A0A087YJF6_POEFO Loading...

Achaete-scute family bHLH transcription factor 1a

AlphaFold DB , UniProt , Accession A0A087YJF6, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 179 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
1M42.8Very low46Very low243 Ų243156.9 Ų156.9100%1.19783%0.833SS**  088.80-72.7178.4-178.100106.3
2D36.4Very low45.9Very low140 Ų140152 Ų15275%0.74982%0.821SS**  trans-63.1161.9172.8-66.2-81.5000112.7
3I45.4Very low45.6Very low164 Ų164153.9 Ų153.984%0.84182%0.821SS**  trans173.793.8135.4-76.7143.5000104
4T43.9Very low45.5Very low121 Ų121155.7 Ų155.774%0.74282%0.822SS**  55.3107.476.4-55.30000114.9
5A49.6Very low45.3Very low103 Ų103156.9 Ų156.985%0.85182%0.822SS**  trans-160.590.9140.500000110
6K52.2Low45.3Very low191 Ų191156.4 Ų156.483%0.8382%0.819SS**  trans-78.5126161.3-75.4-98.1179.51710107.4E8K6-E8 VanDerWaalsContact C-N 3.34Å; K6-E8 PolarHBondContact O-N 3.21Å; K6-E8 VanDerWaalsContact O-N 3.14Å
7M50.2Low46.2Very low182 Ų182154.3 Ų154.390%0.89781%0.814SS**  trans-82.684.4172.2-159.9169.2173.400107.7
8E46.6Very low46.6Very low173 Ų173152.7 Ų152.781%0.80881%0.814SS**  trans-80.7114.9168.2-75.1-11114000108.4K6 N10K6-E8 VanDerWaalsContact C-N 3.34Å; K6-E8 PolarHBondContact O-N 3.21Å; K6-E8 VanDerWaalsContact O-N 3.14Å; E8-N10 PolarHBondContact O-N 3.16Å
9I51.3Low46.5Very low141 Ų141149.9 Ų149.972%0.72381%0.814SS**  trans-85.7101.4170.9-65.5175.5000107.2V11I9-V11 HydrophobicContact CG2-CG2 4.18Å; I9-V11 PolarHBondContact O-N 3.37Å
10N40.5Very low46.4Very low139 Ų139146.2 Ų146.274%0.74381%0.805SS**  trans-78.8101172.4-170.9-33.9000109E8E8-N10 PolarHBondContact O-N 3.16Å
11V47.1Very low45.6Very low129 Ų129145.3 Ų145.378%0.78281%0.807SS**  trans-90.6115.5165.4175.90000107.7I9I9-V11 HydrophobicContact CG2-CG2 4.18Å; I9-V11 PolarHBondContact O-N 3.37Å
12S44.2Very low45.3Very low98 Ų98144.3 Ų144.369%0.68579%0.792SS**  trans-54.5138.5-178.7-73.10000113.5Q14S12-Q14 PolarHBondContact O-N 3.25Å
13Q42.8Very low45.3Very low177 Ų177146 Ų14683%0.82779%0.793SS**  trans-42.4125.6154.6-92.6173.430.800111.9
14Q44.6Very low44.8Very low179 Ų179143.9 Ų143.984%0.83679%0.793SS**  trans-129103.6145.1-102.3174.537.800108.3S12 L16S12-Q14 PolarHBondContact O-N 3.25Å; Q14-L16 PolarHBondContact O-N 3.3Å
15Q41.8Very low44.5Very low174 Ų174145 Ų14581%0.81379%0.79SS**  trans-80.9106.4169-173.2162.914.600107.4
16L44.6Very low44.1Very low148 Ų148145.7 Ų145.778%0.77579%0.788SS**PPolyproline II helixtrans-103122.8169-102.6138.1000108.8Q14Q14-L16 PolarHBondContact O-N 3.3Å
17V60.6Low43.8Very low121 Ų121144.8 Ų144.873%0.73378%0.784SS**PPolyproline II helixtrans-53.8151.1-174.9-68.20000114.6
18P53.8Low43.1Very low125 Ų125144.8 Ų144.881%0.81278%0.782SS**PPolyproline II helixtrans-72.4134.9171.628.8-31.4000111.1A20P18-A20 PolarHBondContact O-N 2.97Å
19A46Very low42.8Very low100 Ų100141.7 Ų141.783%0.82678%0.777SS**PPolyproline II helixtrans-61.2124.3173.500000110.5
20A43Very low42.5Very low75 Ų75145 Ų14562%0.6279%0.786SS**PPolyproline II helixtrans-60.4136.2176.600000111.6P18 Y22P18-A20 PolarHBondContact O-N 2.97Å; A20-Y22 PolarHBondContact O-N 3.17Å
21C31.2Very low42.5Very low128 Ų128149.4 Ų149.487%0.86579%0.792SS**  trans-62.2109.4170.7-39.60000109
22Y35.4Very low42.5Very low222 Ų222152.2 Ų152.287%0.87180%0.797SS**  trans-81.2120.4167.3-81.2-86.4000109.9A20A20-Y22 PolarHBondContact O-N 3.17Å
23F36.1Very low42.3Very low175 Ų175158.2 Ų158.277%0.76881%0.805SS**  trans-50138.5168-106.3-111.4000111.5E25F23-E25 HydrophobicContact CD1-CB 4.46Å
24S36.3Very low42.4Very low120 Ų120154.8 Ų154.884%0.83980%0.8SS**  trans-139.1101.1148.1-76.70000108.2S26S24-S26 PolarHBondContact O-N 3.33Å
25E36.2Very low43Very low145 Ų145152.4 Ų152.468%0.67880%0.803SS**  trans-73.6112178-171.5168.5160.500109.2F23F23-E25 HydrophobicContact CD1-CB 4.46Å
26S40.9Very low43.2Very low117 Ų117149 Ų14982%0.81880%0.799SS**  trans-100.2103.8165.548.30000108.9S24S24-S26 PolarHBondContact O-N 3.33Å
27K46.3Very low43.7Very low173 Ų173147.5 Ų147.575%0.75280%0.797SS**  trans-67.3122.6167.9-74177.1176.9177.70109.7
28Q35.8Very low43.6Very low181 Ų181150 Ų15085%0.84680%0.801SS**  trans-149.4154.2154.9-78.8-54.1-57.300110.1
29P40.8Very low43.5Very low108 Ų108151.6 Ų151.670%0.70180%0.802SS**  trans-94.1160.2-135.535.1-36.7000116.3R31P29-R31 PolarHBondContact O-N 2.86Å
30K45Very low43.9Very low210 Ų210154.9 Ų154.991%0.91381%0.805SS**  trans-51.1112.6168.2-70.8173.4174.9175.50111.5
31R39.6Very low44.3Very low233 Ų233161.2 Ų161.288%0.87981%0.813SS**  trans-108.699.2151.3-81.3-177.890.1178.86.6108.7P29P29-R31 PolarHBondContact O-N 2.86Å
32Q46.6Very low45.2Very low187 Ų187161.5 Ų161.587%0.87482%0.815SS**  trans-66.1127.1154.1-81.5179.5-30.500108
33R41.5Very low46.2Very low225 Ų225157.9 Ų157.985%0.84980%0.803SS**  trans-160.5123.8145.3-114.6173-170.2-139.11.5113.4
34S45.3Very low47.1Very low104 Ų104160.2 Ų160.273%0.72781%0.807SS**  trans61.9103.1152.357.80000119.3S36S34-S36 PolarHBondContact O-N 3.47Å
35S56Low48.3Very low130 Ų130164.7 Ų164.791%0.90981%0.806SS**  trans-48.7117.4149.154.80000110.4
36S46.3Very low49.6Very low103 Ų103163.8 Ų163.872%0.7281%0.805SS**  trans-117.3136.1167.5-175.40000107.3S34 E38S34-S36 PolarHBondContact O-N 3.47Å; S36-E38 PolarHBondContact O-N 2.95Å
37P54.2Low50.5Low115 Ų115164.6 Ų164.675%0.74780%0.8SS**  trans-64.2128.7-162.824.2-33.1000112.2L39P37-L39 PolarHBondContact O-N 2.85Å
38E58.3Low51Low174 Ų174162.1 Ų162.181%0.81379%0.789SS**SBendtrans-73.519.7-171.1-145.7-169.1-175.300114.6S36S36-E38 PolarHBondContact O-N 2.95Å
39L51.8Low52Low158 Ų158157.6 Ų157.683%0.82778%0.783SS**THydrogen-bonded Turntrans-101.722.3-170.1-64.2-171.6000115.4P37P37-L39 PolarHBondContact O-N 2.85Å
40L55.4Low52.9Low170 Ų170155.6 Ų155.689%0.8978%0.782SS**THydrogen-bonded Turntrans-134.714.7169.4-69.4173.7000113.8C42L40-C42 PolarHBondContact O-N 3.34Å
41R51.2Low53.7Low208 Ų208153.1 Ų153.179%0.78577%0.771SS**  trans-93.475.8169.3-144.9176-164.1133.92108.9K43R41-K43 PolarHBondContact O-N 3.12Å
42C49.3Very low54.5Low133 Ų133145.7 Ų145.790%0.89977%0.767SS**  trans-63.977165.1-710000109.5L40L40-C42 PolarHBondContact O-N 3.34Å
43K57.8Low55.1Low147 Ų147145.5 Ų145.564%0.63976%0.76SS**  trans-127.167.4166.7-161.3107.383.6169.70107.6R41 R45R41-K43 PolarHBondContact O-N 3.12Å; K43-R45 VanDerWaalsContact C-N 3.27Å; K43-R45 PolarHBondContact O-N 3.03Å
44R55.1Low56Low223 Ų223141.4 Ų141.484%0.84276%0.76SS**  trans-60.297.8161.7-165.9176.2-67.5164.8-0106.1L46R44-L46 VanDerWaalsContact C-N 3.26Å; R44-L46 HydrophobicContact CG-CD2 4.17Å; R44-L46 PolarHBondContact O-N 3.23Å
