Y95.4Very high91.4Very high152 Ų152110.7 Ų110.760%0.59654%0.536SS*.Hα-helixtrans-59.3-46.6174.5176.5-97000112M81 Y87 H88 L89M81-Y85 WeakPolarHBondContact O-CB 3.46Å; M81-Y85 PolarHBondContact O-N 2.65Å; Y85-Y87 VanDerWaalsContact C-N 3.34Å; Y85-Y87 PolarHBondContact O-N 2.94Å; Y85-H88 PolarHBondContact O-N 2.69Å; Y85-L89 HydrophobicContact CE1-CD1 4.02Å; Y85-L89 HydrophobicContact CE1-CD2 4.17Å; Y85-L89 HydrophobicContact CE2-CD1 4.09Å; Y85-L89 PolarHBondContact O-N 3.42Å
86H95.3Very high92.5Very high123 Ų123112.4 Ų112.457%0.56954%0.539SS*.Hα-helixtrans-63-39.8178.1-166.380.2000112.2Q82 R83 L89 L90Q82-H86 WeakPolarHBondContact O-CB 3.41Å; Q82-H86 PolarHBondContact O-N 3.25Å; R83-H86 PolarHBondContact O-N 2.92Å; H86-L89 WeakPolarHBondContact O-CB 3.49Å; H86-L89 PolarHBondContact O-N 3.17Å; H86-L90 PolarHBondContact O-N 3.28Å
87Y96.3Very high93.5Very high160 Ų160115 Ų11563%0.62755%0.546SS*.Hα-helixtrans-64.4-40.2175.7-152-91.5000112.1R83 Q84 Y85 L90 L91R83-Y87 WeakPolarHBondContact O-CB 3.49Å; R83-Y87 PolarHBondContact O-N 3.1Å; Q84-Y87 PolarHBondContact O-N 2.84Å; Y85-Y87 VanDerWaalsContact C-N 3.34Å; Y85-Y87 PolarHBondContact O-N 2.94Å; Y87-L90 WeakPolarHBondContact O-CB 3.25Å; Y87-L90 PolarHBondContact O-N 3.5Å; Y87-L91 HydrophobicContact CD1-CD1 3.74Å; Y87-L91 HydrophobicContact CE1-CD1 3.62Å; Y87-L91 WeakPolarHBondContact O-CD1 3.23Å; Y87-L91 PolarHBondContact O-N 3.49Å
88H96.1Very high94.2Very high122 Ų122112.7 Ų112.757%0.56554%0.541SS*.Hα-helixtrans-65.2-38175.4-170.2-99.1000112.4Q84 Y85 L90 L91 Q92Q84-H88 PolarHBondContact O-N 3.41Å; Y85-H88 PolarHBondContact O-N 2.69Å; H88-L90 VanDerWaalsContact C-N 3.34Å; H88-L91 PolarHBondContact O-N 3.35Å; H88-Q92 PolarHBondContact O-N 3.38Å
89L97Very high94.6Very high73 Ų73114.6 Ų114.638%0.38254%0.543SS..Hα-helixtrans-61.3-41.2171.5-120.268.2000112.1Y85 H86 Q92 Q93Y85-L89 HydrophobicContact CE1-CD1 4.02Å; Y85-L89 HydrophobicContact CE1-CD2 4.17Å; Y85-L89 HydrophobicContact CE2-CD1 4.09Å; Y85-L89 PolarHBondContact O-N 3.42Å; H86-L89 WeakPolarHBondContact O-CB 3.49Å; H86-L89 PolarHBondContact O-N 3.17Å; L89-Q92 PolarHBondContact O-N 2.86Å; L89-Q93 PolarHBondContact O-N 3.41Å
90L97.1Very high94.9Very high90 Ų90112.1 Ų112.147%0.47154%0.538SS..Hα-helixtrans-63.5-43.8178-136.778.8000112H86 Y87 H88 Q93 Q94H86-L90 PolarHBondContact O-N 3.28Å; Y87-L90 WeakPolarHBondContact O-CB 3.25Å; Y87-L90 PolarHBondContact O-N 3.5Å; H88-L90 VanDerWaalsContact C-N 3.34Å; L90-Q93 PolarHBondContact O-N 3.11Å; L90-Q94 WeakPolarHBondContact O-CB 3.48Å; L90-Q94 PolarHBondContact O-N 3.33Å
91L96.6Very high95Very high90 Ų90114.5 Ų114.547%0.47155%0.547SS..Hα-helixtrans-62.7-42.2174.6-96.567.5000112Y87 H88 Q94 Q95Y87-L91 HydrophobicContact CD1-CD1 3.74Å; Y87-L91 HydrophobicContact CE1-CD1 3.62Å; Y87-L91 WeakPolarHBondContact O-CD1 3.23Å; Y87-L91 PolarHBondContact O-N 3.49Å; H88-L91 PolarHBondContact O-N 3.35Å; L91-Q94 PolarHBondContact O-N 2.83Å; L91-Q95 WeakPolarHBondContact O-CB 3.45Å; L91-Q95 PolarHBondContact O-N 3.43Å
92Q95.8Very high95.2Very high96 Ų96114.2 Ų114.245%0.44954%0.544SS..Hα-helixtrans-62.9-43.5177.3-175175.5102.700111.8H88 L89 Q95 Q96H88-Q92 PolarHBondContact O-N 3.38Å; L89-Q92 PolarHBondContact O-N 2.86Å; Q92-Q95 PolarHBondContact O-N 3Å; Q92-Q96 WeakPolarHBondContact O-CG 3.18Å; Q92-Q96 PolarHBondContact O-N 3.45Å
93Q95.4Very high95.3Very high128 Ų128114.1 Ų114.160%0.59854%0.544SS*.Hα-helixtrans-61.9-45.1175.1-174.1-172100.100111.6L89 L90 Q95 Q96 L97L89-Q93 PolarHBondContact O-N 3.41Å; L90-Q93 PolarHBondContact O-N 3.11Å; Q93-Q95 VanDerWaalsContact C-N 3.34Å; Q93-Q95 PolarHBondContact O-N 3.36Å; Q93-Q96 PolarHBondContact O-N 3.38Å; Q93-L97 WeakPolarHBondContact O-CB 3.25Å; Q93-L97 PolarHBondContact O-N 3.14Å
94Q95.1Very high95.2Very high141 Ų141112.4 Ų112.466%0.65955%0.546SS*.Hα-helixtrans-61.6-41.5178.2-17517988.700111.9L90 L91 L97 A98L90-Q94 WeakPolarHBondContact O-CB 3.48Å; L90-Q94 PolarHBondContact O-N 3.33Å; L91-Q94 PolarHBondContact O-N 2.83Å; Q94-L97 PolarHBondContact O-N 3.24Å; Q94-A98 WeakPolarHBondContact O-CB 3.18Å; Q94-A98 PolarHBondContact O-N 3.27Å
95Q95.1Very high95.1Very high134 Ų134109.2 Ų109.263%0.62654%0.54SS*.Hα-helixtrans-65.7-40.1177-175.7174.875.900112.4L91 Q92 Q93 A98 M99L91-Q95 WeakPolarHBondContact O-CB 3.45Å; L91-Q95 PolarHBondContact O-N 3.43Å; Q92-Q95 PolarHBondContact O-N 3Å; Q93-Q95 VanDerWaalsContact C-N 3.34Å; Q93-Q95 PolarHBondContact O-N 3.36Å; Q95-A98 PolarHBondContact O-N 3.32Å; Q95-M99 PolarHBondContact O-N 3.07Å
96Q94.5Very high94.9Very high109 Ų109106.8 Ų106.851%0.50954%0.537SS..Hα-helixtrans-62.6-43.8173.5-72.1171.44.700111.6Q92 Q93 M99 A100Q92-Q96 WeakPolarHBondContact O-CG 3.18Å; Q92-Q96 PolarHBondContact O-N 3.45Å; Q93-Q96 PolarHBondContact O-N 3.38Å; Q96-M99 PolarHBondContact O-N 2.87Å; Q96-A100 PolarHBondContact O-N 2.91Å
97L95.7Very high94.5Very high103 Ų103103.6 Ų103.654%0.53953%0.532SS..Hα-helixtrans-64.1-41.2178.2-165.971.1000111.9Q93 Q94 A100 Q101Q93-L97 WeakPolarHBondContact O-CB 3.25Å; Q93-L97 PolarHBondContact O-N 3.14Å; Q94-L97 PolarHBondContact O-N 3.24Å; L97-A100 PolarHBondContact O-N 3.42Å; L97-Q101 WeakPolarHBondContact O-CG 3.28Å; L97-Q101 PolarHBondContact O-N 2.85Å
98A95.9Very high94.1Very high54 Ų5498.6 Ų98.645%0.44652%0.524SS..Hα-helixtrans-63-41.9175.800000112.3Q94 Q95 Q101 H102Q94-A98 WeakPolarHBondContact O-CB 3.18Å; Q94-A98 PolarHBondContact O-N 3.27Å; Q95-A98 PolarHBondContact O-N 3.32Å; A98-Q101 PolarHBondContact O-N 3.31Å; A98-H102 WeakPolarHBondContact O-CB 3.3Å; A98-H102 PolarHBondContact O-N 3.43Å
99M94.4Very high93.6Very high108 Ų10896.8 Ų96.853%0.53252%0.524SS..Hα-helixtrans-64.8-41.1173.7-73.5-159.7-64.300112.3Q95 Q96 H102 Q103Q95-M99 PolarHBondContact O-N 3.07Å; Q96-M99 PolarHBondContact O-N 2.87Å; M99-H102 PolarHBondContact O-N 2.91Å; M99-Q103 WeakPolarHBondContact O-CG 3.47Å; M99-Q103 PolarHBondContact O-N 3.46Å
100A93.9Very high92.8Very high53 Ų5396.3 Ų96.344%0.43853%0.531SS..Hα-helixtrans-63.3-42176.700000112Q96 L97 Q103 L104Q96-A100 PolarHBondContact O-N 2.91Å; L97-A100 PolarHBondContact O-N 3.42Å; A100-Q103 PolarHBondContact O-N 2.72Å; A100-L104 WeakPolarHBondContact O-CB 3.24Å; A100-L104 PolarHBondContact O-N 3.09Å
101Q93.4Very high91.9Very high128 Ų12894.5 Ų94.560%0.59853%0.529SS*.Hα-helixtrans-64.3-39.4174.3-74.7178.9-20.300112.4L97 A98 L104 A105L97-Q101 WeakPolarHBondContact O-CG 3.28Å; L97-Q101 PolarHBondContact O-N 2.85Å; A98-Q101 PolarHBondContact O-N 3.31Å; Q101-L104 PolarHBondContact O-N 2.76Å; Q101-A105 WeakPolarHBondContact O-CB 3.49Å; Q101-A105 PolarHBondContact O-N 3.23Å
102H95Very high90.9Very high123 Ų12393.2 Ų93.257%0.56953%0.532SS*.Hα-helixtrans-65.1-42.1175.7-175.260.6000112.3A98 M99 A105 L106A98-H102 WeakPolarHBondContact O-CB 3.3Å; A98-H102 PolarHBondContact O-N 3.43Å; M99-H102 PolarHBondContact O-N 2.91Å; H102-A105 PolarHBondContact O-N 2.74Å; H102-L106 WeakPolarHBondContact O-CG 3.46Å; H102-L106 PolarHBondContact O-N 3.37Å
103Q94.6Very high89.7Confident129 Ų12991.2 Ų91.260%0.60353%0.531SS*.Hα-helixtrans-63.4-41.2173.7-70.5175.522.900112M99 A100 L106 A107M99-Q103 WeakPolarHBondContact O-CG 3.47Å; M99-Q103 PolarHBondContact O-N 3.46Å; A100-Q103 PolarHBondContact O-N 2.72Å; Q103-L106 PolarHBondContact O-N 3Å; Q103-A107 WeakPolarHBondContact O-CB 3.26Å; Q103-A107 PolarHBondContact O-N 3.05Å
104L91.7Very high88.4Confident124 Ų12488.5 Ų88.565%0.64953%0.526SS*.Hα-helixtrans-64.3-39.7175.8-176.961.8000112A100 Q101 A107 A108A100-L104 WeakPolarHBondContact O-CB 3.24Å; A100-L104 PolarHBondContact O-N 3.09Å; Q101-L104 PolarHBondContact O-N 2.76Å; L104-A107 PolarHBondContact O-N 3.17Å; L104-A108 WeakPolarHBondContact O-CB 3.42Å; L104-A108 PolarHBondContact O-N 3.43Å
105A92.9Very high87.1Confident54 Ų5484.4 Ų84.445%0.44652%0.517SS..Hα-helixtrans-63.7-4617500000111.9Q101 H102 A107 A108 S109Q101-A105 WeakPolarHBondContact O-CB 3.49Å; Q101-A105 PolarHBondContact O-N 3.23Å; H102-A105 PolarHBondContact O-N 2.74Å; A105-A107 PolarHBondContact O-N 3.49Å; A105-A108 PolarHBondContact O-N 3.19Å; A105-S109 PolarHBondContact O-N 2.83Å; A105-S109 PolarHBondContact O-OG 3.07Å
106L91.7Very high85.6Confident101 Ų10181.5 Ų81.553%0.52951%0.512SS..Hα-helixtrans-58.3-45.5173.9-77.7163.6000111.9H102 Q103 S109 A110H102-L106 WeakPolarHBondContact O-CG 3.46Å; H102-L106 PolarHBondContact O-N 3.37Å; Q103-L106 PolarHBondContact O-N 3Å; L106-S109 PolarHBondContact O-N 3Å; L106-A110 WeakPolarHBondContact O-CB 3.45Å; L106-A110 PolarHBondContact O-N 3.36Å
107A87.3Confident84.1Confident56 Ų5682.5 Ų82.546%0.46352%0.516SS..Hα-helixtrans-63.8-40.317700000112.2Q103 L104 A105 A110 A111Q103-A107 WeakPolarHBondContact O-CB 3.26Å; Q103-A107 PolarHBondContact O-N 3.05Å; L104-A107 PolarHBondContact O-N 3.17Å; A105-A107 PolarHBondContact O-N 3.49Å; A107-A110 PolarHBondContact O-N 3.35Å; A107-A111 WeakPolarHBondContact O-CB 3.5Å; A107-A111 PolarHBondContact O-N 2.95Å
108A86.8Confident82.7Confident55 Ų5583 Ų8346%0.45552%0.516SS..Hα-helixtrans-66.2-41.1176.300000112.2L104 A105 A111 A112L104-A108 WeakPolarHBondContact O-CB 3.42Å; L104-A108 PolarHBondContact O-N 3.43Å; A105-A108 PolarHBondContact O-N 3.19Å; A108-A111 PolarHBondContact O-N 3.1Å; A108-A112 WeakPolarHBondContact O-CB 3.36Å; A108-A112 PolarHBondContact O-N 2.96Å
109S85.1Confident81.5Confident83 Ų8386.7 Ų86.758%0.5852%0.523SS*.Hα-helixtrans-64.3-41.1173.6-62.30000112.4A105 L106 A112 A113A105-S109 PolarHBondContact O-N 2.83Å; A105-S109 PolarHBondContact O-OG 3.07Å; L106-S109 PolarHBondContact O-N 3Å; S109-A112 PolarHBondContact O-N 3.45Å; S109-A113 PolarHBondContact O-N 2.92Å
110A80Confident80.4Confident63 Ų6385.2 Ų85.252%0.52152%0.521SS..Hα-helixtrans-64.2-43.417500000111.9L106 A107 A113 S114L106-A110 WeakPolarHBondContact O-CB 3.45Å; L106-A110 PolarHBondContact O-N 3.36Å; A107-A110 PolarHBondContact O-N 3.35Å; A110-A113 PolarHBondContact O-N 3.23Å; A110-S114 PolarHBondContact O-N 3.31Å; A110-S114 PolarHBondContact O-OG 2.83Å