45R60.9Low56.6Low215 Ų215141.2 Ų141.281%0.81175%0.75SS**  trans-62.197.3163.2-76.8-113.7-174-107.85.6105.2K43 N47K43-R45 VanDerWaalsContact C-N 3.27Å; K43-R45 PolarHBondContact O-N 3.03Å; R45-N47 PolarHBondContact O-N 2.75Å
46L63.2Low56.8Low125 Ų125140.4 Ų140.465%0.65474%0.742SS**  trans-61.7111.2171.4-67.9175.8000107.1R44 F48R44-L46 VanDerWaalsContact C-N 3.26Å; R44-L46 HydrophobicContact CG-CD2 4.17Å; R44-L46 PolarHBondContact O-N 3.23Å; L46-F48 HydrophobicContact CB-CD2 4.29Å; L46-F48 HydrophobicContact CB-CE2 4.34Å; L46-F48 PolarHBondContact O-N 3.39Å
47N59Low57.6Low135 Ų135143.9 Ų143.972%0.72275%0.747SS**  trans-8194.4173.8-153.844000107.2R45 A49R45-N47 PolarHBondContact O-N 2.75Å; N47-A49 PolarHBondContact O-N 3.48Å
48F56.8Low58.1Low121 Ų121146.6 Ų146.653%0.53175%0.749SS.*G310 helixtrans-66.9-11.4179.5-100.2-93.8000113.5L46 G50 L55L46-F48 HydrophobicContact CB-CD2 4.29Å; L46-F48 HydrophobicContact CB-CE2 4.34Å; L46-F48 PolarHBondContact O-N 3.39Å; F48-G50 PolarHBondContact O-N 3.42Å; F48-G50 VanDerWaalsContact O-N 3.15Å; F48-L55 HydrophobicContact CD1-CD1 4.17Å; F48-L55 HydrophobicContact CD1-CD2 4.31Å; F48-L55 HydrophobicContact CE1-CD1 4.31Å; F48-L55 HydrophobicContact CE1-CD2 4.23Å
49A58.4Low58.5Low85 Ų85143.9 Ų143.970%0.70274%0.736SS**G310 helixtrans-65.9-13-17800000114.7N47N47-A49 PolarHBondContact O-N 3.48Å
50G60Low60.1Low66 Ų66140.1 Ų140.168%0.6872%0.722SS**G310 helixtrans-82.7-8.2-178.100000115.9F48F48-G50 PolarHBondContact O-N 3.42Å; F48-G50 VanDerWaalsContact O-N 3.15Å
51F61.5Low61.4Low159 Ų159139.4 Ų139.470%0.69771%0.713SS**G310 helixtrans-106.510.2-170.9-76.3-77000115Y53F51-Y53 HydrophobicContact CB-CD2 4.28Å; F51-Y53 WeakPolarHBondContact O-CD2 3.25Å; F51-Y53 WeakPolarHBondContact O-CE2 3.34Å; F51-Y53 PolarHBondContact O-N 2.95Å
52G56.5Low63.1Low76 Ų76132.6 Ų132.678%0.78470%0.702SS**SBendtrans67.4-7.117500000115.6
53Y58.3Low65.1Low184 Ų184128.8 Ų128.872%0.72267%0.674SS**  trans-92104.7169.6-57.3-76.5000108.5F51 L55F51-Y53 HydrophobicContact CB-CD2 4.28Å; F51-Y53 WeakPolarHBondContact O-CD2 3.25Å; F51-Y53 WeakPolarHBondContact O-CE2 3.34Å; F51-Y53 PolarHBondContact O-N 2.95Å; Y53-L55 PolarHBondContact O-N 3.42Å
54T60.7Low66.7Low139 Ų139124.1 Ų124.185%0.85366%0.663SS**  trans-63.991.5162.953.40000107.6
55L58.1Low68.5Low100 Ų100121.5 Ų121.552%0.52465%0.653SS.*  trans-59127.3169.5-113.775.6000107F48 Y53 Q57F48-L55 HydrophobicContact CD1-CD1 4.17Å; F48-L55 HydrophobicContact CD1-CD2 4.31Å; F48-L55 HydrophobicContact CE1-CD1 4.31Å; F48-L55 HydrophobicContact CE1-CD2 4.23Å; Y53-L55 PolarHBondContact O-N 3.42Å; L55-Q57 PolarHBondContact O-N 2.95Å
56P60Low70.2Confident113 Ų113120.7 Ų120.773%0.73465%0.65SS**  trans-55.6119174.322.1-30.1000106.8Q58P56-Q58 PolarHBondContact O-N 3.46Å
57Q63Low71.8Confident176 Ų176118.4 Ų118.482%0.82264%0.639SS**  trans-51.5101.2-177.1-174.717934.200108.1L55 Q59L55-Q57 PolarHBondContact O-N 2.95Å; Q57-Q59 PolarHBondContact O-N 3.42Å
58Q63.8Low73.6Confident172 Ų172116.5 Ų116.580%0.80463%0.625SS**  trans-61.8113.9-179.5-80.4-173-16.700107.1P56P56-Q58 PolarHBondContact O-N 3.46Å
59Q68.4Low75.6Confident116 Ų116118.6 Ų118.654%0.54263%0.63SS.*  trans-54.7136.3177.8-68.6-7623.600108.3Q57 H61 V63Q57-Q59 PolarHBondContact O-N 3.42Å; Q59-H61 PolarHBondContact O-N 3.38Å; Q59-V63 HydrophobicContact CB-CB 4.48Å; Q59-V63 HydrophobicContact CB-CG1 4.4Å
60P84.8Confident77.5Confident80 Ų80118.7 Ų118.752%0.51962%0.616SS.*  trans-50.4135.8178.8-25.532.8000110.6A62 V63 A64P60-A62 PolarHBondContact O-N 3.49Å; P60-V63 HydrophobicContact CB-CG2 4.21Å; P60-V63 HydrophobicContact CG-CG2 4.29Å; P60-V63 WeakPolarHBondContact O-CA 3.43Å; P60-V63 WeakPolarHBondContact O-CB 3.28Å; P60-V63 PolarHBondContact O-N 2.96Å; P60-A64 PolarHBondContact O-N 2.9Å; P60-A64 VanDerWaalsContact O-N 3.16Å
61H83.3Confident79.3Confident154 Ų154124.1 Ų124.171%0.71362%0.615SS**Hα-helixtrans-49.5-33-174.1-71.3-83.7000114.2Q59 A64 R65Q59-H61 PolarHBondContact O-N 3.38Å; H61-A64 PolarHBondContact O-N 3.37Å; H61-R65 WeakPolarHBondContact O-CG 3.05Å; H61-R65 PolarHBondContact O-N 2.8Å
62A86.9Confident81.1Confident66 Ų66120.6 Ų120.655%0.54560%0.604SS.*Hα-helixtrans-63.3-41.1174.300000113.1P60 R66P60-A62 PolarHBondContact O-N 3.49Å; A62-R66 PolarHBondContact O-N 3.4Å
63V90Very high83.1Confident53 Ų53123.3 Ų123.332%0.32159%0.591SS.*Hα-helixtrans-66.7-42.3175.91790000110.3Q59 P60 R65 R66 N67Q59-V63 HydrophobicContact CB-CB 4.48Å; Q59-V63 HydrophobicContact CB-CG1 4.4Å; P60-V63 HydrophobicContact CB-CG2 4.21Å; P60-V63 HydrophobicContact CG-CG2 4.29Å; P60-V63 WeakPolarHBondContact O-CA 3.43Å; P60-V63 WeakPolarHBondContact O-CB 3.28Å; P60-V63 PolarHBondContact O-N 2.96Å; V63-R65 PolarHBondContact O-N 3.2Å; V63-R66 PolarHBondContact O-N 2.86Å; V63-N67 WeakPolarHBondContact O-CB 3.37Å; V63-N67 VanDerWaalsContact O-CG 3.27Å; V63-N67 PolarHBondContact O-N 3.46Å; V63-N67 PolarHBondContact O-OD1 2.85Å
64A91.4Very high85Confident49 Ų49117 Ų11741%0.40557%0.571SS.*Hα-helixtrans-59-47.7176.200000111.9P60 H61 R66 N67 E68P60-A64 PolarHBondContact O-N 2.9Å; P60-A64 VanDerWaalsContact O-N 3.16Å; H61-A64 PolarHBondContact O-N 3.37Å; A64-R66 VanDerWaalsContact C-N 3.34Å; A64-R66 PolarHBondContact O-N 3Å; A64-N67 PolarHBondContact O-N 2.97Å; A64-E68 PolarHBondContact O-N 3.46Å
65R93.9Very high86.8Confident167 Ų167116.6 Ų116.663%0.6356%0.557SS**Hα-helixtrans-61.8-39.8175.5-70.8-165.4-60-132.83.8112.8H61 V63 E68 R69H61-R65 WeakPolarHBondContact O-CG 3.05Å; H61-R65 PolarHBondContact O-N 2.8Å; V63-R65 PolarHBondContact O-N 3.2Å; R65-E68 PolarHBondContact O-N 3.22Å; R65-R69 WeakPolarHBondContact O-CG 3.22Å; R65-R69 PolarHBondContact O-N 3.35Å
66R95.9Very high88.7Confident199 Ų199118 Ų11875%0.75157%0.565SS**Hα-helixtrans-63.3-45176.4-178.8-179.1173.6135.30.8111.5A62 V63 A64 E68 R69 E70A62-R66 PolarHBondContact O-N 3.4Å; V63-R66 PolarHBondContact O-N 2.86Å; A64-R66 VanDerWaalsContact C-N 3.34Å; A64-R66 PolarHBondContact O-N 3Å; R66-E68 VanDerWaalsContact C-N 3.32Å; R66-E68 PolarHBondContact O-N 3.36Å; R66-R69 PolarHBondContact O-N 3.43Å; R66-E70 PolarHBondContact O-N 2.95Å; R66-E70 VanDerWaalsContact O-N 3.15Å
67N97.5Very high90.6Very high77 Ų77115.5 Ų115.541%0.41255%0.547SS..Hα-helixtrans-65-38.4-179.8-71.1-2.8000111.8V63 A64 E70 R71V63-N67 WeakPolarHBondContact O-CB 3.37Å; V63-N67 VanDerWaalsContact O-CG 3.27Å; V63-N67 PolarHBondContact O-N 3.46Å; V63-N67 PolarHBondContact O-OD1 2.85Å; A64-N67 PolarHBondContact O-N 2.97Å; N67-E70 PolarHBondContact O-N 3.33Å; N67-R71 WeakPolarHBondContact O-CG 3.41Å; N67-R71 PolarHBondContact O-N 2.97Å