111A78Confident79.5Confident53 Ų5387.8 Ų87.844%0.43853%0.527SS..Hα-helixtrans-61.8-45.2175.800000112A107 A108 A113 S114 A115A107-A111 WeakPolarHBondContact O-CB 3.5Å; A107-A111 PolarHBondContact O-N 2.95Å; A108-A111 PolarHBondContact O-N 3.1Å; A111-A113 VanDerWaalsContact C-N 3.34Å; A111-A113 PolarHBondContact O-N 3.38Å; A111-S114 WeakPolarHBondContact CA-OG 3.45Å; A111-S114 PolarHBondContact O-N 3.34Å; A111-S114 PolarHBondContact O-OG 3.18Å; A111-A115 WeakPolarHBondContact O-CB 3.4Å; A111-A115 PolarHBondContact O-N 3.14Å
112A75.5Confident79.1Confident63 Ų6386.5 Ų86.552%0.52152%0.521SS..Hα-helixtrans-61.2-40.5176.600000112.4A108 S109 A115 S116A108-A112 WeakPolarHBondContact O-CB 3.36Å; A108-A112 PolarHBondContact O-N 2.96Å; S109-A112 PolarHBondContact O-N 3.45Å; A112-A115 PolarHBondContact O-N 3.42Å; A112-S116 PolarHBondContact O-N 3.34Å; A112-S116 VanDerWaalsContact O-N 3.11Å
113A71.7Confident78.5Confident53 Ų5384.9 Ų84.944%0.43852%0.516SS..Hα-helixtrans-63-4417400000112S109 A110 A111 H117S109-A113 PolarHBondContact O-N 2.92Å; A110-A113 PolarHBondContact O-N 3.23Å; A111-A113 VanDerWaalsContact C-N 3.34Å; A111-A113 PolarHBondContact O-N 3.38Å; A113-H117 PolarHBondContact O-CD2 2.87Å; A113-H117 PolarHBondContact O-N 3.24Å
114S69.1Low78Confident71 Ų7181.4 Ų81.450%0.49751%0.509SS..Hα-helixtrans-65.8-38.6176.558.50000113.4A110 A111 H117 Q118A110-S114 PolarHBondContact O-N 3.31Å; A110-S114 PolarHBondContact O-OG 2.83Å; A111-S114 WeakPolarHBondContact CA-OG 3.45Å; A111-S114 PolarHBondContact O-N 3.34Å; A111-S114 PolarHBondContact O-OG 3.18Å; S114-H117 PolarHBondContact O-N 2.8Å; S114-Q118 WeakPolarHBondContact O-CB 3.46Å; S114-Q118 PolarHBondContact O-N 2.83Å
115A66.2Low77.7Confident55 Ų5583.7 Ų83.746%0.45551%0.509SS..Hα-helixtrans-65.5-41.6179.400000111.9A111 A112 Q118 Q119A111-A115 WeakPolarHBondContact O-CB 3.4Å; A111-A115 PolarHBondContact O-N 3.14Å; A112-A115 PolarHBondContact O-N 3.42Å; A115-Q118 PolarHBondContact O-N 3.18Å; A115-Q119 WeakPolarHBondContact O-CB 3.42Å; A115-Q119 PolarHBondContact O-N 3.36Å
116S63.7Low77.6Confident74 Ų7484.2 Ų84.252%0.51751%0.51SS..Hα-helixtrans-59.7-48.9175-174.40000111.6A112 Q119 T120A112-S116 PolarHBondContact O-N 3.34Å; A112-S116 VanDerWaalsContact O-N 3.11Å; S116-Q119 PolarHBondContact O-N 3.04Å; S116-T120 PolarHBondContact O-N 3.41Å; S116-T120 VanDerWaalsContact O-N 3.16Å; S116-T120 PolarHBondContact O-OG1 3.03Å
117H63.4Low77.5Confident130 Ų13084.7 Ų84.760%0.60251%0.512SS*.Hα-helixtrans-61.2-48.4176.3-86.2-67.2000112.4A113 S114 Q119 T120 D121A113-H117 PolarHBondContact O-CD2 2.87Å; A113-H117 PolarHBondContact O-N 3.24Å; S114-H117 PolarHBondContact O-N 2.8Å; H117-Q119 VanDerWaalsContact C-N 3.31Å; H117-Q119 PolarHBondContact O-N 2.9Å; H117-T120 PolarHBondContact O-N 3.48Å; H117-T120 VanDerWaalsContact O-N 3.1Å; H117-T120 PolarHBondContact O-OG1 3.03Å; H117-D121 PolarHBondContact O-N 3.44Å
118Q66.6Low77.4Confident114 Ų11488.7 Ų88.753%0.53352%0.519SS..Hα-helixtrans-57.3-43.7179-178.3176.3-13.800112S114 A115 T120 D121 E122S114-Q118 WeakPolarHBondContact O-CB 3.46Å; S114-Q118 PolarHBondContact O-N 2.83Å; A115-Q118 PolarHBondContact O-N 3.18Å; Q118-T120 VanDerWaalsContact C-N 3.34Å; Q118-T120 PolarHBondContact O-N 2.83Å; Q118-D121 PolarHBondContact O-N 2.6Å; Q118-E122 HydrophobicContact CG-CG 4.48Å; Q118-E122 WeakPolarHBondContact CG-OE1 3.47Å; Q118-E122 PolarHBondContact NE2-OE1 3.27Å; Q118-E122 WeakPolarHBondContact O-CG 3.24Å; Q118-E122 PolarHBondContact O-N 3.19Å
119Q69.6Low77.4Confident130 Ų13090.5 Ų90.561%0.60752%0.52SS*.Hα-helixtrans-62-40.7177.5-170177.19.700111.8A115 S116 H117 E122 I123A115-Q119 WeakPolarHBondContact O-CB 3.42Å; A115-Q119 PolarHBondContact O-N 3.36Å; S116-Q119 PolarHBondContact O-N 3.04Å; H117-Q119 VanDerWaalsContact C-N 3.31Å; H117-Q119 PolarHBondContact O-N 2.9Å; Q119-E122 PolarHBondContact O-N 2.95Å; Q119-I123 HydrophobicContact CG-CD1 4.25Å; Q119-I123 VanDerWaalsContact O-CG1 3.31Å; Q119-I123 WeakPolarHBondContact O-CG1 3.41Å; Q119-I123 PolarHBondContact O-N 3.44Å; Q119-I123 VanDerWaalsContact O-N 3.14Å
120T71.8Confident77.6Confident78 Ų7893.4 Ų93.448%0.47952%0.522SS..Hα-helixtrans-67.1-37.5175.658.50000113.1S116 H117 Q118 I123 A124S116-T120 PolarHBondContact O-N 3.41Å; S116-T120 VanDerWaalsContact O-N 3.16Å; S116-T120 PolarHBondContact O-OG1 3.03Å; H117-T120 PolarHBondContact O-N 3.48Å; H117-T120 VanDerWaalsContact O-N 3.1Å; H117-T120 PolarHBondContact O-OG1 3.03Å; Q118-T120 VanDerWaalsContact C-N 3.34Å; Q118-T120 PolarHBondContact O-N 2.83Å; T120-I123 PolarHBondContact O-N 2.9Å; T120-A124 WeakPolarHBondContact O-CB 3.42Å; T120-A124 PolarHBondContact O-N 2.92Å
121D75.5Confident77.8Confident106 Ų10692.7 Ų92.757%0.56752%0.517SS*.Hα-helixtrans-69.4-34.1177.5-82.4-33.8000112.5H117 Q118 R125H117-D121 PolarHBondContact O-N 3.44Å; Q118-D121 PolarHBondContact O-N 2.6Å; D121-R125 WeakPolarHBondContact O-CB 3.37Å; D121-R125 PolarHBondContact O-N 2.89Å
122E84.2Confident78Confident102 Ų10295.8 Ų95.848%0.47752%0.522SS..Hα-helixtrans-71.9-37.9175.9-73.8176-166.400112.3Q118 Q119 R125 S126Q118-E122 HydrophobicContact CG-CG 4.48Å; Q118-E122 WeakPolarHBondContact CG-OE1 3.47Å; Q118-E122 PolarHBondContact NE2-OE1 3.27Å; Q118-E122 WeakPolarHBondContact O-CG 3.24Å; Q118-E122 PolarHBondContact O-N 3.19Å; Q119-E122 PolarHBondContact O-N 2.95Å; E122-R125 PolarHBondContact O-N 3.37Å; E122-S126 WeakPolarHBondContact O-CB 3.27Å; E122-S126 PolarHBondContact O-N 2.96Å; E122-S126 PolarHBondContact O-OG 3.36Å
123I83.3Confident78.1Confident88 Ų8897.7 Ų97.745%0.45153%0.527SS..Hα-helixtrans-64.6-46170.6-65.5166.3000110.3Q119 T120 R125 S126 L127Q119-I123 HydrophobicContact CG-CD1 4.25Å; Q119-I123 VanDerWaalsContact O-CG1 3.31Å; Q119-I123 WeakPolarHBondContact O-CG1 3.41Å; Q119-I123 PolarHBondContact O-N 3.44Å; Q119-I123 VanDerWaalsContact O-N 3.14Å; T120-I123 PolarHBondContact O-N 2.9Å; I123-R125 PolarHBondContact O-N 3.27Å; I123-S126 WeakPolarHBondContact CA-OG 3.4Å; I123-S126 PolarHBondContact O-N 3.19Å; I123-S126 PolarHBondContact O-OG 2.85Å; I123-L127 HydrophobicContact CG2-CD1 3.9Å; I123-L127 HydrophobicContact CG2-CG 4.48Å; I123-L127 WeakPolarHBondContact O-CB 3.26Å; I123-L127 VanDerWaalsContact O-CG 3.31Å; I123-L127 WeakPolarHBondContact O-CG 3.4Å; I123-L127 PolarHBondContact O-N 2.84Å
124A84.7Confident78.2Confident57 Ų5799.3 Ų99.347%0.47153%0.532SS..Hα-helixtrans-64-38.6177.100000112.4T120 K128T120-A124 WeakPolarHBondContact O-CB 3.42Å; T120-A124 PolarHBondContact O-N 2.92Å; A124-K128 VanDerWaalsContact O-CB 3.24Å; A124-K128 WeakPolarHBondContact O-CB 3.47Å; A124-K128 PolarHBondContact O-N 2.68Å
125R85.4Confident78.1Confident171 Ų17199.9 Ų99.965%0.64553%0.533SS*.Hα-helixtrans-65.6-47.5175.8-178.2-172.2-65.8-167.22.7111.7D121 E122 I123 K128 I129D121-R125 WeakPolarHBondContact O-CB 3.37Å; D121-R125 PolarHBondContact O-N 2.89Å; E122-R125 PolarHBondContact O-N 3.37Å; I123-R125 PolarHBondContact O-N 3.27Å; R125-K128 PolarHBondContact O-N 3.49Å; R125-I129 HydrophobicContact CG-CD1 3.91Å; R125-I129 WeakPolarHBondContact O-CG1 3.47Å; R125-I129 PolarHBondContact O-N 2.96Å
126S89.3Confident77.6Confident66 Ų6698.4 Ų98.446%0.46252%0.523SS..Hα-helixtrans-65.9-44.5-178.648.80000111.8E122 I123 K128 I129 F130E122-S126 WeakPolarHBondContact O-CB 3.27Å; E122-S126 PolarHBondContact O-N 2.96Å; E122-S126 PolarHBondContact O-OG 3.36Å; I123-S126 WeakPolarHBondContact CA-OG 3.4Å; I123-S126 PolarHBondContact O-N 3.19Å; I123-S126 PolarHBondContact O-OG 2.85Å; S126-K128 VanDerWaalsContact C-N 3.29Å; S126-K128 PolarHBondContact O-N 3.37Å; S126-I129 PolarHBondContact O-N 3.01Å; S126-F130 WeakPolarHBondContact O-CB 3.38Å; S126-F130 PolarHBondContact O-N 3.45Å
127L89.7Confident77.1Confident111 Ų11198.6 Ų98.658%0.58153%0.529SS*.Hα-helixtrans-58.5-39.7172.2-71.7171.3000112.4I123 A131I123-L127 HydrophobicContact CG2-CD1 3.9Å; I123-L127 HydrophobicContact CG2-CG 4.48Å; I123-L127 WeakPolarHBondContact O-CB 3.26Å; I123-L127 VanDerWaalsContact O-CG 3.31Å; I123-L127 WeakPolarHBondContact O-CG 3.4Å; I123-L127 PolarHBondContact O-N 2.84Å; L127-A131 WeakPolarHBondContact O-CB 3.49Å; L127-A131 PolarHBondContact O-N 3.15Å
128K86.1Confident76.4Confident140 Ų14096.6 Ų96.661%0.60953%0.534SS*.Hα-helixtrans-67.2-41.1176.9-174.8173.5-176170.20112.8A124 R125 S126 Q132A124-K128 VanDerWaalsContact O-CB 3.24Å; A124-K128 WeakPolarHBondContact O-CB 3.47Å; A124-K128 PolarHBondContact O-N 2.68Å; R125-K128 PolarHBondContact O-N 3.49Å; S126-K128 VanDerWaalsContact C-N 3.29Å; S126-K128 PolarHBondContact O-N 3.37Å; K128-Q132 VanDerWaalsContact O-CG 3.31Å; K128-Q132 WeakPolarHBondContact O-CG 3.42Å; K128-Q132 PolarHBondContact O-N 3.18Å
129I87Confident75.8Confident92 Ų9297.9 Ų97.947%0.47254%0.541SS..Hα-helixtrans-65.8-45.4175.3-68.8166.4000110.1R125 S126 A131 Q132 V133R125-I129 HydrophobicContact CG-CD1 3.91Å; R125-I129 WeakPolarHBondContact O-CG1 3.47Å; R125-I129 PolarHBondContact O-N 2.96Å; S126-I129 PolarHBondContact O-N 3.01Å; I129-A131 PolarHBondContact O-N 3.47Å; I129-Q132 PolarHBondContact O-N 3.41Å; I129-V133 HydrophobicContact CG2-CG2 4.47Å; I129-V133 WeakPolarHBondContact O-CG2 3.44Å; I129-V133 PolarHBondContact O-N 2.88Å
130F88.9Confident74.9Confident144 Ų14498.2 Ų98.263%0.63255%0.547SS*.Hα-helixtrans-56.1-50.1176.1-179.2-96.7000111.3S126 Q132 V133 T134S126-F130 WeakPolarHBondContact O-CB 3.38Å; S126-F130 PolarHBondContact O-N 3.45Å; F130-Q132 VanDerWaalsContact C-N 3.34Å; F130-Q132 PolarHBondContact O-N 2.68Å; F130-V133 PolarHBondContact O-N 3.1Å; F130-T134 PolarHBondContact O-N 3.25Å; F130-T134 PolarHBondContact O-OG1 2.85Å
131A85.1Confident73.9Confident49 Ų4998.9 Ų98.941%0.40556%0.56SS.*Hα-helixtrans-57.1-44.4175.500000112.5L127 I129 V133 T134 T135L127-A131 WeakPolarHBondContact O-CB 3.49Å; L127-A131 PolarHBondContact O-N 3.15Å; I129-A131 PolarHBondContact O-N 3.47Å; A131-V133 PolarHBondContact O-N 3.41Å; A131-T134 PolarHBondContact O-N 3.45Å; A131-T135 WeakPolarHBondContact O-CG2 3.34Å; A131-T135 PolarHBondContact O-N 3.44Å; A131-T135 PolarHBondContact O-OG1 2.86Å