68E97.1Very high92.2Very high94 Ų94110.3 Ų110.344%0.43953%0.525SS..Hα-helixtrans-63.2-43.4176.9-170.954.2-146.700111.9A64 R65 R66 E70 R71 N72A64-E68 PolarHBondContact O-N 3.46Å; R65-E68 PolarHBondContact O-N 3.22Å; R66-E68 VanDerWaalsContact C-N 3.32Å; R66-E68 PolarHBondContact O-N 3.36Å; E68-E70 VanDerWaalsContact C-N 3.3Å; E68-E70 PolarHBondContact O-N 3.43Å; E68-R71 WeakPolarHBondContact O-CB 3.5Å; E68-R71 PolarHBondContact O-N 3.26Å; E68-N72 PolarHBondContact O-N 3.27Å
69R98.2Very high93.8Very high165 Ų165106.4 Ų106.462%0.62351%0.51SS*.Hα-helixtrans-58.4-43.3173.8-69.3176.8-172-171.5-0.8112.1R65 R66 N72 R73R65-R69 WeakPolarHBondContact O-CG 3.22Å; R65-R69 PolarHBondContact O-N 3.35Å; R66-R69 PolarHBondContact O-N 3.43Å; R69-N72 PolarHBondContact O-N 3.36Å; R69-R73 PolarHBondContact O-N 3.5Å
70E98.2Very high95.3Very high87 Ų87103 Ų10341%0.40751%0.506SS..Hα-helixtrans-67.2-37.3179.2-178.155.9-162.900112.1R66 N67 E68 N72 R73 V74R66-E70 PolarHBondContact O-N 2.95Å; R66-E70 VanDerWaalsContact O-N 3.15Å; N67-E70 PolarHBondContact O-N 3.33Å; E68-E70 VanDerWaalsContact C-N 3.3Å; E68-E70 PolarHBondContact O-N 3.43Å; E70-N72 VanDerWaalsContact C-N 3.35Å; E70-N72 PolarHBondContact O-N 3.08Å; E70-R73 PolarHBondContact O-N 3.06Å; E70-R73 IonicContact OE1-CZ 3.4Å; E70-R73 IonicContact OE1-NE 3.24Å; E70-R73 PolarHBondContact OE1-NE 3.39Å; E70-R73 IonicContact OE1-NH2 2.71Å; E70-R73 PolarHBondContact OE1-NH2 3.25Å; E70-R73 IonicContact OE2-CZ 3.78Å; E70-R73 IonicContact OE2-NE 2.86Å; E70-R73 PolarHBondContact OE2-NE 2.92Å; E70-R73 IonicContact OE2-NH2 3.82Å; E70-V74 HydrophobicContact CG-CG2 4.48Å; E70-V74 WeakPolarHBondContact O-CB 3.39Å; E70-V74 VanDerWaalsContact O-CG2 3.3Å; E70-V74 WeakPolarHBondContact O-CG2 3.33Å; E70-V74 PolarHBondContact O-N 3.43Å; E70-V74 WeakPolarHBondContact OE1-CG2 3.23Å
71R98.6Very high95.9Very high180 Ų180100.7 Ų100.768%0.67949%0.488SS*.Hα-helixtrans-59.5-45.7172.5-74.5-180175-159.2-1.9111.6N67 E68 V74 K75N67-R71 WeakPolarHBondContact O-CG 3.41Å; N67-R71 PolarHBondContact O-N 2.97Å; E68-R71 WeakPolarHBondContact O-CB 3.5Å; E68-R71 PolarHBondContact O-N 3.26Å; R71-V74 PolarHBondContact O-N 2.96Å; R71-K75 WeakPolarHBondContact O-CB 3.26Å; R71-K75 PolarHBondContact O-N 3.29Å
72N98.6Very high96.5Very high85 Ų8595.4 Ų95.446%0.45547%0.47SS..Hα-helixtrans-64.7-42.7178.5-71-24.5000112.3E68 R69 E70 V74 K75 L76E68-N72 PolarHBondContact O-N 3.27Å; R69-N72 PolarHBondContact O-N 3.36Å; E70-N72 VanDerWaalsContact C-N 3.35Å; E70-N72 PolarHBondContact O-N 3.08Å; N72-V74 PolarHBondContact O-N 3.46Å; N72-K75 WeakPolarHBondContact O-CB 3.42Å; N72-K75 PolarHBondContact O-N 3.43Å; N72-L76 PolarHBondContact O-N 3.07Å
73R98.6Very high97Very high133 Ų13395.7 Ų95.750%0.50247%0.466SS..Hα-helixtrans-58.6-46.8174.6-166.9-162.969.976.61.6111.6R69 E70 L76 V77R69-R73 PolarHBondContact O-N 3.5Å; E70-R73 PolarHBondContact O-N 3.06Å; E70-R73 IonicContact OE1-CZ 3.4Å; E70-R73 IonicContact OE1-NE 3.24Å; E70-R73 PolarHBondContact OE1-NE 3.39Å; E70-R73 IonicContact OE1-NH2 2.71Å; E70-R73 PolarHBondContact OE1-NH2 3.25Å; E70-R73 IonicContact OE2-CZ 3.78Å; E70-R73 IonicContact OE2-NE 2.86Å; E70-R73 PolarHBondContact OE2-NE 2.92Å; E70-R73 IonicContact OE2-NH2 3.82Å; R73-L76 PolarHBondContact O-N 3.01Å; R73-V77 WeakPolarHBondContact O-CG2 3.33Å; R73-V77 PolarHBondContact O-N 3.13Å; R73-V77 VanDerWaalsContact O-N 3.13Å
74V98.6Very high97.4Very high51 Ų5195.9 Ų95.931%0.30946%0.464SS..Hα-helixtrans-67.2-37.9178.8171.90000111.6E70 R71 N72 L76 V77 N78E70-V74 HydrophobicContact CG-CG2 4.48Å; E70-V74 WeakPolarHBondContact O-CB 3.39Å; E70-V74 VanDerWaalsContact O-CG2 3.3Å; E70-V74 WeakPolarHBondContact O-CG2 3.33Å; E70-V74 PolarHBondContact O-N 3.43Å; E70-V74 WeakPolarHBondContact OE1-CG2 3.23Å; R71-V74 PolarHBondContact O-N 2.96Å; N72-V74 PolarHBondContact O-N 3.46Å; V74-L76 VanDerWaalsContact C-N 3.33Å; V74-L76 PolarHBondContact O-N 3.47Å; V74-V77 PolarHBondContact O-N 3.42Å; V74-N78 WeakPolarHBondContact O-CB 3.14Å; V74-N78 VanDerWaalsContact O-CG 3.3Å; V74-N78 PolarHBondContact O-N 2.95Å; V74-N78 PolarHBondContact O-ND2 3.46Å
75K98.4Very high97.7Very high131 Ų13195.7 Ų95.757%0.5745%0.453SS*.Hα-helixtrans-57.4-47.2173.9-174.1-176.6178.2-172.80110.6R71 N72 V77 N78 N79R71-K75 WeakPolarHBondContact O-CB 3.26Å; R71-K75 PolarHBondContact O-N 3.29Å; N72-K75 WeakPolarHBondContact O-CB 3.42Å; N72-K75 PolarHBondContact O-N 3.43Å; K75-V77 PolarHBondContact O-N 3.39Å; K75-N78 PolarHBondContact O-N 3.36Å; K75-N79 VanDerWaalsContact O-CG 3.31Å; K75-N79 PolarHBondContact O-N 3.4Å; K75-N79 PolarHBondContact O-OD1 3.43Å
76L98.3Very high97.8Very high130 Ų13093.7 Ų93.768%0.68145%0.451SS*.Hα-helixtrans-59.9-46.2177.3-175.664.6000111.9N72 R73 V74 N78 N79 G80N72-L76 PolarHBondContact O-N 3.07Å; R73-L76 PolarHBondContact O-N 3.01Å; V74-L76 VanDerWaalsContact C-N 3.33Å; V74-L76 PolarHBondContact O-N 3.47Å; L76-N78 VanDerWaalsContact C-N 3.32Å; L76-N78 PolarHBondContact O-N 2.96Å; L76-N79 PolarHBondContact O-N 3.31Å; L76-G80 PolarHBondContact O-N 3.18Å
77V98.5Very high97.9Very high60 Ų6090.1 Ų90.136%0.36444%0.443SS..Hα-helixtrans-59.7-44176.3171.80000111.3R73 V74 K75 G80 F81R73-V77 WeakPolarHBondContact O-CG2 3.33Å; R73-V77 PolarHBondContact O-N 3.13Å; R73-V77 VanDerWaalsContact O-N 3.13Å; V74-V77 PolarHBondContact O-N 3.42Å; K75-V77 PolarHBondContact O-N 3.39Å; V77-G80 PolarHBondContact O-N 3.48Å; V77-F81 HydrophobicContact CG1-CD2 4.04Å; V77-F81 HydrophobicContact CG1-CE2 4.09Å; V77-F81 WeakPolarHBondContact O-CD2 3.32Å; V77-F81 PolarHBondContact O-N 3.2Å
78N97.8Very high97.8Very high68 Ų6887 Ų8736%0.36443%0.426SS..Hα-helixtrans-68.4-35.5-179.4-71.1-20.9000112.3V74 K75 L76 F81 A82 K99V74-N78 WeakPolarHBondContact O-CB 3.14Å; V74-N78 VanDerWaalsContact O-CG 3.3Å; V74-N78 PolarHBondContact O-N 2.95Å; V74-N78 PolarHBondContact O-ND2 3.46Å; K75-N78 PolarHBondContact O-N 3.36Å; L76-N78 VanDerWaalsContact C-N 3.32Å; L76-N78 PolarHBondContact O-N 2.96Å; N78-F81 PolarHBondContact O-N 3.33Å; N78-A82 PolarHBondContact O-N 2.85Å; N78-K99 PolarHBondContact OD1-NZ 3.42Å
79N97.9Very high97.8Very high89 Ų8985 Ų8548%0.47642%0.421SS..Hα-helixtrans-62.5-45.2171.6-71.3-0.1000110.8K75 L76 F81 A82 T83K75-N79 VanDerWaalsContact O-CG 3.31Å; K75-N79 PolarHBondContact O-N 3.4Å; K75-N79 PolarHBondContact O-OD1 3.43Å; L76-N79 PolarHBondContact O-N 3.31Å; N79-F81 VanDerWaalsContact C-N 3.29Å; N79-F81 PolarHBondContact O-N 2.97Å; N79-A82 WeakPolarHBondContact O-CA 3.47Å; N79-A82 WeakPolarHBondContact O-CB 3.33Å; N79-A82 PolarHBondContact O-N 3.5Å; N79-T83 PolarHBondContact O-N 3.38Å; N79-T83 PolarHBondContact O-OG1 3.06Å