132Q80.8Confident72.7Confident117 Ų11798.3 Ų98.355%0.54757%0.57SS.*Hα-helixtrans-63.8-36.4177.6-75.4-178.8-4700113.3K128 I129 F130 T135 G136K128-Q132 VanDerWaalsContact O-CG 3.31Å; K128-Q132 WeakPolarHBondContact O-CG 3.42Å; K128-Q132 PolarHBondContact O-N 3.18Å; I129-Q132 PolarHBondContact O-N 3.41Å; F130-Q132 VanDerWaalsContact C-N 3.34Å; F130-Q132 PolarHBondContact O-N 2.68Å; Q132-T135 PolarHBondContact O-OG1 2.74Å; Q132-G136 PolarHBondContact O-N 2.85Å
133V78.6Confident71.3Confident103 Ų10395.9 Ų95.962%0.62457%0.572SS**Hα-helixtrans-69.7-39.6174.31740000110.8I129 F130 A131I129-V133 HydrophobicContact CG2-CG2 4.47Å; I129-V133 WeakPolarHBondContact O-CG2 3.44Å; I129-V133 PolarHBondContact O-N 2.88Å; F130-V133 PolarHBondContact O-N 3.1Å; A131-V133 PolarHBondContact O-N 3.41Å
134T73.8Confident70.6Confident88 Ų8894.7 Ų94.754%0.5457%0.571SS.*Hα-helixtrans-66.8-38.1176-51.20000112.7F130 A131F130-T134 PolarHBondContact O-N 3.25Å; F130-T134 PolarHBondContact O-OG1 2.85Å; A131-T134 PolarHBondContact O-N 3.45Å
135T67.4Low69.8Low83 Ų8399.2 Ų99.251%0.50959%0.585SS.*Hα-helixtrans-79.7-39.9178.459.30000113A131 Q132 A137 A138A131-T135 WeakPolarHBondContact O-CG2 3.34Å; A131-T135 PolarHBondContact O-N 3.44Å; A131-T135 PolarHBondContact O-OG1 2.86Å; Q132-T135 PolarHBondContact O-OG1 2.74Å; T135-A137 PolarHBondContact O-N 2.82Å; T135-A137 VanDerWaalsContact O-N 3.1Å; T135-A138 WeakPolarHBondContact O-CB 3.27Å; T135-A138 PolarHBondContact O-N 3.05Å
136G55.6Low68.9Low24 Ų2497.2 Ų97.225%0.24758%0.583CS.*Hα-helixtrans-62.3-20.7-176.200000114.5Q132 A138 N140Q132-G136 PolarHBondContact O-N 2.85Å; G136-A138 VanDerWaalsContact C-N 3.28Å; G136-A138 PolarHBondContact O-N 3.45Å; G136-N140 PolarHBondContact O-ND2 3.21Å
137A51.8Low68.1Low78 Ų7899.3 Ų99.365%0.64559%0.589SS**Hα-helixtrans-68.5-21.2172.700000113.8T135T135-A137 PolarHBondContact O-N 2.82Å; T135-A137 VanDerWaalsContact O-N 3.1Å
138A49.6Very low67.4Low87 Ų8798.3 Ų98.372%0.71959%0.587SS**Hα-helixtrans-87.5-22.5-177.600000113.9T135 G136T135-A138 WeakPolarHBondContact O-CB 3.27Å; T135-A138 PolarHBondContact O-N 3.05Å; G136-A138 VanDerWaalsContact C-N 3.28Å; G136-A138 PolarHBondContact O-N 3.45Å
139E53.4Low66.9Low142 Ų14297.1 Ų97.166%0.66459%0.585SS**Hα-helixtrans-105.3-5.3-167.659.7-165.1139.300115.2
140N50.8Low66.4Low137 Ų13798.3 Ų98.373%0.73359%0.589SS**SBendtrans-108.4-0.5177.2-69.1-85.2000114.4G136 A142G136-N140 PolarHBondContact O-ND2 3.21Å; N140-A142 PolarHBondContact O-N 3.12Å
141A50.5Low65.7Low92 Ų9297.3 Ų97.376%0.7659%0.586SS**THydrogen-bonded Turntrans-81.69.1179.300000114.4
142A51.2Low65.2Low93 Ų93101.6 Ų101.677%0.76960%0.595SS**THydrogen-bonded Turntrans-116.710-175.300000114.1N140 S144N140-A142 PolarHBondContact O-N 3.12Å; A142-S144 PolarHBondContact O-N 3.45Å
143G55.4Low64.8Low51 Ų5199 Ų9953%0.52660%0.595SS.*  trans-64.2102.7166.600000109.7
144S68.4Low64.5Low63 Ų6399 Ų9944%0.44160%0.595SS.*  trans-59.8148.9178-1740000110.5A142 Q146 D147 V148A142-S144 PolarHBondContact O-N 3.45Å; S144-Q146 PolarHBondContact O-N 3.21Å; S144-Q146 VanDerWaalsContact O-N 3.12Å; S144-Q146 PolarHBondContact OG-OE1 2.79Å; S144-D147 WeakPolarHBondContact O-CA 3.34Å; S144-D147 VanDerWaalsContact O-CB 3.29Å; S144-D147 WeakPolarHBondContact O-CB 3.47Å; S144-D147 PolarHBondContact O-N 2.93Å; S144-V148 PolarHBondContact O-N 3.08Å
145M67.2Low64.3Low152 Ų15299.2 Ų99.275%0.74959%0.593SS**Hα-helixtrans-60.4-25.6176.5-71.7-167.6175.200112.5D147 M149M145-D147 VanDerWaalsContact C-N 3.29Å; M145-D147 PolarHBondContact O-N 3.22Å; M145-M149 HydrophobicContact CB-CE 4.28Å; M145-M149 VanDerWaalsContact O-CE 3.3Å; M145-M149 WeakPolarHBondContact O-CE 3.42Å; M145-M149 WeakPolarHBondContact O-CG 3.48Å; M145-M149 PolarHBondContact O-N 2.8Å
146Q65.6Low63.9Low130 Ų13098.1 Ų98.161%0.60760%0.597SS**Hα-helixtrans-58.9-37.5168.5-81.770.424.300112.9S144 M149 Q150S144-Q146 PolarHBondContact O-N 3.21Å; S144-Q146 VanDerWaalsContact O-N 3.12Å; S144-Q146 PolarHBondContact OG-OE1 2.79Å; Q146-M149 PolarHBondContact O-N 3.1Å; Q146-Q150 VanDerWaalsContact O-CB 3.23Å; Q146-Q150 WeakPolarHBondContact O-CB 3.43Å; Q146-Q150 PolarHBondContact O-N 3.24Å
147D73.4Confident63.9Low110 Ų110105.7 Ų105.759%0.58862%0.62SS**Hα-helixtrans-72.3-41.2-176.5-144.226.5000110.7S144 M145 Q150 E151S144-D147 WeakPolarHBondContact O-CA 3.34Å; S144-D147 VanDerWaalsContact O-CB 3.29Å; S144-D147 WeakPolarHBondContact O-CB 3.47Å; S144-D147 PolarHBondContact O-N 2.93Å; M145-D147 VanDerWaalsContact C-N 3.29Å; M145-D147 PolarHBondContact O-N 3.22Å; D147-Q150 WeakPolarHBondContact O-CB 3.42Å; D147-Q150 PolarHBondContact O-N 3Å; D147-E151 PolarHBondContact O-N 3.45Å
148V76Confident64.4Low90 Ų90105.8 Ų105.855%0.54562%0.621SS.*Hα-helixtrans-64.4-40.5173.2-176.40000111.6S144 Q150 F152S144-V148 PolarHBondContact O-N 3.08Å; V148-Q150 VanDerWaalsContact C-N 3.34Å; V148-F152 PolarHBondContact O-N 3.26Å
149M75.2Confident64.5Low115 Ų115106.5 Ų106.557%0.56762%0.62SS**Hα-helixtrans-68.6-33.2173.4-73.6-174.4-76.400112.3M145 Q146 F152 A153M145-M149 HydrophobicContact CB-CE 4.28Å; M145-M149 VanDerWaalsContact O-CE 3.3Å; M145-M149 WeakPolarHBondContact O-CE 3.42Å; M145-M149 WeakPolarHBondContact O-CG 3.48Å; M145-M149 PolarHBondContact O-N 2.8Å; Q146-M149 PolarHBondContact O-N 3.1Å; M149-F152 PolarHBondContact O-N 3.35Å; M149-A153 WeakPolarHBondContact O-CB 3.43Å; M149-A153 PolarHBondContact O-N 3.36Å
150Q75.4Confident64.5Low117 Ų117107.6 Ų107.655%0.54763%0.631SS.*Hα-helixtrans-68.3-40.7175.9-168.864.878.800111.3Q146 D147 V148 A153 T154Q146-Q150 VanDerWaalsContact O-CB 3.23Å; Q146-Q150 WeakPolarHBondContact O-CB 3.43Å; Q146-Q150 PolarHBondContact O-N 3.24Å; D147-Q150 WeakPolarHBondContact O-CB 3.42Å; D147-Q150 PolarHBondContact O-N 3Å; V148-Q150 VanDerWaalsContact C-N 3.34Å; Q150-A153 PolarHBondContact O-N 3.05Å; Q150-T154 WeakPolarHBondContact O-CG2 3.19Å; Q150-T154 PolarHBondContact O-N 3.03Å; Q150-T154 PolarHBondContact O-OG1 3.31Å
151E75.6Confident64.2Low122 Ų122107 Ų10757%0.5763%0.628SS**Hα-helixtrans-62.9-43.2171.8179.2173.7-149.900112D147 A153 T154 N155D147-E151 PolarHBondContact O-N 3.45Å; E151-A153 VanDerWaalsContact C-N 3.31Å; E151-A153 PolarHBondContact O-N 3.04Å; E151-T154 PolarHBondContact O-N 2.96Å; E151-T154 PolarHBondContact O-OG1 2.86Å; E151-N155 VanDerWaalsContact CG-ND2 3.26Å; E151-N155 WeakPolarHBondContact CG-ND2 3.41Å; E151-N155 WeakPolarHBondContact O-CB 3.5Å; E151-N155 PolarHBondContact O-N 3.07Å; E151-N155 VanDerWaalsContact O-N 3.09Å; E151-N155 PolarHBondContact O-ND2 3.26Å
152F73.2Confident64.2Low139 Ų139111.1 Ų111.161%0.6164%0.636SS**Hα-helixtrans-61.7-41.1176.5-171.3-94.8000111.8V148 M149V148-F152 PolarHBondContact O-N 3.26Å; M149-F152 PolarHBondContact O-N 3.35Å
153A73.3Confident64.1Low64 Ų64110 Ų11053%0.52963%0.633SS.*Hα-helixtrans-68.4-38.3177.500000113.4M149 Q150 E151M149-A153 WeakPolarHBondContact O-CB 3.43Å; M149-A153 PolarHBondContact O-N 3.36Å; Q150-A153 PolarHBondContact O-N 3.05Å; E151-A153 VanDerWaalsContact C-N 3.31Å; E151-A153 PolarHBondContact O-N 3.04Å
154T72.2Confident63.6Low103 Ų103118.2 Ų118.263%0.63265%0.648SS**Hα-helixtrans-76.5-23.6179.853.70000113.7Q150 E151 G156Q150-T154 WeakPolarHBondContact O-CG2 3.19Å; Q150-T154 PolarHBondContact O-N 3.03Å; Q150-T154 PolarHBondContact O-OG1 3.31Å; E151-T154 PolarHBondContact O-N 2.96Å; E151-T154 PolarHBondContact O-OG1 2.86Å; T154-G156 PolarHBondContact O-N 3.33Å
155N69.9Low62.3Low92 Ų92124.2 Ų124.249%0.49267%0.672SS.*THydrogen-bonded Turntrans-76.60.7177.1-81.1-62.8000114.7E151 Y157E151-N155 VanDerWaalsContact CG-ND2 3.26Å; E151-N155 WeakPolarHBondContact CG-ND2 3.41Å; E151-N155 WeakPolarHBondContact O-CB 3.5Å; E151-N155 PolarHBondContact O-N 3.07Å; E151-N155 VanDerWaalsContact O-N 3.09Å; E151-N155 PolarHBondContact O-ND2 3.26Å; N155-Y157 HydrophobicContact CB-CD2 4.1Å; N155-Y157 HydrophobicContact CB-CE2 4.23Å; N155-Y157 WeakPolarHBondContact O-CD2 3.23Å; N155-Y157 PolarHBondContact O-N 3.21Å
156G58.3Low60.9Low59 Ų59122.6 Ų122.661%0.60868%0.675SS**THydrogen-bonded Turntrans77.214.916200000117T154 A158T154-G156 PolarHBondContact O-N 3.33Å; G156-A158 VanDerWaalsContact C-N 3.32Å; G156-A158 PolarHBondContact O-N 3Å
157Y55Low59.7Low183 Ų183128.1 Ų128.172%0.71869%0.692SS**  trans-85.14.2179.3-69.6-76.6000114.9N155 S159N155-Y157 HydrophobicContact CB-CD2 4.1Å; N155-Y157 HydrophobicContact CB-CE2 4.23Å; N155-Y157 WeakPolarHBondContact O-CD2 3.23Å; N155-Y157 PolarHBondContact O-N 3.21Å; Y157-S159 PolarHBondContact O-N 3.29Å
158A63.9Low57.8Low80 Ų80126.5 Ų126.566%0.66170%0.701SS**  trans-76.5111.8173.900000110.4G156G156-A158 VanDerWaalsContact C-N 3.32Å; G156-A158 PolarHBondContact O-N 3Å
159S51.6Low55.7Low102 Ų102128.2 Ų128.271%0.71372%0.717SS**  trans-133.7106.3176.5-69.20000110.3Y157 D161Y157-S159 PolarHBondContact O-N 3.29Å; S159-D161 PolarHBondContact O-N 3.03Å
160D52.5Low53.8Low165 Ų165127.4 Ų127.488%0.88273%0.729SS**  trans-76.865.8177.8-65-69.4000112L162D160-L162 PolarHBondContact O-N 2.89Å
161D44.4Very low52.4Low125 Ų125127.8 Ų127.867%0.66874%0.741SS**  trans-78.667.6178.4-156-34.5000111.8S159 G163S159-D161 PolarHBondContact O-N 3.03Å; D161-G163 PolarHBondContact O-N 2.73Å; D161-G163 VanDerWaalsContact O-N 3.08Å; D161-G163 PolarHBondContact OD1-N 3.25Å
162L51Low50.8Low179 Ų179127.5 Ų127.594%0.93775%0.75SS**THydrogen-bonded Turntrans-74.916.5175.6-155.769.9000112.4D160D160-L162 PolarHBondContact O-N 2.89Å
163G49.6Very low48.9Very low68 Ų68129.5 Ų129.570%0.70176%0.762SS**THydrogen-bonded Turntrans-111.5-12.8-16100000117.3D161D161-G163 PolarHBondContact O-N 2.73Å; D161-G163 VanDerWaalsContact O-N 3.08Å; D161-G163 PolarHBondContact OD1-N 3.25Å
164R44Very low47.1Very low225 Ų225132.6 Ų132.685%0.84977%0.773SS**  trans-13051.3-162.5-150.7176.4179.3-175.4-0.9117.5
165M41.7Very low45.3Very low189 Ų189136.8 Ų136.893%0.93179%0.786SS**  trans-100.180.8165.4-61.9-173-166.100111.9
166S37.8Very low43.8Very low117 Ų117140.4 Ų140.482%0.81880%0.802SS**  trans-136.3107.3169.4-84.90000111.1
167Y39.9Very low42.8Very low247 Ų247143 Ų14397%0.96981%0.808SS**  trans-73.1127.8165.5-81.1-99.2000109.4
168G32.4Very low42.1Very low76 Ų76140.2 Ų140.278%0.78481%0.812SS**  trans-154.2132.7177.300000110.4
169S33.3Very low40.5Very low126 Ų126144.9 Ų144.988%0.88182%0.82SS**  trans-99.8161-161.8-57.20000114.8
170A34Very low39.6Very low98 Ų98149.6 Ų149.681%0.8183%0.831SS**  trans80.2137.6164.400000118.5
171P47.3Very low38.5Very low124 Ų124148.7 Ų148.781%0.80582%0.822SS**  trans-104.3165.7177.840.3-35000113.5
172P41.1Very low37.8Very low116 Ų116149.8 Ų149.875%0.75382%0.823SS**  trans-133.6122153.934.7-19.7000115.1
173Q33.2Very low36.8Very low182 Ų182148.4 Ų148.485%0.8581%0.811SS**  trans66.5154.9137.5-65.2-58.4-36.800122.5
174V36.3Very low35.9Very low128 Ų128152 Ų15278%0.77681%0.81SS**  trans-99142.5-179.1177.20000109.6
175Q34.3Very low35.3Very low191 Ų191147.5 Ų147.589%0.89380%0.798SS**  trans-143.1131.5172.3-129.4152.8-1.900113.2
176M38.2Very low34.7Very low169 Ų169147 Ų14783%0.83379%0.793SS**PPolyproline II helixtrans-97.1160.2177.5-80.8-111.6-71.600110.7
177P38Very low34.2Very low112 Ų112145.2 Ų145.273%0.72779%0.794SS**PPolyproline II helixtrans-75.7151.4-167.429.8-36.6000114.2
178P38.8Very low34.3Very low126 Ų126141.8 Ų141.882%0.81879%0.792SS**PPolyproline II helixtrans-79.2151.5174.233.3-35000112.5
179Q30Very low34.2Very low177 Ų177146.5 Ų146.583%0.82779%0.793SS**PPolyproline II helixtrans-84.9156.5167.6-64.9-169.8-50.900111.7
180Q33.8Very low34.3Very low201 Ų201148 Ų14894%0.93979%0.79SS**  trans-117.3158.4153.5-75.4-169.5-16.600109.7
181Q29.3Very low34.6Very low146 Ų146148.5 Ų148.568%0.68279%0.785SS**  trans-148.5149-151.6-154.6-175.523.800111.9
182H30.8Very low33.9Very low149 Ų149150.5 Ų150.569%0.6979%0.788SS**  trans76.9157.4174.9-50.2111.8000115.4
183Q29.1Very low33.3Very low150 Ų150148.6 Ų148.670%0.70179%0.789SS**  cis-154.7150.921.1-158.3164.883.100115.1
184Q30.1Very low33.2Very low144 Ų144152.1 Ų152.167%0.67380%0.795SS**  trans69.2150.2154.4-91.916643.100119.4
185Q31.4Very low33.2Very low130 Ų130153.3 Ų153.361%0.60780%0.797SS**  cis-153.2138.8-4.7-157.4155.12400114
186Q29.8Very low33.5Very low177 Ų177150 Ų15083%0.82779%0.792SS**  trans34.3137.1148.7-60.7162.67.900122.9
187G26.7Very low33.2Very low81 Ų81146.8 Ų146.884%0.83579%0.793SS**  trans167.8102.9158.500000114.4
188L41.8Very low32.9Very low174 Ų174150.5 Ų150.591%0.91180%0.8SS**  trans-95.1130.5177.7-80.3163.3000112
189H31Very low32.8Very low176 Ų176153.1 Ų153.182%0.81581%0.806SS**  -174.7154.8129.853-89.2000112.6
190L35.4Very low32.9Very low157 Ų157153 Ų15382%0.82281%0.806SS**  trans-117.5150.7155.5-127.474.3000106.5
191P40.5Very low32.8Very low109 Ų109149.5 Ų149.571%0.70880%0.798SS**  -149173.7101.838.1-21.2000116.4
192L31.8Very low33Very low166 Ų166150.7 Ų150.787%0.86981%0.809SS**  trans-33130.2176.5-77.950.9000118
193G28.8Very low33.3Very low75 Ų75147.4 Ų147.477%0.77382%0.815SS**  90.8119.3104.100000120
194R31.2Very low33.4Very low256 Ų256143.3 Ų143.397%0.96681%0.813SS**  trans-155.5146.4151.2-125.5173.4-1791730.2111.7
195N35.3Very low34.2Very low154 Ų154144.9 Ų144.982%0.82483%0.827SS**PPolyproline II helixtrans-74.9154.1-180-75.3-32.7000112.6
196P40.9Very low34.8Very low121 Ų121146.6 Ų146.679%0.78684%0.839SS**PPolyproline II helixtrans-69.1142.6165.131.2-34.4000110.7
197A32.3Very low35.8Very low102 Ų102146 Ų14684%0.84384%0.838SS**PPolyproline II helixtrans-77.3141.9172.200000110.8
198Q32.6Very low36.8Very low189 Ų189148 Ų14888%0.88384%0.836SS**PPolyproline II helixtrans-80.1150.1171.8-64.4-161.8-45.700111.3
199L35.9Very low37.5Very low181 Ų181145.7 Ų145.795%0.94882%0.824SS**  trans-125.3132158.7-111.2162.3000107.7
200Q32Very low38.8Very low175 Ų175141.1 Ų141.182%0.81881%0.809SS**  trans-95.6149.9-155.1-162.7167.42.600113.1
201T32.2Very low39.8Very low127 Ų127141.2 Ų141.278%0.77981%0.81SS**  trans-53.8146.7178.351.50000113.8
202N32.9Very low40.5Very low172 Ų172139 Ų13992%0.9280%0.801SS**  trans-135.7148.2145.5-138.9-21.2000110.4
203G36.7Very low41.5Very low79 Ų79133.5 Ų133.581%0.81478%0.775SS**  trans-82.1131-152.500000116.6
204G32.5Very low42.9Very low64 Ų64135.9 Ų135.966%0.6677%0.765SS**  trans-161.3122.4163.500000109.9L206G204-L206 PolarHBondContact O-N 2.95Å
205N46.2Very low44.3Very low178 Ų178130.8 Ų130.895%0.95275%0.746SS**  trans-72.990.1-174.7-83-39.5000111.6
206L43.7Very low45.5Very low166 Ų166127 Ų12787%0.86973%0.725SS**  trans-120.1108.9167.8-68.1174.9000108.8G204G204-L206 PolarHBondContact O-N 2.95Å
207M51.5Low46.4Very low165 Ų165124.5 Ų124.581%0.81371%0.705SS**  trans-60.1142.6174.1-61.5-67.7-81.900109.6I209M207-I209 PolarHBondContact O-N 2.79Å
208P46.7Very low48.2Very low122 Ų122123.9 Ų123.979%0.79269%0.688SS**  trans-61.9105.9173.8-19.831.9000109.9P210P208-P210 WeakPolarHBondContact O-CD 3.3Å
209I57.2Low49.9Very low125 Ų125121.2 Ų121.264%0.64167%0.671SS**  trans-64.3120.2173.8-61.8178.3000106.9M207 T213M207-I209 PolarHBondContact O-N 2.79Å; I209-T213 HydrophobicContact CG2-CG2 4.31Å
210P57.8Low51.5Low80 Ų80120.9 Ų120.952%0.51966%0.657SS.*  trans-64.6151.6-177.626.8-33.8000110.3P208 A212 T213P208-P210 WeakPolarHBondContact O-CD 3.3Å; P210-A212 PolarHBondContact O-N 2.94Å; P210-T213 PolarHBondContact O-N 3.19Å; P210-T213 PolarHBondContact O-OG1 3.46Å
211L57Low53.2Low159 Ų159118.2 Ų118.283%0.83264%0.644SS**Hα-helixtrans-55.6-26.3179.7-76.578.2000112.2T213 H214L211-T213 PolarHBondContact O-N 3.17Å; L211-T213 VanDerWaalsContact O-N 3.12Å; L211-H214 PolarHBondContact O-N 3.45Å; L211-H214 VanDerWaalsContact O-N 3.08Å
212A54.7Low55.2Low63 Ų63118.2 Ų118.252%0.52164%0.635SS.*Hα-helixtrans-59.9-11.2171.900000115.5P210 W215P210-A212 PolarHBondContact O-N 2.94Å; A212-W215 PolarHBondContact O-NE1 3.49Å
213T54Low56.8Low51 Ų51114 Ų11431%0.31361%0.612SS.*Hα-helixtrans-105.6-17.8172-26.70000112.8I209 P210 L211 W215 L216 N217I209-T213 HydrophobicContact CG2-CG2 4.31Å; P210-T213 PolarHBondContact O-N 3.19Å; P210-T213 PolarHBondContact O-OG1 3.46Å; L211-T213 PolarHBondContact O-N 3.17Å; L211-T213 VanDerWaalsContact O-N 3.12Å; T213-W215 PolarHBondContact O-N 3.1Å; T213-L216 PolarHBondContact O-N 3.38Å; T213-N217 PolarHBondContact O-N 3.3Å; T213-N217 PolarHBondContact O-ND2 3.5Å
214H57.8Low58.4Low125 Ų125114.7 Ų114.758%0.57960%0.597SS**Hα-helixtrans-67.4-36.8-179.8-165.487.2000112.1L211 N218L211-H214 PolarHBondContact O-N 3.45Å; L211-H214 VanDerWaalsContact O-N 3.08Å; H214-N218 PolarHBondContact NE2-ND2 3.01Å; H214-N218 PolarHBondContact O-N 2.92Å; H214-N218 VanDerWaalsContact O-N 3.11Å
215W59.8Low60.2Low149 Ų149115.4 Ų115.456%0.56459%0.586SS**Hα-helixtrans-69-34.6175.376.8-92.3000112.8A212 T213 N217 N218 Y219A212-W215 PolarHBondContact O-NE1 3.49Å; T213-W215 PolarHBondContact O-N 3.1Å; W215-N217 PolarHBondContact O-N 3.46Å; W215-N218 PolarHBondContact O-N 3.46Å; W215-Y219 VanDerWaalsContact O-CB 3.25Å; W215-Y219 WeakPolarHBondContact O-CB 3.45Å; W215-Y219 PolarHBondContact O-N 2.94Å
216L61.5Low61.5Low74 Ų74110.2 Ų110.239%0.38756%0.561SS.*Hα-helixtrans-65.5-37.4177.2-82.5165.7000112.3T213 R220T213-L216 PolarHBondContact O-N 3.38Å; L216-R220 PolarHBondContact O-N 3.31Å
217N59.1Low62.6Low68 Ų68110.8 Ų110.836%0.36455%0.551SS.*Hα-helixtrans-70.6-48174.5-68.2-33.7000111.1T213 W215 Y219 R220 E221T213-N217 PolarHBondContact O-N 3.3Å; T213-N217 PolarHBondContact O-ND2 3.5Å; W215-N217 PolarHBondContact O-N 3.46Å; N217-Y219 VanDerWaalsContact C-N 3.25Å; N217-Y219 PolarHBondContact O-N 2.85Å; N217-R220 PolarHBondContact O-N 2.99Å; N217-R220 VanDerWaalsContact O-N 3.14Å; N217-E221 WeakPolarHBondContact O-CG 3.23Å; N217-E221 PolarHBondContact O-N 3.27Å
218N70.1Confident63.2Low89 Ų89110.3 Ų110.348%0.47654%0.541SS..Hα-helixtrans-53.2-42.3172.2-102.8-98.5000112.3H214 W215 E221 H222H214-N218 PolarHBondContact NE2-ND2 3.01Å; H214-N218 PolarHBondContact O-N 2.92Å; H214-N218 VanDerWaalsContact O-N 3.11Å; W215-N218 PolarHBondContact O-N 3.46Å; N218-E221 PolarHBondContact O-N 3.39Å; N218-H222 VanDerWaalsContact O-CB 3.3Å; N218-H222 WeakPolarHBondContact O-CB 3.41Å; N218-H222 PolarHBondContact O-N 2.87Å
219Y68.1Low63.9Low133 Ų133110.6 Ų110.652%0.52254%0.535SS..Hα-helixtrans-66.7-43.6178.6-174.7-107.9000112.4W215 N217 E221 H222 L223W215-Y219 VanDerWaalsContact O-CB 3.25Å; W215-Y219 WeakPolarHBondContact O-CB 3.45Å; W215-Y219 PolarHBondContact O-N 2.94Å; N217-Y219 VanDerWaalsContact C-N 3.25Å; N217-Y219 PolarHBondContact O-N 2.85Å; Y219-E221 PolarHBondContact O-N 3.33Å; Y219-H222 PolarHBondContact O-N 3.39Å; Y219-L223 HydrophobicContact CD1-CD1 4.05Å; Y219-L223 HydrophobicContact CE1-CD1 3.54Å; Y219-L223 HydrophobicContact CE1-CG 4.32Å; Y219-L223 WeakPolarHBondContact O-CG 3.32Å; Y219-L223 PolarHBondContact O-N 3.26Å
220R69.9Low63.7Low175 Ų175111.1 Ų111.166%0.6654%0.537SS*.Hα-helixtrans-59.9-43.4172.9-86.9-179.2163.5154.7-3.5112.3L216 N217 N224L216-R220 PolarHBondContact O-N 3.31Å; N217-R220 PolarHBondContact O-N 2.99Å; N217-R220 VanDerWaalsContact O-N 3.14Å; R220-N224 PolarHBondContact O-N 3.44Å; R220-N224 PolarHBondContact O-ND2 2.99Å
221E68.6Low63.7Low118 Ų118110.7 Ų110.755%0.55154%0.535SS*.Hα-helixtrans-68.4-39.5178.2-71.5172.3-134.200111.7N217 N218 Y219 N224 N225N217-E221 WeakPolarHBondContact O-CG 3.23Å; N217-E221 PolarHBondContact O-N 3.27Å; N218-E221 PolarHBondContact O-N 3.39Å; Y219-E221 PolarHBondContact O-N 3.33Å; E221-N224 PolarHBondContact O-N 2.97Å; E221-N225 PolarHBondContact O-N 2.94Å; E221-N225 PolarHBondContact O-ND2 2.89Å
222H73.2Confident63.3Low127 Ų127112.6 Ų112.659%0.58853%0.533SS*.Hα-helixtrans-62.6-46.2176-163.885.2000111.8N218 Y219 N224 N225 V226N218-H222 VanDerWaalsContact O-CB 3.3Å; N218-H222 WeakPolarHBondContact O-CB 3.41Å; N218-H222 PolarHBondContact O-N 2.87Å; Y219-H222 PolarHBondContact O-N 3.39Å; H222-N224 VanDerWaalsContact C-N 3.35Å; H222-N224 PolarHBondContact O-N 3.04Å; H222-N225 PolarHBondContact O-N 3.41Å; H222-V226 WeakPolarHBondContact O-CG2 3.47Å; H222-V226 PolarHBondContact O-N 3.4Å