80G97.9Very high97.4Very high44 Ų4483.4 Ų83.445%0.45443%0.425SS..Hα-helixtrans-57.9-39.6174.500000113.1L76 V77 A82 L84L76-G80 PolarHBondContact O-N 3.18Å; V77-G80 PolarHBondContact O-N 3.48Å; G80-A82 VanDerWaalsContact C-N 3.34Å; G80-A82 PolarHBondContact O-N 2.75Å; G80-L84 WeakPolarHBondContact O-CB 3.4Å; G80-L84 PolarHBondContact O-N 3.12Å
81F97.9Very high97Very high33 Ų3379.4 Ų79.415%0.14541%0.407CS..Hα-helixtrans-65.6-33.4172.1-91.9-79.6000113.3V77 N78 N79 R85 K99 T102 L103V77-F81 HydrophobicContact CG1-CD2 4.04Å; V77-F81 HydrophobicContact CG1-CE2 4.09Å; V77-F81 WeakPolarHBondContact O-CD2 3.32Å; V77-F81 PolarHBondContact O-N 3.2Å; N78-F81 PolarHBondContact O-N 3.33Å; N79-F81 VanDerWaalsContact C-N 3.29Å; N79-F81 PolarHBondContact O-N 2.97Å; F81-R85 WeakPolarHBondContact O-CG 3.28Å; F81-R85 PolarHBondContact O-N 3.41Å; F81-R85 VanDerWaalsContact O-N 3.16Å; F81-R85 PolarHBondContact O-NH1 3.21Å; F81-K99 HydrophobicContact CD1-CB 4.26Å; F81-K99 HydrophobicContact CD1-CG 3.97Å; F81-K99 HydrophobicContact CD2-CD 4.23Å; F81-K99 HydrophobicContact CD2-CG 4.3Å; F81-K99 HydrophobicContact CE1-CB 3.65Å; F81-K99 HydrophobicContact CE1-CD 4.42Å; F81-K99 HydrophobicContact CE1-CG 3.77Å; F81-K99 HydrophobicContact CE2-CD 3.89Å; F81-K99 HydrophobicContact CE2-CG 4.12Å; F81-K99 HydrophobicContact CG-CG 4.24Å; F81-K99 HydrophobicContact CZ-CB 3.82Å; F81-K99 HydrophobicContact CZ-CD 3.99Å; F81-K99 HydrophobicContact CZ-CG 3.85Å; F81-T102 HydrophobicContact CD1-CG2 4.26Å; F81-L103 HydrophobicContact CE1-CD1 4.42Å; F81-L103 HydrophobicContact CE1-CD2 4.1Å; F81-L103 HydrophobicContact CE1-CG 3.98Å; F81-L103 HydrophobicContact CZ-CD1 4.23Å; F81-L103 HydrophobicContact CZ-CD2 4.26Å; F81-L103 HydrophobicContact CZ-CG 4.24Å
82A96.8Very high96.5Very high42 Ų4274.5 Ų74.535%0.34741%0.405SS..Hα-helixtrans-67.6-49.217600000110.9N78 N79 G80 L84 R85 E86N78-A82 PolarHBondContact O-N 2.85Å; N79-A82 WeakPolarHBondContact O-CA 3.47Å; N79-A82 WeakPolarHBondContact O-CB 3.33Å; N79-A82 PolarHBondContact O-N 3.5Å; G80-A82 VanDerWaalsContact C-N 3.34Å; G80-A82 PolarHBondContact O-N 2.75Å; A82-L84 VanDerWaalsContact C-N 3.3Å; A82-L84 PolarHBondContact O-N 3.44Å; A82-R85 WeakPolarHBondContact O-CB 3.31Å; A82-R85 PolarHBondContact O-N 3.25Å; A82-E86 PolarHBondContact O-N 3.43Å
83T97.3Very high96Very high73 Ų7375.1 Ų75.145%0.44842%0.422SS..Hα-helixtrans-59.1-41.5175-540000111.7N79 R85 E86 H87N79-T83 PolarHBondContact O-N 3.38Å; N79-T83 PolarHBondContact O-OG1 3.06Å; T83-R85 VanDerWaalsContact C-N 3.28Å; T83-R85 PolarHBondContact O-N 3.39Å; T83-E86 WeakPolarHBondContact O-CB 3.4Å; T83-E86 PolarHBondContact O-N 2.96Å; T83-E86 VanDerWaalsContact O-N 3.15Å; T83-H87 PolarHBondContact O-ND1 3.32Å
84L97.9Very high95.3Very high56 Ų5672.4 Ų72.429%0.29342%0.417SS..Hα-helixtrans-60.4-38.5175.8-178.459.4000111.9G80 A82 E86 H87 V88 T102 L103 A106G80-L84 WeakPolarHBondContact O-CB 3.4Å; G80-L84 PolarHBondContact O-N 3.12Å; A82-L84 VanDerWaalsContact C-N 3.3Å; A82-L84 PolarHBondContact O-N 3.44Å; L84-E86 PolarHBondContact O-N 2.89Å; L84-H87 PolarHBondContact O-N 3.29Å; L84-H87 VanDerWaalsContact O-N 3.12Å; L84-V88 HydrophobicContact CD1-CG1 3.92Å; L84-V88 HydrophobicContact CG-CG1 4.23Å; L84-V88 WeakPolarHBondContact O-CG1 3.32Å; L84-V88 PolarHBondContact O-N 2.88Å; L84-T102 HydrophobicContact CB-CG2 4.3Å; L84-T102 HydrophobicContact CD2-CG2 3.74Å; L84-T102 HydrophobicContact CG-CG2 3.79Å; L84-L103 HydrophobicContact CD2-CD2 4.28Å; L84-A106 HydrophobicContact CD1-CB 4.15Å; L84-A106 HydrophobicContact CD2-CB 4.37Å
85R97.6Very high94.4Very high45 Ų4579.1 Ų79.117%0.1744%0.443CS..Hα-helixtrans-61-34.1177.2-74.5-176.3-162.198-6.8112.6F81 A82 T83 H87 G91 A92 M97 T102F81-R85 WeakPolarHBondContact O-CG 3.28Å; F81-R85 PolarHBondContact O-N 3.41Å; F81-R85 VanDerWaalsContact O-N 3.16Å; F81-R85 PolarHBondContact O-NH1 3.21Å; A82-R85 WeakPolarHBondContact O-CB 3.31Å; A82-R85 PolarHBondContact O-N 3.25Å; T83-R85 VanDerWaalsContact C-N 3.28Å; T83-R85 PolarHBondContact O-N 3.39Å; R85-H87 PolarHBondContact O-N 2.86Å; R85-G91 CarbonylContact O-C 2.97Å; R85-G91 WeakPolarHBondContact O-CA 3.39Å; R85-A92 PolarHBondContact O-N 3.05Å; R85-M97 HydrophobicContact CG-CE 3.91Å; R85-M97 VanDerWaalsContact CZ-O 3.3Å; R85-M97 PolarHBondContact NE-O 3.25Å; R85-M97 PolarHBondContact NH2-O 2.71Å; R85-T102 HydrophobicContact CG-CG2 3.85Å
86E97.1Very high93.9Very high126 Ų12681.9 Ų81.959%0.58946%0.455SS*.Hα-helixtrans-63.5-25.5178.9-64.6166.5175.500112.4A82 T83 L84A82-E86 PolarHBondContact O-N 3.43Å; T83-E86 WeakPolarHBondContact O-CB 3.4Å; T83-E86 PolarHBondContact O-N 2.96Å; T83-E86 VanDerWaalsContact O-N 3.15Å; L84-E86 PolarHBondContact O-N 2.89Å
87H96.9Very high93.7Very high124 Ų12476.5 Ų76.557%0.57443%0.426SS*.Hα-helixtrans-104.6-6.8-172.9-64.182.6000114.3T83 L84 R85 Y109T83-H87 PolarHBondContact O-ND1 3.32Å; L84-H87 PolarHBondContact O-N 3.29Å; L84-H87 VanDerWaalsContact O-N 3.12Å; R85-H87 PolarHBondContact O-N 2.86Å; H87-Y109 VanDerWaalsContact O-CE1 3.23Å; H87-Y109 WeakPolarHBondContact O-CE1 3.43Å
88V96.9Very high93.7Very high10 Ų1076 Ų766%0.06143%0.425CS..SBendtrans-103.8148.8-179.5-61.20000111.2L84 N90 G91 M97 T102 A106L84-V88 HydrophobicContact CD1-CG1 3.92Å; L84-V88 HydrophobicContact CG-CG1 4.23Å; L84-V88 WeakPolarHBondContact O-CG1 3.32Å; L84-V88 PolarHBondContact O-N 2.88Å; V88-N90 PolarHBondContact O-N 3.04Å; V88-G91 PolarHBondContact O-N 2.92Å; V88-M97 HydrophobicContact CG2-CE 3.46Å; V88-M97 VanDerWaalsContact CG2-CE 3.46Å; V88-T102 HydrophobicContact CG2-CG2 4.44Å; V88-A106 HydrophobicContact CG1-CB 3.73Å
89P95.7Very high93.6Very high52 Ų5277.3 Ų77.334%0.33843%0.428SS..THydrogen-bonded Turntrans-53.3135177.8-26.734.9000111.4G91 S105 Y109P89-G91 PolarHBondContact O-N 3.33Å; P89-S105 PolarHBondContact O-OG 2.65Å; P89-Y109 HydrophobicContact CG-CD1 4.19Å; P89-Y109 HydrophobicContact CG-CD2 3.37Å; P89-Y109 HydrophobicContact CG-CE2 3.82Å; P89-Y109 HydrophobicContact CG-CG 3.59Å
90N90.1Very high93.6Very high133 Ų13376.8 Ų76.871%0.71143%0.428SS*.THydrogen-bonded Turntrans61.6-3.3-176.6-52.3-49.4000115.6V88 N94V88-N90 PolarHBondContact O-N 3.04Å; N90-N94 VanDerWaalsContact O-CB 3.22Å; N90-N94 WeakPolarHBondContact O-CB 3.46Å; N90-N94 PolarHBondContact O-N 3.48Å; N90-N94 VanDerWaalsContact O-N 3.07Å
91G90.9Very high93.6Very high2 Ų279.4 Ų79.42%0.02143%0.428CS..THydrogen-bonded Turntrans-74.9-40.3-17800000113.4R85 V88 P89 A93 N94R85-G91 CarbonylContact O-C 2.97Å; R85-G91 WeakPolarHBondContact O-CA 3.39Å; V88-G91 PolarHBondContact O-N 2.92Å; P89-G91 PolarHBondContact O-N 3.33Å; G91-A93 VanDerWaalsContact C-N 3.33Å; G91-A93 PolarHBondContact O-N 3.34Å; G91-N94 CarbonylContact O-C 3.32Å; G91-N94 PolarHBondContact O-N 3.16Å
92A87.8Confident93.6Very high77 Ų7777.9 Ų77.964%0.63642%0.421SS*.THydrogen-bonded Turntrans-64.2-39.2178.200000112R85R85-A92 PolarHBondContact O-N 3.05Å
93A86.8Confident93.7Very high99 Ų9980.1 Ų80.182%0.81843%0.427SS*.THydrogen-bonded Turntrans-75-29.6176.600000112.6G91G91-A93 VanDerWaalsContact C-N 3.33Å; G91-A93 PolarHBondContact O-N 3.34Å
94N84.9Confident93.7Very high75 Ų7585 Ų8540%0.40144%0.438SS..  trans-112.185.2-177.3-170.7-1.2000112.5N90 G91 K96 M97N90-N94 VanDerWaalsContact O-CB 3.22Å; N90-N94 WeakPolarHBondContact O-CB 3.46Å; N90-N94 PolarHBondContact O-N 3.48Å; N90-N94 VanDerWaalsContact O-N 3.07Å; G91-N94 CarbonylContact O-C 3.32Å; G91-N94 PolarHBondContact O-N 3.16Å; N94-K96 PolarHBondContact O-N 3.32Å; N94-K96 WeakPolarHBondContact OD1-CA 3.38Å; N94-K96 WeakPolarHBondContact OD1-CB 3.26Å; N94-K96 PolarHBondContact OD1-N 3.31Å; N94-M97 PolarHBondContact O-N 3.12Å; N94-M97 VanDerWaalsContact O-N 3.09Å; N94-M97 PolarHBondContact OD1-N 3.38Å
95K79.3Confident93.7Very high192 Ų19283.5 Ų83.584%0.83543%0.432SS*.THydrogen-bonded Turntrans-59.6-11.8173.6-163.6167.7-178.5175.20113.8
96K88.9Confident93.8Very high190 Ų19082 Ų8283%0.82643%0.429SS*.THydrogen-bonded Turntrans-98.35.1179.6-60.9-178.766.8-178.40114.1N94 S98N94-K96 PolarHBondContact O-N 3.32Å; N94-K96 WeakPolarHBondContact OD1-CA 3.38Å; N94-K96 WeakPolarHBondContact OD1-CB 3.26Å; N94-K96 PolarHBondContact OD1-N 3.31Å; K96-S98 PolarHBondContact O-N 3.31Å
97M93.8Very high93.9Very high16 Ų1679.4 Ų79.48%0.07942%0.421CS..  trans-60.3129.4179.1-164.3168.761.500111.3R85 V88 N94 E101 T102R85-M97 HydrophobicContact CG-CE 3.91Å; R85-M97 VanDerWaalsContact CZ-O 3.3Å; R85-M97 PolarHBondContact NE-O 3.25Å; R85-M97 PolarHBondContact NH2-O 2.71Å; V88-M97 HydrophobicContact CG2-CE 3.46Å; V88-M97 VanDerWaalsContact CG2-CE 3.46Å; N94-M97 PolarHBondContact O-N 3.12Å; N94-M97 VanDerWaalsContact O-N 3.09Å; N94-M97 PolarHBondContact OD1-N 3.38Å; M97-E101 HydrophobicContact CG-CB 3.67Å; M97-E101 HydrophobicContact SD-CB 4.35Å; M97-T102 HydrophobicContact CE-CG2 3.85Å; M97-T102 WeakPolarHBondContact CE-OG1 3.37Å
98S97.1Very high93.9Very high50 Ų5080 Ų8035%0.3543%0.425SS..  trans-70.3164.3-176.171.40000112.1K96 V100 E101 T102K96-S98 PolarHBondContact O-N 3.31Å; S98-V100 VanDerWaalsContact C-N 3.31Å; S98-V100 PolarHBondContact O-N 3.2Å; S98-E101 WeakPolarHBondContact CB-OE2 3.23Å; S98-E101 PolarHBondContact N-OE2 3.5Å; S98-E101 PolarHBondContact O-N 3.1Å; S98-E101 WeakPolarHBondContact OG-CB 3.29Å; S98-E101 WeakPolarHBondContact OG-CG 3.36Å; S98-E101 PolarHBondContact OG-N 3.24Å; S98-E101 PolarHBondContact OG-OE2 3.38Å; S98-T102 WeakPolarHBondContact O-CB 3.36Å; S98-T102 PolarHBondContact O-N 3.36Å; S98-T102 PolarHBondContact O-OG1 2.84Å
99K97.3Very high94Very high95 Ų9584 Ų8441%0.41344%0.439SS..Hα-helixtrans-58.2-44.2178.2-69.4-173.7175.3-176.40111.7N78 F81 T102 L103N78-K99 PolarHBondContact OD1-NZ 3.42Å; F81-K99 HydrophobicContact CD1-CB 4.26Å; F81-K99 HydrophobicContact CD1-CG 3.97Å; F81-K99 HydrophobicContact CD2-CD 4.23Å; F81-K99 HydrophobicContact CD2-CG 4.3Å; F81-K99 HydrophobicContact CE1-CB 3.65Å; F81-K99 HydrophobicContact CE1-CD 4.42Å; F81-K99 HydrophobicContact CE1-CG 3.77Å; F81-K99 HydrophobicContact CE2-CD 3.89Å; F81-K99 HydrophobicContact CE2-CG 4.12Å; F81-K99 HydrophobicContact CG-CG 4.24Å; F81-K99 HydrophobicContact CZ-CB 3.82Å; F81-K99 HydrophobicContact CZ-CD 3.99Å; F81-K99 HydrophobicContact CZ-CG 3.85Å; K99-T102 PolarHBondContact O-N 3.29Å; K99-L103 VanDerWaalsContact O-CG 3.29Å; K99-L103 WeakPolarHBondContact O-CG 3.41Å; K99-L103 PolarHBondContact O-N 3.45Å
100V98.1Very high94.1Very high78 Ų7886 Ų8647%0.47345%0.446SS..Hα-helixtrans-67.3-45.2-178.9175.90000111.2S98 T102 L103 R104S98-V100 VanDerWaalsContact C-N 3.31Å; S98-V100 PolarHBondContact O-N 3.2Å; V100-T102 VanDerWaalsContact C-N 3.34Å; V100-T102 PolarHBondContact O-N 3.45Å; V100-L103 PolarHBondContact O-N 3.49Å; V100-R104 HydrophobicContact CG1-CG 4.5Å; V100-R104 VanDerWaalsContact CG1-CZ 3.44Å; V100-R104 WeakPolarHBondContact O-CG 3.45Å; V100-R104 PolarHBondContact O-N 3.09Å
101E97.2Very high94.5Very high100 Ų10087.6 Ų87.647%0.46744%0.442SS..Hα-helixtrans-62.5-42.5176.5-70.1164.214500111.7M97 S98 L103 R104 S105M97-E101 HydrophobicContact CG-CB 3.67Å; M97-E101 HydrophobicContact SD-CB 4.35Å; S98-E101 WeakPolarHBondContact CB-OE2 3.23Å; S98-E101 PolarHBondContact N-OE2 3.5Å; S98-E101 PolarHBondContact O-N 3.1Å; S98-E101 WeakPolarHBondContact OG-CB 3.29Å; S98-E101 WeakPolarHBondContact OG-CG 3.36Å; S98-E101 PolarHBondContact OG-N 3.24Å; S98-E101 PolarHBondContact OG-OE2 3.38Å; E101-L103 VanDerWaalsContact C-N 3.32Å; E101-L103 PolarHBondContact O-N 3.45Å; E101-R104 PolarHBondContact O-N 3.18Å; E101-S105 WeakPolarHBondContact O-CB 3.46Å; E101-S105 PolarHBondContact O-N 2.66Å
102T97.7Very high94.9Very high0 Ų089.9 Ų89.90%046%0.461CS..Hα-helixtrans-57.7-46.4176.7-50.90000110.9F81 L84 R85 V88 M97 S98 K99 V100 A106F81-T102 HydrophobicContact CD1-CG2 4.26Å; L84-T102 HydrophobicContact CB-CG2 4.3Å; L84-T102 HydrophobicContact CD2-CG2 3.74Å; L84-T102 HydrophobicContact CG-CG2 3.79Å; R85-T102 HydrophobicContact CG-CG2 3.85Å; V88-T102 HydrophobicContact CG2-CG2 4.44Å; M97-T102 HydrophobicContact CE-CG2 3.85Å; M97-T102 WeakPolarHBondContact CE-OG1 3.37Å; S98-T102 WeakPolarHBondContact O-CB 3.36Å; S98-T102 PolarHBondContact O-N 3.36Å; S98-T102 PolarHBondContact O-OG1 2.84Å; K99-T102 PolarHBondContact O-N 3.29Å; V100-T102 VanDerWaalsContact C-N 3.34Å; V100-T102 PolarHBondContact O-N 3.45Å; T102-A106 WeakPolarHBondContact O-CB 3.41Å; T102-A106 PolarHBondContact O-N 2.91Å
103L98.5Very high95.4Very high90 Ų9089.7 Ų89.747%0.47145%0.449SS..Hα-helixtrans-67.3-41.3179.4-67.2175000112.4F81 L84 K99 V100 E101 A106 V107F81-L103 HydrophobicContact CE1-CD1 4.42Å; F81-L103 HydrophobicContact CE1-CD2 4.1Å; F81-L103 HydrophobicContact CE1-CG 3.98Å; F81-L103 HydrophobicContact CZ-CD1 4.23Å; F81-L103 HydrophobicContact CZ-CD2 4.26Å; F81-L103 HydrophobicContact CZ-CG 4.24Å; L84-L103 HydrophobicContact CD2-CD2 4.28Å; K99-L103 VanDerWaalsContact O-CG 3.29Å; K99-L103 WeakPolarHBondContact O-CG 3.41Å; K99-L103 PolarHBondContact O-N 3.45Å; V100-L103 PolarHBondContact O-N 3.49Å; E101-L103 VanDerWaalsContact C-N 3.32Å; E101-L103 PolarHBondContact O-N 3.45Å; L103-A106 PolarHBondContact O-N 3.16Å; L103-V107 WeakPolarHBondContact O-CG2 3.48Å; L103-V107 PolarHBondContact O-N 3.21Å; L103-V107 VanDerWaalsContact O-N 3.13Å