223L67.7Low62.9Low84 Ų84116.1 Ų116.144%0.4454%0.542SS..Hα-helixtrans-62-39.8175.1-70-179.9000112.4Y219 V226 W227Y219-L223 HydrophobicContact CD1-CD1 4.05Å; Y219-L223 HydrophobicContact CE1-CD1 3.54Å; Y219-L223 HydrophobicContact CE1-CG 4.32Å; Y219-L223 WeakPolarHBondContact O-CG 3.32Å; Y219-L223 PolarHBondContact O-N 3.26Å; L223-V226 PolarHBondContact O-N 3.34Å; L223-W227 WeakPolarHBondContact O-CB 3.28Å; L223-W227 PolarHBondContact O-N 2.97Å
224N69.3Low62.3Low93 Ų93119.1 Ų119.150%0.49756%0.562SS.*Hα-helixtrans-63.7-40.5174.5-87.6-88.8000112.2R220 E221 H222 W227 R228R220-N224 PolarHBondContact O-N 3.44Å; R220-N224 PolarHBondContact O-ND2 2.99Å; E221-N224 PolarHBondContact O-N 2.97Å; H222-N224 VanDerWaalsContact C-N 3.35Å; H222-N224 PolarHBondContact O-N 3.04Å; N224-W227 PolarHBondContact O-N 2.92Å; N224-R228 WeakPolarHBondContact O-CB 3.46Å; N224-R228 VanDerWaalsContact O-CG 3.27Å; N224-R228 WeakPolarHBondContact O-CG 3.29Å; N224-R228 PolarHBondContact O-N 3.4Å
225N70.3Confident61.7Low79 Ų79117.9 Ų117.942%0.42257%0.573SS.*Hα-helixtrans-68.5-38.3177.6-75-49.6000112.4E221 H222 N229E221-N225 PolarHBondContact O-N 2.94Å; E221-N225 PolarHBondContact O-ND2 2.89Å; H222-N225 PolarHBondContact O-N 3.41Å; N225-N229 WeakPolarHBondContact O-CB 3.24Å; N225-N229 PolarHBondContact O-N 2.89Å; N225-N229 PolarHBondContact O-ND2 2.99Å
226V73.8Confident61Low70 Ų70114.6 Ų114.642%0.42458%0.578SS.*Hα-helixtrans-61.3-46.1171.3171.90000110.8H222 L223 N229 M230H222-V226 WeakPolarHBondContact O-CG2 3.47Å; H222-V226 PolarHBondContact O-N 3.4Å; L223-V226 PolarHBondContact O-N 3.34Å; V226-N229 PolarHBondContact O-N 2.76Å; V226-M230 WeakPolarHBondContact O-CB 3.42Å; V226-M230 PolarHBondContact O-N 3.34Å
227W65.6Low60.3Low177 Ų177116.3 Ų116.367%0.6759%0.594SS**Hα-helixtrans-63.2-45.2178.8-172.982.6000112.5L223 N224 N229 M230 S231L223-W227 WeakPolarHBondContact O-CB 3.28Å; L223-W227 PolarHBondContact O-N 2.97Å; N224-W227 PolarHBondContact O-N 2.92Å; W227-N229 PolarHBondContact O-N 3.37Å; W227-M230 WeakPolarHBondContact O-CB 3.33Å; W227-M230 PolarHBondContact O-N 2.91Å; W227-S231 PolarHBondContact O-N 3.43Å
228R65.6Low59.6Low156 Ų156120.9 Ų120.959%0.58962%0.618SS**Hα-helixtrans-62.2-41.9177-71.4177.177.9-147.64.8112.1N224 M230 S231N224-R228 WeakPolarHBondContact O-CB 3.46Å; N224-R228 VanDerWaalsContact O-CG 3.27Å; N224-R228 WeakPolarHBondContact O-CG 3.29Å; N224-R228 PolarHBondContact O-N 3.4Å; R228-M230 VanDerWaalsContact C-N 3.35Å; R228-S231 WeakPolarHBondContact CA-OG 3.35Å; R228-S231 PolarHBondContact O-N 3.4Å; R228-S231 PolarHBondContact O-OG 3.45Å
229N60.2Low58.3Low127 Ų127122.4 Ų122.468%0.67963%0.631SS**Hα-helixtrans-66.4-35.5174.8-74-23.3000112.5N225 V226 W227 S231 Y232N225-N229 WeakPolarHBondContact O-CB 3.24Å; N225-N229 PolarHBondContact O-N 2.89Å; N225-N229 PolarHBondContact O-ND2 2.99Å; V226-N229 PolarHBondContact O-N 2.76Å; W227-N229 PolarHBondContact O-N 3.37Å; N229-S231 VanDerWaalsContact C-N 3.29Å; N229-S231 PolarHBondContact O-N 3.41Å; N229-Y232 PolarHBondContact O-N 3.41Å
230M54.5Low57.2Low137 Ų137125.7 Ų125.768%0.67565%0.653SS**Hα-helixtrans-65.8-32.4174.4-155.274.674.800112.3V226 W227 R228 Y232V226-M230 WeakPolarHBondContact O-CB 3.42Å; V226-M230 PolarHBondContact O-N 3.34Å; W227-M230 WeakPolarHBondContact O-CB 3.33Å; W227-M230 PolarHBondContact O-N 2.91Å; R228-M230 VanDerWaalsContact C-N 3.35Å; M230-Y232 VanDerWaalsContact C-N 3.28Å; M230-Y232 PolarHBondContact O-N 3.43Å
231S55.9Low55.5Low70 Ų70120.6 Ų120.649%0.4966%0.655SS.*THydrogen-bonded Turntrans-76.5-2.4-18067.70000115.7W227 R228 N229W227-S231 PolarHBondContact O-N 3.43Å; R228-S231 WeakPolarHBondContact CA-OG 3.35Å; R228-S231 PolarHBondContact O-N 3.4Å; R228-S231 PolarHBondContact O-OG 3.45Å; N229-S231 VanDerWaalsContact C-N 3.29Å; N229-S231 PolarHBondContact O-N 3.41Å
232Y48.9Very low54.4Low199 Ų199123.3 Ų123.378%0.7867%0.672SS**  trans-12652.5-172.9-110.4-82.6000113.8N229 M230N229-Y232 PolarHBondContact O-N 3.41Å; M230-Y232 VanDerWaalsContact C-N 3.28Å; M230-Y232 PolarHBondContact O-N 3.43Å
233I47.7Very low52.5Low138 Ų138126.1 Ų126.171%0.70869%0.686SS**  trans-106.4103.6163.3-57.5178.9000108.6A235I233-A235 PolarHBondContact O-N 3.24Å
234P40.6Very low51Low113 Ų113126.4 Ų126.473%0.73470%0.7SS**  trans-71.1121.7171.528.9-32.2000109.6A236P234-A236 PolarHBondContact O-N 2.96Å
235A44.5Very low49.4Very low99 Ų99131.3 Ų131.382%0.81872%0.72SS**  trans-68.9103.6177.800000110.7I233 P237I233-A235 PolarHBondContact O-N 3.24Å; A235-P237 WeakPolarHBondContact O-CD 3.42Å
236A44.9Very low47.8Very low81 Ų81134.3 Ų134.367%0.66974%0.742SS**  trans-71.5120.517700000110.8P234 N238P234-A236 PolarHBondContact O-N 2.96Å; A236-N238 PolarHBondContact O-N 2.77Å
237P46.9Very low45.8Very low109 Ų109136.2 Ų136.271%0.70876%0.764SS**  trans-77111.5-177.529.7-33.4000111.2A235 T239A235-P237 WeakPolarHBondContact O-CD 3.42Å; P237-T239 HydrophobicContact CB-CG2 4.31Å; P237-T239 PolarHBondContact O-N 3.02Å
238N46.2Very low44.4Very low165 Ų165132.7 Ų132.788%0.88277%0.773SS**  trans-79.967.8169.6-77.5-78.3000110.7A236 M240A236-N238 PolarHBondContact O-N 2.77Å; N238-M240 PolarHBondContact O-N 3.14Å
239T41.7Very low42.8Very low120 Ų120131.8 Ų131.874%0.73679%0.785SS**  trans-91.597.5175.949.60000111.2P237 G241P237-T239 HydrophobicContact CB-CG2 4.31Å; P237-T239 PolarHBondContact O-N 3.02Å; T239-G241 PolarHBondContact O-N 3.49Å
240M44.1Very low41.5Very low203 Ų203132.9 Ų132.9100%180%0.796SS**  trans-67.1116.3155.1-78.8-168.6172.500108.3N238N238-M240 PolarHBondContact O-N 3.14Å
241G35.2Very low40.5Very low68 Ų68131.9 Ų131.970%0.70180%0.803SS**  trans-140.5130.8176.700000110.7T239T239-G241 PolarHBondContact O-N 3.49Å
242L45Very low39.6Very low174 Ų174135.8 Ų135.891%0.91182%0.824SS**  trans-68.6135.6163.8-75.269.5000108
243Q33.7Very low39.1Very low187 Ų187133.2 Ų133.287%0.87482%0.823SS**  trans-152146.7150.4-160.263.2-2.700109.8
244A35.4Very low38.4Very low89 Ų89135.1 Ų135.174%0.73683%0.834SS**  trans-75.9159-169.200000114.4
245Q36.8Very low38Very low196 Ų196133.1 Ų133.192%0.91683%0.834SS**  trans-83.4116.1174.7-63.5172.2-10.200111.4
246T35.7Very low37.7Very low143 Ų143135.9 Ų135.988%0.87784%0.84SS**  trans-151.179.316330.70000111.8
247A33.1Very low37Very low109 Ų109134.7 Ų134.790%0.90184%0.836SS**  trans-153.4124.816100000109.4
248A36.6Very low36.7Very low103 Ų103138.8 Ų138.885%0.85185%0.848SS**  trans-125.9121.5-179.900000110.4
249T31.8Very low36Very low138 Ų138134.1 Ų134.185%0.84784%0.839SS**  trans-139119.216745.40000110.7
250V32.4Very low35.8Very low149 Ų149137.2 Ų137.290%0.90385%0.85SS**  trans-29.6143.8174.2-740000118.4
251S33.5Very low35.2Very low117 Ų117131.2 Ų131.282%0.81884%0.84SS**  trans-84.4154.1164.9-43.10000112.4
252T37.4Very low35.3Very low151 Ų151135.4 Ų135.493%0.92685%0.846SS**  trans-140.3158.314339.80000110.6
253N37.8Very low35.4Very low145 Ų145133 Ų13378%0.77584%0.841SS**  trans-130.6137.4-174.5167.813.7000108.7
254L33.5Very low35.7Very low179 Ų179129.9 Ų129.994%0.93783%0.834SS**  trans-159148.7151.7-131.969.4000108.8
255G31.8Very low35.5Very low70 Ų70135 Ų13572%0.72284%0.843SS**  trans-164.4164.9-174.100000117.3
256V37.5Very low35.7Very low158 Ų158129 Ų12996%0.95883%0.833SS**  trans-156.4149178.1-178.20000106.3
257G30.3Very low35.6Very low56 Ų56130.2 Ų130.258%0.57783%0.829SS**  cis164.1169.1-3.300000110.5
258M40.5Very low35.6Very low194 Ų194131.6 Ų131.696%0.95682%0.817SS**  trans66.8144.6-167.7-43.8-58.6-177.800113.1
259G32.8Very low35.5Very low68 Ų68133.1 Ų133.170%0.70181%0.81SS**  cis98.7121.717.600000109.1
260L36.1Very low35.6Very low185 Ų185137.5 Ų137.597%0.96981%0.811SS**  cis-137172.322.5-55.4157.7000107.9
261G31.8Very low35.6Very low77 Ų77133.5 Ų133.579%0.79480%0.8SS**  cis164.3135.49.500000107.6
262L37.1Very low35.6Very low156 Ų156132.5 Ų132.582%0.81780%0.799SS**  trans-97.1163.8-179.5-88.1164.1000111.3
263P47.2Very low35.7Very low124 Ų124130.1 Ų130.181%0.80579%0.788SS**  -137.5156.59837-25.5000115.1
264V41.3Very low36Very low121 Ų121131 Ų13173%0.73379%0.793SS**  trans-89.9143.4170.1172.20000109.7
265Q31.1Very low36.2Very low197 Ų197128.5 Ų128.592%0.92179%0.791SS**  trans-137.7146.6157.2-79.9-177.4-20.800109.5
266G40.1Very low36.9Very low69 Ų69130.5 Ų130.571%0.71179%0.794SS**  trans-173.9119.617800000111.7
267E33.7Very low37.3Very low169 Ų169129.5 Ų129.579%0.7978%0.783SS**  trans-169152-173.6-106171.8134.900106.6
268Q33.8Very low37.9Very low137 Ų137133.3 Ų133.364%0.6479%0.79SS**  cis-166.71640.5-147.1173.852.700110.2
269L33.8Very low38.2Very low136 Ų136130.4 Ų130.471%0.71278%0.779SS**  trans68.7151.7167-48.1168.2000115.1
270R34.9Very low39.1Very low229 Ų229135.1 Ų135.186%0.86479%0.788SS**  cis-159153.72.4-164.7177.3-63.4-138.6-0.3107.1
271G31.8Very low40.1Very low66 Ų66133.1 Ų133.168%0.6878%0.778SS**  cis165.4165.5-7.500000111.2
272A32.8Very low41.1Very low96 Ų96134.2 Ų134.279%0.79377%0.766SS**  trans61.798167.800000121.2
273S40.9Very low41.7Very low100 Ų100133.9 Ų133.970%0.69977%0.765SS**  trans42.8121.4131.661.50000123.4
274N42.6Very low42Very low163 Ų163132.8 Ų132.887%0.87275%0.752SS**  trans57.3113.3135.2-59.62.1000121
275S37.6Very low42.4Very low127 Ų127133.4 Ų133.489%0.88875%0.745SS**  -144.1146.9126.9-1630000110.3
276S47.3Very low43.2Very low113 Ų113129.1 Ų129.179%0.7973%0.732SS**  trans-85.8169-175.2-70.50000112.8
277N45.8Very low43.5Very low137 Ų137133.8 Ų133.873%0.73373%0.729SS**  trans76.599.3159.3-164.420000117.2
278N42.8Very low44.2Very low135 Ų135134.5 Ų134.572%0.72273%0.73SS**  -166.6141.9117.4-110.2-71.5000114.7
279N47.3Very low44.8Very low134 Ų134137.8 Ų137.872%0.71774%0.736SS**  trans-2119.8166.1-68.4-66.1000120.8N281N279-N281 PolarHBondContact O-N 2.92Å