104R98.3Very high95.9Very high176 Ų17690 Ų9066%0.66443%0.433SS*.Hα-helixtrans-61.8-49176.7-72.9175.9-178.4161.6-0.1111.2V100 E101 A106 V107 E108V100-R104 HydrophobicContact CG1-CG 4.5Å; V100-R104 VanDerWaalsContact CG1-CZ 3.44Å; V100-R104 WeakPolarHBondContact O-CG 3.45Å; V100-R104 PolarHBondContact O-N 3.09Å; E101-R104 PolarHBondContact O-N 3.18Å; R104-A106 VanDerWaalsContact C-N 3.33Å; R104-A106 PolarHBondContact O-N 3.43Å; R104-V107 PolarHBondContact O-N 3.33Å; R104-E108 PolarHBondContact O-N 3.49Å
105S97.9Very high96.5Very high24 Ų2492 Ų9217%0.16844%0.44CS..Hα-helixtrans-60.1-41.5177.6-176.80000111.7P89 E101 V107 E108 Y109P89-S105 PolarHBondContact O-OG 2.65Å; E101-S105 WeakPolarHBondContact O-CB 3.46Å; E101-S105 PolarHBondContact O-N 2.66Å; S105-V107 PolarHBondContact O-N 3.24Å; S105-E108 PolarHBondContact O-N 3.01Å; S105-Y109 VanDerWaalsContact O-CB 3.26Å; S105-Y109 WeakPolarHBondContact O-CB 3.1Å; S105-Y109 PolarHBondContact O-N 2.87Å
106A98.5Very high97.4Very high14 Ų1487.9 Ų87.912%0.11643%0.427CS..Hα-helixtrans-59.8-47.3176.400000112.8L84 V88 T102 L103 R104 Y109 I110L84-A106 HydrophobicContact CD1-CB 4.15Å; L84-A106 HydrophobicContact CD2-CB 4.37Å; V88-A106 HydrophobicContact CG1-CB 3.73Å; T102-A106 WeakPolarHBondContact O-CB 3.41Å; T102-A106 PolarHBondContact O-N 2.91Å; L103-A106 PolarHBondContact O-N 3.16Å; R104-A106 VanDerWaalsContact C-N 3.33Å; R104-A106 PolarHBondContact O-N 3.43Å; A106-Y109 PolarHBondContact O-N 3.33Å; A106-I110 VanDerWaalsContact O-CG1 3.31Å; A106-I110 WeakPolarHBondContact O-CG1 3.26Å; A106-I110 PolarHBondContact O-N 3.37Å
107V98.6Very high97.8Very high70 Ų7083.6 Ų83.642%0.42441%0.412SS..Hα-helixtrans-63.9-43.1179.91720000111.2L103 R104 S105 R111L103-V107 WeakPolarHBondContact O-CG2 3.48Å; L103-V107 PolarHBondContact O-N 3.21Å; L103-V107 VanDerWaalsContact O-N 3.13Å; R104-V107 PolarHBondContact O-N 3.33Å; S105-V107 PolarHBondContact O-N 3.24Å; V107-R111 WeakPolarHBondContact O-CG 3.47Å; V107-R111 PolarHBondContact O-N 3.37Å
108E98.4Very high97.9Very high138 Ų13888 Ų8865%0.64544%0.437SS*.Hα-helixtrans-65.5-41.3177.7-173.6166.2-158.200111.7R104 S105 R111 A112R104-E108 PolarHBondContact O-N 3.49Å; S105-E108 PolarHBondContact O-N 3.01Å; E108-R111 PolarHBondContact O-N 3.48Å; E108-A112 PolarHBondContact O-N 2.86Å
109Y98.4Very high97.8Very high92 Ų9290.8 Ų90.836%0.36144%0.444SS..Hα-helixtrans-65.9-41.8179.4-171.2-135.5000112.6H87 P89 S105 A106 R111 A112 L113H87-Y109 VanDerWaalsContact O-CE1 3.23Å; H87-Y109 WeakPolarHBondContact O-CE1 3.43Å; P89-Y109 HydrophobicContact CG-CD1 4.19Å; P89-Y109 HydrophobicContact CG-CD2 3.37Å; P89-Y109 HydrophobicContact CG-CE2 3.82Å; P89-Y109 HydrophobicContact CG-CG 3.59Å; S105-Y109 VanDerWaalsContact O-CB 3.26Å; S105-Y109 WeakPolarHBondContact O-CB 3.1Å; S105-Y109 PolarHBondContact O-N 2.87Å; A106-Y109 PolarHBondContact O-N 3.33Å; Y109-R111 VanDerWaalsContact C-N 3.3Å; Y109-R111 PolarHBondContact O-N 3.35Å; Y109-A112 PolarHBondContact O-N 2.97Å; Y109-L113 HydrophobicContact CD1-CD1 3.99Å; Y109-L113 HydrophobicContact CD2-CD1 4.4Å; Y109-L113 HydrophobicContact CD2-CG 4.14Å; Y109-L113 HydrophobicContact CE1-CD1 3.71Å; Y109-L113 HydrophobicContact CE1-CG 4.39Å; Y109-L113 HydrophobicContact CE2-CD1 4.13Å; Y109-L113 HydrophobicContact CE2-CD2 3.89Å; Y109-L113 HydrophobicContact CE2-CG 3.9Å; Y109-L113 HydrophobicContact CG-CD1 4.33Å; Y109-L113 HydrophobicContact CG-CG 4.49Å; Y109-L113 VanDerWaalsContact O-CG 3.32Å; Y109-L113 WeakPolarHBondContact O-CG 3.4Å; Y109-L113 PolarHBondContact O-N 3.07Å
110I98.4Very high97.6Very high96 Ų9691.5 Ų91.549%0.49245%0.448SS..Hα-helixtrans-57.5-45.5174.2-68.8164.7000110.5A106 A112 L113 Q114A106-I110 VanDerWaalsContact O-CG1 3.31Å; A106-I110 WeakPolarHBondContact O-CG1 3.26Å; A106-I110 PolarHBondContact O-N 3.37Å; I110-A112 PolarHBondContact O-N 3.15Å; I110-L113 PolarHBondContact O-N 3.27Å; I110-Q114 HydrophobicContact CG2-CG 4.45Å; I110-Q114 VanDerWaalsContact O-CG 3.28Å; I110-Q114 WeakPolarHBondContact O-CG 3.5Å; I110-Q114 PolarHBondContact O-N 3.38Å
111R98.6Very high97.4Very high165 Ų16592.4 Ų92.462%0.62345%0.451SS*.Hα-helixtrans-62.9-42.9178.3-69.7172.5-179156.20112.3V107 E108 Y109 Q114 Q115V107-R111 WeakPolarHBondContact O-CG 3.47Å; V107-R111 PolarHBondContact O-N 3.37Å; E108-R111 PolarHBondContact O-N 3.48Å; Y109-R111 VanDerWaalsContact C-N 3.3Å; Y109-R111 PolarHBondContact O-N 3.35Å; R111-Q114 PolarHBondContact O-N 3.48Å; R111-Q115 PolarHBondContact O-N 3.13Å
112A98.3Very high97Very high51 Ų5190.6 Ų90.642%0.42145%0.453SS..Hα-helixtrans-63.5-41.9178.100000111.8E108 Y109 I110 Q115 L116E108-A112 PolarHBondContact O-N 2.86Å; Y109-A112 PolarHBondContact O-N 2.97Å; I110-A112 PolarHBondContact O-N 3.15Å; A112-Q115 PolarHBondContact O-N 3.47Å; A112-L116 WeakPolarHBondContact O-CB 3.35Å; A112-L116 PolarHBondContact O-N 3.48Å
113L98.3Very high96.5Very high72 Ų7293.8 Ų93.838%0.37747%0.472SS..Hα-helixtrans-65.4-40.8175.9-68.9176.3000112Y109 I110 L116 L117Y109-L113 HydrophobicContact CD1-CD1 3.99Å; Y109-L113 HydrophobicContact CD2-CD1 4.4Å; Y109-L113 HydrophobicContact CD2-CG 4.14Å; Y109-L113 HydrophobicContact CE1-CD1 3.71Å; Y109-L113 HydrophobicContact CE1-CG 4.39Å; Y109-L113 HydrophobicContact CE2-CD1 4.13Å; Y109-L113 HydrophobicContact CE2-CD2 3.89Å; Y109-L113 HydrophobicContact CE2-CG 3.9Å; Y109-L113 HydrophobicContact CG-CD1 4.33Å; Y109-L113 HydrophobicContact CG-CG 4.49Å; Y109-L113 VanDerWaalsContact O-CG 3.32Å; Y109-L113 WeakPolarHBondContact O-CG 3.4Å; Y109-L113 PolarHBondContact O-N 3.07Å; I110-L113 PolarHBondContact O-N 3.27Å; L113-L116 PolarHBondContact O-N 3.45Å; L113-L117 WeakPolarHBondContact O-CG 3.41Å; L113-L117 PolarHBondContact O-N 3.35Å; L113-L117 VanDerWaalsContact O-N 3.08Å
114Q98.3Very high96.1Very high106 Ų10691.2 Ų91.250%0.49546%0.461SS..Hα-helixtrans-60-48.1174.6-74170.7-34.500111.3I110 R111 L116 L117 D118I110-Q114 HydrophobicContact CG2-CG 4.45Å; I110-Q114 VanDerWaalsContact O-CG 3.28Å; I110-Q114 WeakPolarHBondContact O-CG 3.5Å; I110-Q114 PolarHBondContact O-N 3.38Å; R111-Q114 PolarHBondContact O-N 3.48Å; Q114-L116 VanDerWaalsContact C-N 3.33Å; Q114-L116 PolarHBondContact O-N 2.91Å; Q114-L117 PolarHBondContact O-N 2.94Å; Q114-D118 PolarHBondContact O-N 3.3Å