280N51.4Low45.6Very low167 Ų167141.4 Ų141.489%0.89374%0.742SS**SBendtrans-63.197.4156.7-81.1-34000111.1
281N55.9Low46.3Very low142 Ų142136.3 Ų136.376%0.75973%0.732SS**  trans-164.446.9165-111.5-29.9000116N279N279-N281 PolarHBondContact O-N 2.92Å
282N54Low47.1Very low101 Ų101138.2 Ų138.254%0.5474%0.735SS.*  trans-117.3-1.4174.5-87.6-49.2000115.9N284 K285N282-N284 PolarHBondContact O-N 3.47Å; N282-K285 WeakPolarHBondContact OD1-CE 3.31Å; N282-K285 PolarHBondContact OD1-NZ 2.83Å
283N50.3Low48Very low148 Ų148142 Ų14279%0.79173%0.733SS**THydrogen-bonded Turntrans-75.439.9177.7-690.1000113.7Y287N283-Y287 VanDerWaalsContact O-CE2 3.24Å; N283-Y287 WeakPolarHBondContact O-CE2 3.41Å; N283-Y287 PolarHBondContact O-OH 3.45Å
284N53.3Low48.4Very low101 Ų101141.8 Ų141.854%0.5474%0.738SS.*THydrogen-bonded Turntrans-134.6-11168.781.68.7000115.1N282 V286N282-N284 PolarHBondContact O-N 3.47Å; N284-V286 PolarHBondContact O-N 3.42Å
285K48.3Very low48.6Very low134 Ų134142.4 Ų142.458%0.58373%0.733SS**THydrogen-bonded Turntrans-82-9.4-172.8-68.2176.2-176.7158.50114.7N282N282-K285 WeakPolarHBondContact OD1-CE 3.31Å; N282-K285 PolarHBondContact OD1-NZ 2.83Å
286V49.4Very low49.3Very low107 Ų107144.7 Ų144.765%0.64873%0.729SS**THydrogen-bonded Turntrans-81.9-44.2179.4-177.70000111.4N284 K288N284-V286 PolarHBondContact O-N 3.42Å; V286-K288 VanDerWaalsContact C-N 3.28Å; V286-K288 PolarHBondContact O-N 3.07Å
287Y46.7Very low49.8Very low167 Ų167145.5 Ų145.566%0.65572%0.723SS**G310 helixtrans-69.8-25.9-175.2-30.6-56000112.8N283 R289N283-Y287 VanDerWaalsContact O-CE2 3.24Å; N283-Y287 WeakPolarHBondContact O-CE2 3.41Å; N283-Y287 PolarHBondContact O-OH 3.45Å; Y287-R289 PolarHBondContact O-N 3.25Å
288K46.6Very low50.6Low185 Ų185143.4 Ų143.480%0.80472%0.719SS**G310 helixtrans-80.99.6-173.8-146171.9-176.5178.80114.5V286V286-K288 VanDerWaalsContact C-N 3.28Å; V286-K288 PolarHBondContact O-N 3.07Å
289R47.8Very low52.4Low206 Ų206144.8 Ų144.878%0.77772%0.715SS**G310 helixtrans-96-5.3177.5-67-164.4178.6-153.51.4115.4Y287Y287-R289 PolarHBondContact O-N 3.25Å
290Y50.6Low54.5Low212 Ų212141.1 Ų141.183%0.83169%0.693SS**SBendtrans-111.79.4179-62.8-73.9000114.3
291N48.6Very low56.6Low121 Ų121133.2 Ų133.265%0.64765%0.651SS**  trans-109.144.5166.3-160-8.9000111.4K293N291-K293 PolarHBondContact O-N 2.93Å
292S49.5Very low58.4Low107 Ų107130.4 Ų130.475%0.74864%0.639SS**  trans-64.791.9141.6-68.30000106.4A294S292-A294 PolarHBondContact O-N 3.37Å; S292-A294 VanDerWaalsContact O-N 3.1Å
293K50.3Low60.3Low175 Ų175128 Ų12876%0.76162%0.623SS**  trans-43.4123.6151.8-65.2-176.9-179.9-178.40105.4N291 K295N291-K293 PolarHBondContact O-N 2.93Å; K293-K295 PolarHBondContact O-N 2.95Å
294A51.3Low62.4Low96 Ų96120.9 Ų120.979%0.79359%0.585SS**  trans-49.8115.4-17800000107S292 E296S292-A294 PolarHBondContact O-N 3.37Å; S292-A294 VanDerWaalsContact O-N 3.1Å; A294-E296 PolarHBondContact O-N 3.28Å
295K46.2Very low64.3Low176 Ų176120.6 Ų120.677%0.76558%0.581SS**  trans-57.4112.2-176.3179.1175.2-174-70.60104.7K293 I297K293-K295 PolarHBondContact O-N 2.95Å; K295-I297 WeakPolarHBondContact O-CG1 3.32Å; K295-I297 PolarHBondContact O-N 3.02Å
296E52Low66.6Low174 Ų174120.5 Ų120.581%0.81359%0.586SS**  trans-65.396.2-179.5-171.8162.5-146.900105.5A294 S298A294-E296 PolarHBondContact O-N 3.28Å; E296-S298 PolarHBondContact O-N 2.89Å
297I57.3Low68.6Low130 Ų130119.3 Ų119.367%0.66758%0.576SS**  trans-71.688.7174.2-69.7151.6000102.2K295 R299K295-I297 WeakPolarHBondContact O-CG1 3.32Å; K295-I297 PolarHBondContact O-N 3.02Å; I297-R299 VanDerWaalsContact O-CG 3.24Å; I297-R299 WeakPolarHBondContact O-CG 3.44Å; I297-R299 PolarHBondContact O-N 3.03Å
298S63.4Low70.9Confident93 Ų93118.5 Ų118.565%0.6558%0.584SS**  trans-50.4103.6-170.234.80000108.4E296 H300E296-S298 PolarHBondContact O-N 2.89Å; S298-H300 PolarHBondContact O-N 3.38Å
299R79.9Confident73.1Confident165 Ų165111.8 Ų111.862%0.62356%0.555SS**BIsolated β-bridgetrans-80.462.5-177.2-66.3-164.6173.7-167.8-1.7108.1I297 N315 S316 H317I297-R299 VanDerWaalsContact O-CG 3.24Å; I297-R299 WeakPolarHBondContact O-CG 3.44Å; I297-R299 PolarHBondContact O-N 3.03Å; R299-N315 CarbonylContact O-C 2.89Å; R299-N315 WeakPolarHBondContact O-CA 3.17Å; R299-S316 CarbonylContact O-C 3.55Å; R299-S316 PolarHBondContact O-N 2.98Å; R299-H317 VanDerWaalsContact C-C 3.5Å; R299-H317 CarbonylContact C-O 3.2Å; R299-H317 CarbonylContact O-C 3.24Å; R299-H317 VanDerWaalsContact O-C 3.24Å; R299-H317 PolarHBondContact O-N 3.32Å
300H92.1Very high75.2Confident57 Ų57106 Ų10626%0.26454%0.544SS..  trans-95.1127.7-169.9168.587.5000109.9S298 E305 I314 H317S298-H300 PolarHBondContact O-N 3.38Å; H300-E305 VanDerWaalsContact CE1-CD 3.5Å; H300-E305 IonicContact CE1-OE1 3.37Å; H300-E305 PolarHBondContact CE1-OE1 3.42Å; H300-E305 IonicContact CE1-OE2 3.53Å; H300-E305 IonicContact NE2-OE2 3.49Å; H300-E305 PolarHBondContact NE2-OE2 3.43Å; H300-I314 CarbonylContact C-O 3.52Å; H300-I314 WeakPolarHBondContact CA-O 3.44Å; H300-I314 WeakPolarHBondContact ND1-CG2 3.44Å; H300-H317 CarbonylContact C-O 3.26Å; H300-H317 VanDerWaalsContact C-O 3.26Å
301C94.8Very high77.2Confident0 Ų0102.6 Ų102.60%054%0.536CS..  trans-108.896-179.8-171.90000111.3F303 C304 E305 I314 H317 C328C301-F303 PolarHBondContact O-N 3.02Å; C301-F303 VanDerWaalsContact O-N 3.1Å; C301-C304 HydrophobicContact CB-CB 3.94Å; C301-C304 PolarHBondContact O-N 3.24Å; C301-C304 PolarHBondContact SG-N 2.94Å; C301-C304 VanDerWaalsContact SG-N 3.43Å; C301-E305 PolarHBondContact O-N 2.81Å; C301-I314 PolarHBondContact N-O 2.92Å; C301-H317 WeakPolarHBondContact CB-NE2 3.43Å; C301-H317 VanDerWaalsContact CB-O 3.27Å; C301-H317 WeakPolarHBondContact CB-O 3.39Å; C301-H317 PolarHBondContact N-O 3.41Å; C301-H317 PolarHBondContact SG-NE2 3.24Å; C301-C328 VanDerWaalsContact SG-SG 3.64Å
302V94.1Very high79.1Confident84 Ų84101 Ų10151%0.50954%0.539SS..Hα-helixtrans-51.7-33173-172.60000111.9E305 N306 V319V302-E305 PolarHBondContact O-N 3.18Å; V302-N306 WeakPolarHBondContact O-CB 3.43Å; V302-N306 PolarHBondContact O-N 3.33Å; V302-V319 HydrophobicContact CB-CG2 4.23Å
303F94.7Very high81.1Confident49 Ų4998.1 Ų98.122%0.21552%0.517CS..Hα-helixtrans-68.1-38.8175.6-175.5-93.7000112.7C301 N307 V319 K330 L331 T348C301-F303 PolarHBondContact O-N 3.02Å; C301-F303 VanDerWaalsContact O-N 3.1Å; F303-N307 WeakPolarHBondContact CE1-ND2 3.44Å; F303-N307 WeakPolarHBondContact CZ-ND2 3.35Å; F303-N307 PolarHBondContact O-N 3.15Å; F303-N307 PolarHBondContact O-ND2 3.5Å; F303-V319 HydrophobicContact CB-CG1 4.35Å; F303-V319 HydrophobicContact CB-CG2 4.33Å; F303-K330 HydrophobicContact CD1-CB 4.44Å; F303-K330 HydrophobicContact CE1-CB 3.99Å; F303-L331 HydrophobicContact CD1-CB 4.01Å; F303-L331 HydrophobicContact CD2-CD1 4.46Å; F303-L331 HydrophobicContact CD2-CD2 4.44Å; F303-L331 HydrophobicContact CE1-CB 3.93Å; F303-L331 HydrophobicContact CE2-CD1 3.96Å; F303-L331 HydrophobicContact CG-CB 4.39Å; F303-L331 HydrophobicContact CZ-CB 4.24Å; F303-L331 HydrophobicContact CZ-CD1 4Å; F303-T348 HydrophobicContact CE2-CG2 3.85Å; F303-T348 HydrophobicContact CZ-CG2 4.4Å
304C94.1Very high83.2Confident0 Ų090.8 Ų90.80%049%0.486CS..Hα-helixtrans-75.1-33.7174.7-74.20000112C301 N307 N308 E309 V313 I314 C328C301-C304 HydrophobicContact CB-CB 3.94Å; C301-C304 PolarHBondContact O-N 3.24Å; C301-C304 PolarHBondContact SG-N 2.94Å; C301-C304 VanDerWaalsContact SG-N 3.43Å; C304-N307 CarbonylContact O-C 3.54Å; C304-N307 PolarHBondContact O-N 3.04Å; C304-N308 PolarHBondContact O-N 2.91Å; C304-E309 HydrophobicContact CB-CB 3.95Å; C304-E309 HydrophobicContact CB-CG 3.8Å; C304-E309 WeakPolarHBondContact O-CB 3.43Å; C304-E309 WeakPolarHBondContact O-CG 3.38Å; C304-E309 PolarHBondContact O-N 2.89Å; C304-V313 HydrophobicContact CB-CG1 4.45Å; C304-I314 HydrophobicContact CB-CG1 4.17Å; C304-C328 VanDerWaalsContact SG-SG 3.61Å
305E93.8Very high85.1Confident95 Ų9589.8 Ų89.844%0.44447%0.467SS..Hα-helixtrans-61-50.5173.6-179.6-179.8-120.200111.7H300 C301 V302 N307 N308 I314H300-E305 VanDerWaalsContact CE1-CD 3.5Å; H300-E305 IonicContact CE1-OE1 3.37Å; H300-E305 PolarHBondContact CE1-OE1 3.42Å; H300-E305 IonicContact CE1-OE2 3.53Å; H300-E305 IonicContact NE2-OE2 3.49Å; H300-E305 PolarHBondContact NE2-OE2 3.43Å; C301-E305 PolarHBondContact O-N 2.81Å; V302-E305 PolarHBondContact O-N 3.18Å; E305-N307 PolarHBondContact O-N 2.84Å; E305-N308 PolarHBondContact O-N 3.23Å; E305-I314 HydrophobicContact CB-CD1 4.05Å; E305-I314 HydrophobicContact CB-CG1 4.4Å; E305-I314 HydrophobicContact CB-CG2 4.1Å; E305-I314 HydrophobicContact CG-CD1 4.41Å
306N94.9Very high87.2Confident131 Ų13184.1 Ų84.170%0.70145%0.45SS*.Hα-helixtrans-65.1-18.7177.2-169.798.1000113.3V302V302-N306 WeakPolarHBondContact O-CB 3.43Å; V302-N306 PolarHBondContact O-N 3.33Å
307N92.9Very high89.1Confident82 Ų8276.9 Ų76.944%0.43942%0.416SS..THydrogen-bonded Turntrans-95.16.6172.8-76-65.4000113.1F303 C304 E305 E309F303-N307 WeakPolarHBondContact CE1-ND2 3.44Å; F303-N307 WeakPolarHBondContact CZ-ND2 3.35Å; F303-N307 PolarHBondContact O-N 3.15Å; F303-N307 PolarHBondContact O-ND2 3.5Å; C304-N307 CarbonylContact O-C 3.54Å; C304-N307 PolarHBondContact O-N 3.04Å; E305-N307 PolarHBondContact O-N 2.84Å; N307-E309 HydrophobicContact CB-CG 4.37Å; N307-E309 PolarHBondContact O-N 3.16Å
308N94Very high90.9Very high151 Ų15172.7 Ų72.781%0.80740%0.398SS*.THydrogen-bonded Turntrans5235.2-177.6-55.7120.7000114.4C304 E305C304-N308 PolarHBondContact O-N 2.91Å; E305-N308 PolarHBondContact O-N 3.23Å