115Q97.6Very high95.6Very high116 Ų11685.4 Ų85.454%0.54245%0.451SS..Hα-helixtrans-60.1-42.4177.4-177.6-179.3-14.800112.1R111 A112 L117 D118 E119R111-Q115 PolarHBondContact O-N 3.13Å; A112-Q115 PolarHBondContact O-N 3.47Å; Q115-L117 VanDerWaalsContact C-N 3.31Å; Q115-L117 PolarHBondContact O-N 2.85Å; Q115-D118 PolarHBondContact O-N 3.27Å; Q115-E119 HydrophobicContact CG-CG 4.45Å; Q115-E119 WeakPolarHBondContact CG-OE1 3.21Å; Q115-E119 PolarHBondContact NE2-OE1 3.34Å; Q115-E119 WeakPolarHBondContact O-CB 3.36Å; Q115-E119 WeakPolarHBondContact O-CG 3.39Å; Q115-E119 PolarHBondContact O-N 3.41Å
116L97.6Very high94.9Very high106 Ų10685.2 Ų85.256%0.55545%0.451SS*.Hα-helixtrans-61.4-40.7178.2-175.2154.5000111.9A112 L113 Q114 H120A112-L116 WeakPolarHBondContact O-CB 3.35Å; A112-L116 PolarHBondContact O-N 3.48Å; L113-L116 PolarHBondContact O-N 3.45Å; Q114-L116 VanDerWaalsContact C-N 3.33Å; Q114-L116 PolarHBondContact O-N 2.91Å; L116-H120 WeakPolarHBondContact O-CB 3.46Å; L116-H120 PolarHBondContact O-N 2.95Å
117L97Very high94.1Very high100 Ų10089.6 Ų89.652%0.52447%0.468SS..Hα-helixtrans-67.3-45176.8-68.5171.5000111.5L113 Q114 Q115 E119 H120 D121L113-L117 WeakPolarHBondContact O-CG 3.41Å; L113-L117 PolarHBondContact O-N 3.35Å; L113-L117 VanDerWaalsContact O-N 3.08Å; Q114-L117 PolarHBondContact O-N 2.94Å; Q115-L117 VanDerWaalsContact C-N 3.31Å; Q115-L117 PolarHBondContact O-N 2.85Å; L117-E119 VanDerWaalsContact C-N 3.33Å; L117-E119 PolarHBondContact O-N 3.21Å; L117-H120 PolarHBondContact O-N 3.44Å; L117-D121 WeakPolarHBondContact O-CB 3.22Å; L117-D121 PolarHBondContact O-N 3.15Å
118D95.6Very high93.4Very high110 Ų11094.5 Ų94.559%0.58849%0.486SS*.Hα-helixtrans-61.3-41.7178.4-68.4-22.9000111.8Q114 Q115 D121 A122Q114-D118 PolarHBondContact O-N 3.3Å; Q115-D118 PolarHBondContact O-N 3.27Å; D118-D121 PolarHBondContact O-N 3.35Å; D118-A122 WeakPolarHBondContact O-CB 3.3Å; D118-A122 PolarHBondContact O-N 3.03Å
119E94.8Very high92.6Very high108 Ų10891.4 Ų91.451%0.50548%0.484SS..Hα-helixtrans-63.1-44.6175-74174.5-165.300111.6Q115 L117 D121 A122 V123Q115-E119 HydrophobicContact CG-CG 4.45Å; Q115-E119 WeakPolarHBondContact CG-OE1 3.21Å; Q115-E119 PolarHBondContact NE2-OE1 3.34Å; Q115-E119 WeakPolarHBondContact O-CB 3.36Å; Q115-E119 WeakPolarHBondContact O-CG 3.39Å; Q115-E119 PolarHBondContact O-N 3.41Å; L117-E119 VanDerWaalsContact C-N 3.33Å; L117-E119 PolarHBondContact O-N 3.21Å; E119-D121 PolarHBondContact O-N 3.46Å; E119-A122 PolarHBondContact O-N 3.19Å; E119-V123 WeakPolarHBondContact O-CB 3.21Å; E119-V123 VanDerWaalsContact O-CG2 3.23Å; E119-V123 WeakPolarHBondContact O-CG2 3.47Å; E119-V123 PolarHBondContact O-N 3.29Å
120H94.1Very high91.3Very high109 Ų10989.5 Ų89.551%0.50549%0.492SS..Hα-helixtrans-62.7-41.3177.6175.9-87000112.2L116 L117 V123 S124L116-H120 WeakPolarHBondContact O-CB 3.46Å; L116-H120 PolarHBondContact O-N 2.95Å; L117-H120 PolarHBondContact O-N 3.44Å; H120-V123 PolarHBondContact O-N 2.95Å; H120-S124 PolarHBondContact CE1-OG 3Å; H120-S124 VanDerWaalsContact O-CB 3.26Å; H120-S124 WeakPolarHBondContact O-CB 3.13Å; H120-S124 PolarHBondContact O-N 3.3Å; H120-S124 PolarHBondContact O-OG 3.36Å
121D92.7Very high89.8Confident98 Ų9889.9 Ų89.952%0.52450%0.499SS..Hα-helixtrans-69.4-40.6178.9-73.9-8.8000111.3L117 D118 E119 S124 A125L117-D121 WeakPolarHBondContact O-CB 3.22Å; L117-D121 PolarHBondContact O-N 3.15Å; D118-D121 PolarHBondContact O-N 3.35Å; E119-D121 PolarHBondContact O-N 3.46Å; D121-S124 PolarHBondContact O-N 2.94Å; D121-A125 VanDerWaalsContact O-CB 3.28Å; D121-A125 WeakPolarHBondContact O-CB 3.36Å; D121-A125 PolarHBondContact O-N 2.96Å
122A88.9Confident87.7Confident61 Ų6186.1 Ų86.150%0.50449%0.491SS..Hα-helixtrans-61.5-44173.800000112D118 E119 A126D118-A122 WeakPolarHBondContact O-CB 3.3Å; D118-A122 PolarHBondContact O-N 3.03Å; E119-A122 PolarHBondContact O-N 3.19Å; A122-A126 WeakPolarHBondContact O-CB 3.45Å; A122-A126 PolarHBondContact O-N 2.97Å
123V88.9Confident85.7Confident68 Ų6888.6 Ų88.641%0.41251%0.505SS..Hα-helixtrans-65.3-44.9176.7169.60000110.8E119 H120 A125 A126 F127E119-V123 WeakPolarHBondContact O-CB 3.21Å; E119-V123 VanDerWaalsContact O-CG2 3.23Å; E119-V123 WeakPolarHBondContact O-CG2 3.47Å; E119-V123 PolarHBondContact O-N 3.29Å; H120-V123 PolarHBondContact O-N 2.95Å; V123-A125 PolarHBondContact O-N 3.37Å; V123-A126 WeakPolarHBondContact O-CB 3.37Å; V123-A126 PolarHBondContact O-N 2.85Å; V123-F127 HydrophobicContact CG1-CD2 3.66Å; V123-F127 HydrophobicContact CG1-CE2 3.37Å; V123-F127 WeakPolarHBondContact O-CD2 3.48Å; V123-F127 PolarHBondContact O-N 3Å
124S89.9Confident83.7Confident35 Ų3589.6 Ų89.625%0.24552%0.516CS..Hα-helixtrans-62.5-42.1178.1-65.80000112H120 D121 A126 F127 Q128H120-S124 PolarHBondContact CE1-OG 3Å; H120-S124 VanDerWaalsContact O-CB 3.26Å; H120-S124 WeakPolarHBondContact O-CB 3.13Å; H120-S124 PolarHBondContact O-N 3.3Å; H120-S124 PolarHBondContact O-OG 3.36Å; D121-S124 PolarHBondContact O-N 2.94Å; S124-A126 VanDerWaalsContact C-N 3.34Å; S124-F127 PolarHBondContact O-N 3.45Å; S124-Q128 WeakPolarHBondContact O-CG 3.38Å; S124-Q128 PolarHBondContact O-N 3.01Å
125A87.4Confident81.8Confident55 Ų5587.5 Ų87.546%0.45552%0.523SS..Hα-helixtrans-63.4-39.3173.700000111.9D121 V123 Q128 A129D121-A125 VanDerWaalsContact O-CB 3.28Å; D121-A125 WeakPolarHBondContact O-CB 3.36Å; D121-A125 PolarHBondContact O-N 2.96Å; V123-A125 PolarHBondContact O-N 3.37Å; A125-Q128 PolarHBondContact O-N 3.29Å; A125-A129 VanDerWaalsContact O-CB 3.25Å; A125-A129 WeakPolarHBondContact O-CB 3.4Å; A125-A129 PolarHBondContact O-N 2.9Å
126A83.1Confident79.7Confident20 Ų2090.1 Ų90.117%0.16554%0.537CS..Hα-helixtrans-65.2-37.9176.100000112.6A122 V123 S124 G130 V131 L132A122-A126 WeakPolarHBondContact O-CB 3.45Å; A122-A126 PolarHBondContact O-N 2.97Å; V123-A126 WeakPolarHBondContact O-CB 3.37Å; V123-A126 PolarHBondContact O-N 2.85Å; S124-A126 VanDerWaalsContact C-N 3.34Å; A126-G130 PolarHBondContact O-N 3.35Å; A126-V131 VanDerWaalsContact CA-CG2 3.48Å; A126-V131 HydrophobicContact CB-CG2 3.66Å; A126-V131 WeakPolarHBondContact O-CG2 3.46Å; A126-V131 PolarHBondContact O-N 3.47Å; A126-V131 VanDerWaalsContact O-N 3.16Å; A126-L132 HydrophobicContact CB-CD1 3.71Å; A126-L132 HydrophobicContact CB-CG 4.04Å