309E93.4Very high92.3Very high44 Ų4470 Ų7021%0.20638%0.378CS..  trans-62.3155.3167.7-60.4-76.8159.500110.2C304 N307 V313 I314 K330C304-E309 HydrophobicContact CB-CB 3.95Å; C304-E309 HydrophobicContact CB-CG 3.8Å; C304-E309 WeakPolarHBondContact O-CB 3.43Å; C304-E309 WeakPolarHBondContact O-CG 3.38Å; C304-E309 PolarHBondContact O-N 2.89Å; N307-E309 HydrophobicContact CB-CG 4.37Å; N307-E309 PolarHBondContact O-N 3.16Å; E309-V313 HydrophobicContact CB-CB 4.27Å; E309-V313 HydrophobicContact CB-CG1 4.09Å; E309-V313 HydrophobicContact CG-CG1 4.44Å; E309-I314 HydrophobicContact CB-CG1 4.45Å; E309-I314 VanDerWaalsContact O-CD1 3.23Å; E309-I314 WeakPolarHBondContact O-CD1 3.39Å; E309-K330 WeakPolarHBondContact OE1-CE 3.47Å; E309-K330 IonicContact OE1-NZ 3.31Å; E309-K330 PolarHBondContact OE1-NZ 3.3Å; E309-K330 WeakPolarHBondContact OE2-CE 3.47Å; E309-K330 IonicContact OE2-NZ 3.1Å; E309-K330 PolarHBondContact OE2-NZ 2.98Å
310P92.3Very high92.9Very high84 Ų8468.4 Ų68.455%0.54537%0.372SS..  trans-62.1149178.625.3-34.8000112.1A312 V313 I314P310-A312 PolarHBondContact O-N 3.03Å; P310-A312 VanDerWaalsContact O-N 3.1Å; P310-V313 HydrophobicContact CG-CB 4.25Å; P310-V313 HydrophobicContact CG-CG2 3.89Å; P310-V313 WeakPolarHBondContact O-CA 3.35Å; P310-V313 WeakPolarHBondContact O-CB 3.4Å; P310-V313 PolarHBondContact O-N 3.1Å; P310-I314 PolarHBondContact O-N 3.41Å; P310-I314 VanDerWaalsContact O-N 3.08Å
311E91.8Very high92.9Very high141 Ų14167.3 Ų67.366%0.65937%0.368SS*.Hα-helixtrans-53.5-37.5-175-173.7179.6178.500113.5V313 I314 N315E311-V313 PolarHBondContact O-N 3.29Å; E311-I314 PolarHBondContact O-N 3.22Å; E311-I314 VanDerWaalsContact O-N 3.15Å; E311-N315 VanDerWaalsContact CG-ND2 3.32Å; E311-N315 WeakPolarHBondContact CG-ND2 3.45Å; E311-N315 WeakPolarHBondContact O-CB 3.43Å; E311-N315 PolarHBondContact O-N 2.97Å; E311-N315 PolarHBondContact OE1-ND2 3.32Å
312A89.5Confident92.7Very high87 Ų8774.9 Ų74.972%0.71941%0.408SS*.Hα-helixtrans-60.9-27.3175.200000113.7P310 S316P310-A312 PolarHBondContact O-N 3.03Å; P310-A312 VanDerWaalsContact O-N 3.1Å; A312-S316 WeakPolarHBondContact O-CB 3.24Å
313V90.6Very high92.4Very high47 Ų4778.4 Ų78.429%0.28542%0.417SS..Hα-helixtrans-83.2-43.7171.8172.80000110.4C304 E309 P310 E311 N315 S316 H317C304-V313 HydrophobicContact CB-CG1 4.45Å; E309-V313 HydrophobicContact CB-CB 4.27Å; E309-V313 HydrophobicContact CB-CG1 4.09Å; E309-V313 HydrophobicContact CG-CG1 4.44Å; P310-V313 HydrophobicContact CG-CB 4.25Å; P310-V313 HydrophobicContact CG-CG2 3.89Å; P310-V313 WeakPolarHBondContact O-CA 3.35Å; P310-V313 WeakPolarHBondContact O-CB 3.4Å; P310-V313 PolarHBondContact O-N 3.1Å; E311-V313 PolarHBondContact O-N 3.29Å; V313-N315 VanDerWaalsContact C-N 3.3Å; V313-N315 PolarHBondContact O-N 2.86Å; V313-S316 PolarHBondContact O-N 3.23Å; V313-S316 PolarHBondContact O-OG 3.07Å; V313-H317 PolarHBondContact O-CE1 3.02Å; V313-H317 PolarHBondContact O-ND1 2.98Å
314I93.6Very high92.1Very high21 Ų2181.7 Ų81.711%0.10844%0.437CS..Hα-helixtrans-54.7-46.9176.9-61.7173.4000110.8H300 C301 C304 E305 E309 P310 E311 S316H300-I314 CarbonylContact C-O 3.52Å; H300-I314 WeakPolarHBondContact CA-O 3.44Å; H300-I314 WeakPolarHBondContact ND1-CG2 3.44Å; C301-I314 PolarHBondContact N-O 2.92Å; C304-I314 HydrophobicContact CB-CG1 4.17Å; E305-I314 HydrophobicContact CB-CD1 4.05Å; E305-I314 HydrophobicContact CB-CG1 4.4Å; E305-I314 HydrophobicContact CB-CG2 4.1Å; E305-I314 HydrophobicContact CG-CD1 4.41Å; E309-I314 HydrophobicContact CB-CG1 4.45Å; E309-I314 VanDerWaalsContact O-CD1 3.23Å; E309-I314 WeakPolarHBondContact O-CD1 3.39Å; P310-I314 PolarHBondContact O-N 3.41Å; P310-I314 VanDerWaalsContact O-N 3.08Å; E311-I314 PolarHBondContact O-N 3.22Å; E311-I314 VanDerWaalsContact O-N 3.15Å; I314-S316 VanDerWaalsContact C-N 3.34Å; I314-S316 PolarHBondContact O-N 3.04Å
315N92.7Very high92Very high74 Ų7487.4 Ų87.440%0.39646%0.459SS..THydrogen-bonded Turntrans-90.112.8-174.2-67.6-23.7000114.2R299 E311 V313R299-N315 CarbonylContact O-C 2.89Å; R299-N315 WeakPolarHBondContact O-CA 3.17Å; E311-N315 VanDerWaalsContact CG-ND2 3.32Å; E311-N315 WeakPolarHBondContact CG-ND2 3.45Å; E311-N315 WeakPolarHBondContact O-CB 3.43Å; E311-N315 PolarHBondContact O-N 2.97Å; E311-N315 PolarHBondContact OE1-ND2 3.32Å; V313-N315 VanDerWaalsContact C-N 3.3Å; V313-N315 PolarHBondContact O-N 2.86Å
316S90.4Very high92.1Very high57 Ų5783 Ų8340%0.39944%0.438SS..BIsolated β-bridgetrans-92.3-25.8179.664.90000115.1R299 A312 V313 I314R299-S316 CarbonylContact O-C 3.55Å; R299-S316 PolarHBondContact O-N 2.98Å; A312-S316 WeakPolarHBondContact O-CB 3.24Å; V313-S316 PolarHBondContact O-N 3.23Å; V313-S316 PolarHBondContact O-OG 3.07Å; I314-S316 VanDerWaalsContact C-N 3.34Å; I314-S316 PolarHBondContact O-N 3.04Å
317H91.8Very high92.1Very high23 Ų2380.4 Ų80.411%0.10642%0.424CS..  trans-152.2152.3-172.360.8-84.2000112.1R299 H300 C301 V313 C328R299-H317 VanDerWaalsContact C-C 3.5Å; R299-H317 CarbonylContact C-O 3.2Å; R299-H317 CarbonylContact O-C 3.24Å; R299-H317 VanDerWaalsContact O-C 3.24Å; R299-H317 PolarHBondContact O-N 3.32Å; H300-H317 CarbonylContact C-O 3.26Å; H300-H317 VanDerWaalsContact C-O 3.26Å; C301-H317 WeakPolarHBondContact CB-NE2 3.43Å; C301-H317 VanDerWaalsContact CB-O 3.27Å; C301-H317 WeakPolarHBondContact CB-O 3.39Å; C301-H317 PolarHBondContact N-O 3.41Å; C301-H317 PolarHBondContact SG-NE2 3.24Å; V313-H317 PolarHBondContact O-CE1 3.02Å; V313-H317 PolarHBondContact O-ND1 2.98Å; H317-C328 VanDerWaalsContact CD2-CA 3.41Å; H317-C328 WeakPolarHBondContact CD2-CA 3.45Å; H317-C328 PolarHBondContact NE2-SG 2.97Å; H317-C328 VanDerWaalsContact NE2-SG 3.35Å
318S93.6Very high92.2Very high42 Ų4276.5 Ų76.529%0.29440%0.403SS..  trans-81.4160.5167.154.50000111.3R320 L327S318-R320 VanDerWaalsContact C-N 3.32Å; S318-R320 WeakPolarHBondContact CB-O 3.46Å; S318-R320 PolarHBondContact O-N 3.44Å; S318-R320 PolarHBondContact OG-O 2.95Å; S318-L327 VanDerWaalsContact O-CB 3.24Å; S318-L327 WeakPolarHBondContact O-CB 3.44Å; S318-L327 WeakPolarHBondContact OG-CD1 3.46Å
319V93.5Very high92.2Very high37 Ų3772.8 Ų72.822%0.22439%0.387CS..SBendtrans-61.4-42.6174.9-172.60000111.1V302 F303 L327 C328 L331V302-V319 HydrophobicContact CB-CG2 4.23Å; F303-V319 HydrophobicContact CB-CG1 4.35Å; F303-V319 HydrophobicContact CB-CG2 4.33Å; V319-L327 PolarHBondContact O-N 3.29Å; V319-C328 PolarHBondContact O-N 3.07Å; V319-L331 HydrophobicContact CG1-CD2 4.32Å
320R93.1Very high92.2Very high131 Ų13175.2 Ų75.249%0.49440%0.397SS..BIsolated β-bridgetrans-132.1159178.8-69.1-176.5-179.2178.32.1112.3S318 N324 R325S318-R320 VanDerWaalsContact C-N 3.32Å; S318-R320 WeakPolarHBondContact CB-O 3.46Å; S318-R320 PolarHBondContact O-N 3.44Å; S318-R320 PolarHBondContact OG-O 2.95Å; R320-N324 WeakPolarHBondContact CD-O 3.47Å; R320-R325 CarbonylContact C-O 3.53Å; R320-R325 VanDerWaalsContact CA-O 3.23Å; R320-R325 WeakPolarHBondContact CA-O 3.37Å
321D90.6Very high92.3Very high34 Ų3471.8 Ų71.818%0.18237%0.374CS..  trans-85.4165.7175.2-170.611.4000112F323 N324 R325 L327D321-F323 PolarHBondContact O-N 3.34Å; D321-F323 VanDerWaalsContact O-N 3.17Å; D321-F323 WeakPolarHBondContact OD2-CD2 3.2Å; D321-N324 WeakPolarHBondContact O-CA 3.34Å; D321-N324 PolarHBondContact O-N 3.34Å; D321-R325 HydrophobicContact CB-CB 4.26Å; D321-R325 PolarHBondContact N-O 3.44Å; D321-R325 IonicContact OD2-CZ 2.79Å; D321-R325 VanDerWaalsContact OD2-CZ 3.31Å; D321-R325 IonicContact OD2-NE 3.19Å; D321-R325 PolarHBondContact OD2-NE 3.45Å; D321-R325 VanDerWaalsContact OD2-NE 3.1Å; D321-R325 IonicContact OD2-NH2 2.65Å; D321-R325 PolarHBondContact OD2-NH2 2.9Å; D321-L327 HydrophobicContact CB-CD1 3.76Å; D321-L327 HydrophobicContact CB-CG 3.98Å
322N90.6Very high92.5Very high158 Ų15869.2 Ų69.285%0.84536%0.358SS*.THydrogen-bonded Turntrans-57.2-27.3170.1-69.5104.6000112.5N324N322-N324 VanDerWaalsContact C-N 3.26Å; N322-N324 PolarHBondContact O-N 2.95Å
323F88Confident92.7Very high159 Ų15970.3 Ų70.370%0.69736%0.356SS*.THydrogen-bonded Turntrans-86.218.5174.1-60.6-81.8000113.7D321 R325D321-F323 PolarHBondContact O-N 3.34Å; D321-F323 VanDerWaalsContact O-N 3.17Å; D321-F323 WeakPolarHBondContact OD2-CD2 3.2Å; F323-R325 HydrophobicContact CB-CG 4.38Å; F323-R325 PolarHBondContact O-N 3.3Å
324N89.3Confident92.9Very high118 Ų11872.2 Ų72.263%0.63136%0.359SS*.SBendtrans59.8-2.1-177-88.1-66.3000117.3R320 D321 N322R320-N324 WeakPolarHBondContact CD-O 3.47Å; D321-N324 WeakPolarHBondContact O-CA 3.34Å; D321-N324 PolarHBondContact O-N 3.34Å; N322-N324 VanDerWaalsContact C-N 3.26Å; N322-N324 PolarHBondContact O-N 2.95Å
325R92.5Very high93Very high119 Ų11975.2 Ų75.245%0.44938%0.378SS..  trans-62.3144.4172.8-57.4179.8-66.3-172.3-1.1111.2R320 D321 F323 L327 D344R320-R325 CarbonylContact C-O 3.53Å; R320-R325 VanDerWaalsContact CA-O 3.23Å; R320-R325 WeakPolarHBondContact CA-O 3.37Å; D321-R325 HydrophobicContact CB-CB 4.26Å; D321-R325 PolarHBondContact N-O 3.44Å; D321-R325 IonicContact OD2-CZ 2.79Å; D321-R325 VanDerWaalsContact OD2-CZ 3.31Å; D321-R325 IonicContact OD2-NE 3.19Å; D321-R325 PolarHBondContact OD2-NE 3.45Å; D321-R325 VanDerWaalsContact OD2-NE 3.1Å; D321-R325 IonicContact OD2-NH2 2.65Å; D321-R325 PolarHBondContact OD2-NH2 2.9Å; F323-R325 HydrophobicContact CB-CG 4.38Å; F323-R325 PolarHBondContact O-N 3.3Å; R325-L327 PolarHBondContact O-N 2.93Å; R325-D344 HydrophobicContact CB-CB 4.43Å; R325-D344 HydrophobicContact CG-CB 4.46Å
326V95.3Very high93.2Very high2 Ų271.8 Ų71.81%0.01236%0.36CS..BIsolated β-bridgetrans-68.4124.1173.1-178.60000110.8C328 L331 R332 D344 A346V326-C328 HydrophobicContact CG1-CB 4.38Å; V326-L331 HydrophobicContact CG1-CB 3.89Å; V326-L331 HydrophobicContact CG1-CD2 3.83Å; V326-L331 HydrophobicContact CG1-CG 3.87Å; V326-L331 HydrophobicContact CG2-CD2 4.37Å; V326-R332 HydrophobicContact CB-CG 4.2Å; V326-R332 HydrophobicContact CG1-CG 3.86Å; V326-R332 WeakPolarHBondContact O-CD 3.4Å; V326-R332 PolarHBondContact O-NH1 2.99Å; V326-D344 PolarHBondContact N-O 3.1Å; V326-A346 HydrophobicContact CG2-CB 4.39Å; V326-A346 VanDerWaalsContact CG2-O 3.25Å; V326-A346 WeakPolarHBondContact CG2-O 3.41Å
327L94.6Very high93.5Very high78 Ų7874.1 Ų74.141%0.40837%0.374SS..  trans-95-28.7174-90169.1000112.9S318 V319 D321 R325 P329S318-L327 VanDerWaalsContact O-CB 3.24Å; S318-L327 WeakPolarHBondContact O-CB 3.44Å; S318-L327 WeakPolarHBondContact OG-CD1 3.46Å; V319-L327 PolarHBondContact O-N 3.29Å; D321-L327 HydrophobicContact CB-CD1 3.76Å; D321-L327 HydrophobicContact CB-CG 3.98Å; R325-L327 PolarHBondContact O-N 2.93Å; L327-P329 WeakPolarHBondContact O-CD 3.42Å
328C94.8Very high93.7Very high0 Ų080.4 Ų80.40%041%0.406CS..  trans-61.9117.9-177.3177.10000112.8C301 C304 H317 V319 V326 K330 L331 R332C301-C328 VanDerWaalsContact SG-SG 3.64Å; C304-C328 VanDerWaalsContact SG-SG 3.61Å; H317-C328 VanDerWaalsContact CD2-CA 3.41Å; H317-C328 WeakPolarHBondContact CD2-CA 3.45Å; H317-C328 PolarHBondContact NE2-SG 2.97Å; H317-C328 VanDerWaalsContact NE2-SG 3.35Å; V319-C328 PolarHBondContact O-N 3.07Å; V326-C328 HydrophobicContact CG1-CB 4.38Å; C328-K330 VanDerWaalsContact C-N 3.32Å; C328-K330 PolarHBondContact O-N 3.46Å; C328-L331 HydrophobicContact CB-CB 4.04Å; C328-L331 PolarHBondContact O-N 3.35Å; C328-R332 VanDerWaalsContact O-CG 3.26Å; C328-R332 WeakPolarHBondContact O-CG 3.44Å; C328-R332 PolarHBondContact O-N 2.91Å
329P93.9Very high93.8Very high72 Ų7282.1 Ų82.147%0.46842%0.418SS..Hα-helixtrans-63.9-35.5-175.825-33.4000112.7L327 R332 T333L327-P329 WeakPolarHBondContact O-CD 3.42Å; P329-R332 PolarHBondContact O-N 3.36Å; P329-T333 PolarHBondContact O-N 3.26Å; P329-T333 PolarHBondContact O-OG1 3.47Å
330K93.5Very high93.8Very high96 Ų9682.8 Ų82.842%0.41743%0.432SS..Hα-helixtrans-63.5-45.9176.5-63.6-79.5179124.20111.3F303 E309 C328 T333 Y334F303-K330 HydrophobicContact CD1-CB 4.44Å; F303-K330 HydrophobicContact CE1-CB 3.99Å; E309-K330 WeakPolarHBondContact OE1-CE 3.47Å; E309-K330 IonicContact OE1-NZ 3.31Å; E309-K330 PolarHBondContact OE1-NZ 3.3Å; E309-K330 WeakPolarHBondContact OE2-CE 3.47Å; E309-K330 IonicContact OE2-NZ 3.1Å; E309-K330 PolarHBondContact OE2-NZ 2.98Å; C328-K330 VanDerWaalsContact C-N 3.32Å; C328-K330 PolarHBondContact O-N 3.46Å; K330-T333 PolarHBondContact O-N 2.87Å; K330-T333 PolarHBondContact O-OG1 2.91Å; K330-Y334 PolarHBondContact O-N 3.41Å
331L94.9Very high93.9Very high12 Ų1277.6 Ų77.66%0.06342%0.417CS..Hα-helixtrans-68.8-38.7176.2-174.156.5000111.5F303 V319 V326 C328 T333 Y334 A346 T348F303-L331 HydrophobicContact CD1-CB 4.01Å; F303-L331 HydrophobicContact CD2-CD1 4.46Å; F303-L331 HydrophobicContact CD2-CD2 4.44Å; F303-L331 HydrophobicContact CE1-CB 3.93Å; F303-L331 HydrophobicContact CE2-CD1 3.96Å; F303-L331 HydrophobicContact CG-CB 4.39Å; F303-L331 HydrophobicContact CZ-CB 4.24Å; F303-L331 HydrophobicContact CZ-CD1 4Å; V319-L331 HydrophobicContact CG1-CD2 4.32Å; V326-L331 HydrophobicContact CG1-CB 3.89Å; V326-L331 HydrophobicContact CG1-CD2 3.83Å; V326-L331 HydrophobicContact CG1-CG 3.87Å; V326-L331 HydrophobicContact CG2-CD2 4.37Å; C328-L331 HydrophobicContact CB-CB 4.04Å; C328-L331 PolarHBondContact O-N 3.35Å; L331-T333 PolarHBondContact O-N 3.2Å; L331-Y334 VanDerWaalsContact O-CB 3.28Å; L331-Y334 WeakPolarHBondContact O-CB 3.5Å; L331-Y334 PolarHBondContact O-N 2.92Å; L331-A346 HydrophobicContact CG-CB 4.26Å; L331-A346 WeakPolarHBondContact O-CB 3.36Å; L331-T348 HydrophobicContact CD1-CG2 4.14Å
332R95.7Very high94.1Very high86 Ų8678 Ų7833%0.32542%0.423SS..Hα-helixtrans-58.9-32.2174.3-70.9176.675.281.36.7113.3V326 C328 P329 Y334 S342 G343 D344V326-R332 HydrophobicContact CB-CG 4.2Å; V326-R332 HydrophobicContact CG1-CG 3.86Å; V326-R332 WeakPolarHBondContact O-CD 3.4Å; V326-R332 PolarHBondContact O-NH1 2.99Å; C328-R332 VanDerWaalsContact O-CG 3.26Å; C328-R332 WeakPolarHBondContact O-CG 3.44Å; C328-R332 PolarHBondContact O-N 2.91Å; P329-R332 PolarHBondContact O-N 3.36Å; R332-Y334 VanDerWaalsContact C-N 3.33Å; R332-S342 PolarHBondContact O-OG 3.11Å; R332-G343 WeakPolarHBondContact O-CA 3.31Å; R332-G343 PolarHBondContact O-N 3.16Å; R332-D344 IonicContact CZ-OD1 2.69Å; R332-D344 IonicContact NH1-OD1 2.6Å; R332-D344 PolarHBondContact NH1-OD1 3.49Å; R332-D344 IonicContact NH2-OD1 2.83Å; R332-D344 PolarHBondContact NH2-OD1 3.43Å
333T93.6Very high94.3Very high111 Ų11171.4 Ų71.468%0.68139%0.391SS*.THydrogen-bonded Turntrans-79.6-11175.247.10000114.4P329 K330 L331P329-T333 PolarHBondContact O-N 3.26Å; P329-T333 PolarHBondContact O-OG1 3.47Å; K330-T333 PolarHBondContact O-N 2.87Å; K330-T333 PolarHBondContact O-OG1 2.91Å; L331-T333 PolarHBondContact O-N 3.2Å
334Y95.1Very high94.6Very high86 Ų8667.8 Ų67.834%0.33738%0.38SS..  trans-72.9145.7173-171.5-104.4000110.6K330 L331 R332 C336 P337 S342 H347 T348K330-Y334 PolarHBondContact O-N 3.41Å; L331-Y334 VanDerWaalsContact O-CB 3.28Å; L331-Y334 WeakPolarHBondContact O-CB 3.5Å; L331-Y334 PolarHBondContact O-N 2.92Å; R332-Y334 VanDerWaalsContact C-N 3.33Å; Y334-C336 HydrophobicContact CE1-CB 4.44Å; Y334-P337 VanDerWaalsContact OH-CD 3.26Å; Y334-P337 WeakPolarHBondContact OH-CD 3.45Å; Y334-S342 WeakPolarHBondContact O-CA 3.45Å; Y334-S342 VanDerWaalsContact O-CB 3.28Å; Y334-S342 WeakPolarHBondContact O-CB 3.46Å; Y334-S342 PolarHBondContact O-OG 3.5Å; Y334-H347 WeakPolarHBondContact CD1-O 3.48Å; Y334-H347 WeakPolarHBondContact CE1-O 3.38Å; Y334-T348 HydrophobicContact CE1-CG2 4.5Å
335V95.6Very high94.8Very high84 Ų8465.8 Ų65.851%0.50938%0.375SS..  trans-121.1116.2173.3-177.70000106.6P337 A341V335-P337 WeakPolarHBondContact O-CD 3.47Å; V335-A341 WeakPolarHBondContact CA-O 3.38Å
336C97.3Very high94.9Very high3 Ų360.2 Ų60.22%0.0235%0.354CS..  trans-62.2121.9-178.7175.90000110.3Y334 I338 C339 G340 A341 H347Y334-C336 HydrophobicContact CE1-CB 4.44Å; C336-I338 PolarHBondContact O-N 2.96Å; C336-C339 PolarHBondContact O-N 3.4Å; C336-C339 VanDerWaalsContact SG-SG 3.61Å; C336-G340 VanDerWaalsContact O-CA 3.32Å; C336-G340 WeakPolarHBondContact O-CA 3.33Å; C336-G340 PolarHBondContact O-N 3.34Å; C336-A341 HydrophobicContact CB-CB 4.5Å; C336-A341 PolarHBondContact N-O 3.21Å; C336-H347 PolarHBondContact SG-NE2 3.42Å; C336-H347 VanDerWaalsContact SG-NE2 3.43Å
337P95.7Very high94.8Very high105 Ų10563.5 Ų63.568%0.68237%0.369SS*.THydrogen-bonded Turntrans-70-13.4-176.828.3-35.5000113.5Y334 V335Y334-P337 VanDerWaalsContact OH-CD 3.26Å; Y334-P337 WeakPolarHBondContact OH-CD 3.45Å; V335-P337 WeakPolarHBondContact O-CD 3.47Å
338I96.6Very high94.6Very high155 Ų15565.5 Ų65.580%0.79539%0.385SS*.THydrogen-bonded Turntrans-89.5-37.2-179.1-57.2171.6000111.6C336C336-I338 PolarHBondContact O-N 2.96Å
339C96.8Very high94.6Very high79 Ų7968.8 Ų68.853%0.53440%0.404SS..THydrogen-bonded Turntrans-131.6-3.7-172.271.20000115.9C336 A341 H347C336-C339 PolarHBondContact O-N 3.4Å; C336-C339 VanDerWaalsContact SG-SG 3.61Å; C339-A341 PolarHBondContact O-N 3.03Å; C339-A341 VanDerWaalsContact SG-CB 3.53Å; C339-H347 PolarHBondContact SG-CE1 3.46Å; C339-H347 PolarHBondContact SG-NE2 3Å
340G93.4Very high94.7Very high51 Ų5168.6 Ų68.653%0.52640%0.401SS..  trans73.52.7-178.900000115.7C336C336-G340 VanDerWaalsContact O-CA 3.32Å; C336-G340 WeakPolarHBondContact O-CA 3.33Å; C336-G340 PolarHBondContact O-N 3.34Å
341A95.2Very high94.7Very high21 Ų2167.1 Ų67.117%0.17440%0.4CS..  trans-64.1139.7179.700000112.3V335 C336 C339V335-A341 WeakPolarHBondContact CA-O 3.38Å; C336-A341 HydrophobicContact CB-CB 4.5Å; C336-A341 PolarHBondContact N-O 3.21Å; C339-A341 PolarHBondContact O-N 3.03Å; C339-A341 VanDerWaalsContact SG-CB 3.53Å
342S94.9Very high94.7Very high44 Ų4470.4 Ų70.431%0.30842%0.42SS..  trans-158.3174.2-176-166.80000110.5R332 Y334 D344 S345R332-S342 PolarHBondContact O-OG 3.11Å; Y334-S342 WeakPolarHBondContact O-CA 3.45Å; Y334-S342 VanDerWaalsContact O-CB 3.28Å; Y334-S342 WeakPolarHBondContact O-CB 3.46Å; Y334-S342 PolarHBondContact O-OG 3.5Å; S342-D344 PolarHBondContact O-N 3.44Å; S342-S345 PolarHBondContact O-OG 2.95Å
343G93.9Very high94.7Very high18 Ų1869.4 Ų69.419%0.18643%0.426CS..G310 helixtrans62.7-123.9-179.200000112.8R332 S345 A346R332-G343 WeakPolarHBondContact O-CA 3.31Å; R332-G343 PolarHBondContact O-N 3.16Å; G343-S345 PolarHBondContact O-N 3.23Å; G343-A346 WeakPolarHBondContact O-CB 3.31Å; G343-A346 PolarHBondContact O-N 2.74Å
344D94.3Very high94.7Very high84 Ų8466.6 Ų66.645%0.44941%0.409SS..G310 helixtrans-61.7-27.8-175.4-66.1-28.8000113.9R325 V326 R332 S342R325-D344 HydrophobicContact CB-CB 4.43Å; R325-D344 HydrophobicContact CG-CB 4.46Å; V326-D344 PolarHBondContact N-O 3.1Å; R332-D344 IonicContact CZ-OD1 2.69Å; R332-D344 IonicContact NH1-OD1 2.6Å; R332-D344 PolarHBondContact NH1-OD1 3.49Å; R332-D344 IonicContact NH2-OD1 2.83Å; R332-D344 PolarHBondContact NH2-OD1 3.43Å; S342-D344 PolarHBondContact O-N 3.44Å
345S92.9Very high94.7Very high76 Ų7665.2 Ų65.253%0.53141%0.414SS..G310 helixtrans-108.212.1-177.358.80000113.9S342 G343 H347S342-S345 PolarHBondContact O-OG 2.95Å; G343-S345 PolarHBondContact O-N 3.23Å; S345-H347 PolarHBondContact O-ND1 2.92Å; S345-H347 VanDerWaalsContact O-ND1 3.11Å
346A94.3Very high94.6Very high1 Ų163.8 Ų63.81%0.00841%0.406CS..  trans-59.5143.4-178.200000113V326 L331 G343V326-A346 HydrophobicContact CG2-CB 4.39Å; V326-A346 VanDerWaalsContact CG2-O 3.25Å; V326-A346 WeakPolarHBondContact CG2-O 3.41Å; L331-A346 HydrophobicContact CG-CB 4.26Å; L331-A346 WeakPolarHBondContact O-CB 3.36Å; G343-A346 WeakPolarHBondContact O-CB 3.31Å; G343-A346 PolarHBondContact O-N 2.74Å
347H93.3Very high94.4Very high71 Ų7168.8 Ų68.833%0.32944%0.439SS..  trans-156.3150.1174.554.5-87000108.8Y334 C336 C339 S345Y334-H347 WeakPolarHBondContact CD1-O 3.48Å; Y334-H347 WeakPolarHBondContact CE1-O 3.38Å; C336-H347 PolarHBondContact SG-NE2 3.42Å; C336-H347 VanDerWaalsContact SG-NE2 3.43Å; C339-H347 PolarHBondContact SG-CE1 3.46Å; C339-H347 PolarHBondContact SG-NE2 3Å; S345-H347 PolarHBondContact O-ND1 2.92Å; S345-H347 VanDerWaalsContact O-ND1 3.11Å
348T91.8Very high94.3Very high121 Ų12165.5 Ų65.574%0.74242%0.416SS*.  trans-77.80165.952.30000110F303 L331 Y334F303-T348 HydrophobicContact CE2-CG2 3.85Å; F303-T348 HydrophobicContact CZ-CG2 4.4Å; L331-T348 HydrophobicContact CD1-CG2 4.14Å; Y334-T348 HydrophobicContact CE1-CG2 4.5Å

Retrieved 348 of 348 residues in 182.7 ms (Link to these results)