127F82.1Confident77.7Confident105 Ų10590.2 Ų90.246%0.46155%0.546SS..Hα-helixtrans-65.2-43.8172.1-80.4-67.9000112.1V123 S124 G130 L132 P134V123-F127 HydrophobicContact CG1-CD2 3.66Å; V123-F127 HydrophobicContact CG1-CE2 3.37Å; V123-F127 WeakPolarHBondContact O-CD2 3.48Å; V123-F127 PolarHBondContact O-N 3Å; S124-F127 PolarHBondContact O-N 3.45Å; F127-G130 PolarHBondContact O-N 3.39Å; F127-L132 HydrophobicContact CD1-CB 4.16Å; F127-L132 VanDerWaalsContact CD1-O 3.22Å; F127-L132 WeakPolarHBondContact CD1-O 3.39Å; F127-L132 HydrophobicContact CE1-CB 4.07Å; F127-L132 WeakPolarHBondContact CE1-O 3.42Å; F127-P134 HydrophobicContact CE1-CG 4.22Å
128Q82.6Confident75.2Confident173 Ų17393.4 Ų93.481%0.80856%0.559SS**Hα-helixtrans-67.4-35.3177.9-70.5176.916.100112.9S124 A125 G130S124-Q128 WeakPolarHBondContact O-CG 3.38Å; S124-Q128 PolarHBondContact O-N 3.01Å; A125-Q128 PolarHBondContact O-N 3.29Å; Q128-G130 PolarHBondContact O-N 3.09Å
129A81.6Confident73.2Confident73 Ų7392.1 Ų92.160%0.60357%0.572SS**THydrogen-bonded Turntrans-77.31.5176.900000113.5A125 V131A125-A129 VanDerWaalsContact O-CB 3.25Å; A125-A129 WeakPolarHBondContact O-CB 3.4Å; A125-A129 PolarHBondContact O-N 2.9Å; A129-V131 HydrophobicContact CB-CG2 4.26Å; A129-V131 PolarHBondContact O-N 2.95Å
130G71.8Confident70.6Confident52 Ų5296.4 Ų96.454%0.53659%0.585SS.*THydrogen-bonded Turntrans68.413.1177.600000114.6A126 F127 Q128A126-G130 PolarHBondContact O-N 3.35Å; F127-G130 PolarHBondContact O-N 3.39Å; Q128-G130 PolarHBondContact O-N 3.09Å
131V66.6Low68.7Low104 Ų10496.7 Ų96.763%0.6360%0.599SS**SBendtrans-82.9-16.7-179.3-73.60000112.8A126 A129A126-V131 VanDerWaalsContact CA-CG2 3.48Å; A126-V131 HydrophobicContact CB-CG2 3.66Å; A126-V131 WeakPolarHBondContact O-CG2 3.46Å; A126-V131 PolarHBondContact O-N 3.47Å; A126-V131 VanDerWaalsContact O-N 3.16Å; A129-V131 HydrophobicContact CB-CG2 4.26Å; A129-V131 PolarHBondContact O-N 2.95Å
132L55Low66.6Low86 Ų8696 Ų9645%0.4561%0.606SS.*SBendtrans-123.383.3172.3-58.2176.9000109.2A126 F127 P134A126-L132 HydrophobicContact CB-CD1 3.71Å; A126-L132 HydrophobicContact CB-CG 4.04Å; F127-L132 HydrophobicContact CD1-CB 4.16Å; F127-L132 VanDerWaalsContact CD1-O 3.22Å; F127-L132 WeakPolarHBondContact CD1-O 3.39Å; F127-L132 HydrophobicContact CE1-CB 4.07Å; F127-L132 WeakPolarHBondContact CE1-O 3.42Å; L132-P134 WeakPolarHBondContact O-CD 3.34Å
133S56.4Low64.8Low103 Ų10399.6 Ų99.672%0.7262%0.617SS**  trans-81.3122.2172.7-113.10000110.1G135S133-G135 PolarHBondContact O-N 2.99Å; S133-G135 VanDerWaalsContact O-N 3.12Å
134P56.8Low63.1Low93 Ų93104.5 Ų104.560%0.60464%0.638SS**  trans-62.5112.7154.7-13.328.5000106.3F127 L132 M136F127-P134 HydrophobicContact CE1-CG 4.22Å; L132-P134 WeakPolarHBondContact O-CD 3.34Å; P134-M136 PolarHBondContact O-N 3.25Å
135G56.8Low61.5Low62 Ų62110.5 Ų110.564%0.63967%0.667SS**  trans-65.781.218000000111.3S133S133-G135 PolarHBondContact O-N 2.99Å; S133-G135 VanDerWaalsContact O-N 3.12Å
136M53.3Low59.8Low171 Ų171112.8 Ų112.884%0.84268%0.679SS**  trans-110.577.7167.4-61.2-71.8103.400107.6P134 Q138P134-M136 PolarHBondContact O-N 3.25Å; M136-Q138 PolarHBondContact O-N 2.76Å
137S57.3Low58.5Low108 Ų108120.5 Ų120.576%0.75572%0.715SS**  trans-71.198159.5480000108.5
138Q44.1Very low57.1Low168 Ų168120.3 Ų120.379%0.78573%0.732SS**  trans-148.296.8155.8-147.785.729.100108.8M136 Y140M136-Q138 PolarHBondContact O-N 2.76Å; Q138-Y140 PolarHBondContact O-N 2.93Å
139G53.1Low55.2Low83 Ų83115.6 Ų115.686%0.85673%0.73SS**  trans-62.4126.6167.800000110.2
140Y40.5Very low53.7Low198 Ų198117.2 Ų117.278%0.77674%0.737SS**  trans-143.6119.8145.256.5-89.7000108.3Q138Q138-Y140 PolarHBondContact O-N 2.93Å
141S53.7Low53Low115 Ų115120.6 Ų120.680%0.80475%0.749SS**  trans-58.3127.8158.11650000108.8
142A49Very low52.3Low82 Ų82121.6 Ų121.668%0.67876%0.756SS**  trans-156.997.4155.300000109.4M144A142-M144 PolarHBondContact O-N 3.16Å
143D50.5Low52Low137 Ų137123.1 Ų123.173%0.73377%0.774SS**  trans-39.8130146.9-70.8-77000110.6
144M54.1Low51.7Low171 Ų171123.4 Ų123.484%0.84278%0.775SS**  trans-160.499.4140.3-87.4-44.8147.500109.4A142 S146A142-M144 PolarHBondContact O-N 3.16Å; M144-S146 PolarHBondContact O-N 3.41Å
145N55.5Low51.5Low162 Ų162128.7 Ų128.787%0.86679%0.785SS**  trans-63.9116.4152.6-175.928.2000107.9
146S52.4Low51.2Low102 Ų102131.4 Ų131.471%0.71379%0.794SS**  trans-150.297.4167.9-81.70000111.5M144M144-S146 PolarHBondContact O-N 3.41Å
147M55.8Low51.5Low183 Ų183127.9 Ų127.990%0.90179%0.786SS**  trans-9.2122137.5-165.4105.383.500115.7
148A51.5Low51.2Low100 Ų100130.1 Ų130.183%0.82679%0.789SS**  163.5132.2129.400000112.4
149G43.6Very low51.5Low75 Ų75130.6 Ų130.677%0.77379%0.792SS**  trans110.580.7151.700000116.6
150S50.9Low51.5Low106 Ų106129.8 Ų129.874%0.74178%0.784SS**  trans-66.9148151.5-173.70000109.2
151P56.5Low52.1Low123 Ų123125.9 Ų125.980%0.79979%0.785SS**  -128.3137.8119.631.6-21.7000112.8
152V50.8Low52Low126 Ų126131 Ų13176%0.76479%0.788SS**PPolyproline II helixtrans-53132.9170.2-73.20000111.9
153S48.5Very low52.8Low118 Ų118133.7 Ų133.783%0.82579%0.791SS**PPolyproline II helixtrans-76.2120.6168.5176.70000109Y155S153-Y155 PolarHBondContact O-N 3.23Å
154S50.2Low53.5Low108 Ų108132.6 Ų132.676%0.75579%0.792SS**PPolyproline II helixtrans-71.7120.4168-65.60000109.4S156S154-S156 PolarHBondContact O-N 3.47Å
155Y52.7Low53.8Low204 Ų204128.8 Ų128.880%0.877%0.774SS**PPolyproline II helixtrans-66.5123.2160.775.4-78.8000107.6S153S153-Y155 PolarHBondContact O-N 3.23Å
156S51.8Low54.5Low120 Ų120123.5 Ų123.584%0.83975%0.75SS**  trans-107.998.2167.5-169.70000106.5S154S154-S156 PolarHBondContact O-N 3.47Å
157S58.4Low55.1Low96 Ų96124 Ų12467%0.67175%0.75SS**  trans-81.5110.3168.4-690000108
158D50.8Low55.3Low155 Ų155122.3 Ų122.383%0.82974%0.741SS**  trans-89.1110.9165.8-168.5-116.2000108G160D158-G160 PolarHBondContact O-N 2.89Å
159E52.2Low55.8Low179 Ų179122.3 Ų122.384%0.83672%0.723SS**  trans-69.7119170.9-89.3-116119.900109S161E159-S161 PolarHBondContact O-N 3.42Å
160G52.7Low56.8Low66 Ų66124.2 Ų124.268%0.6871%0.712SS**  trans-61.399.5178.100000112.6D158 Y162D158-G160 PolarHBondContact O-N 2.89Å; G160-Y162 PolarHBondContact O-N 2.95Å
161S53.4Low57.2Low115 Ų115125.6 Ų125.680%0.80471%0.707SS**  trans-81.7103.2159.1-179.10000108.2E159 D163E159-S161 PolarHBondContact O-N 3.42Å; S161-D163 PolarHBondContact O-N 3.29Å; S161-D163 VanDerWaalsContact O-N 3.12Å
162Y50.2Low57.4Low222 Ų222125.6 Ų125.687%0.87170%0.7SS**  trans-64.4109.8174.6-85.1-92.3000110.3G160G160-Y162 PolarHBondContact O-N 2.95Å
163D67.4Low57.9Low139 Ų139123.8 Ų123.874%0.74369%0.685SS**PPolyproline II helixtrans-71.3133.4165.2-145.9-4.9000108.4S161 L165S161-D163 PolarHBondContact O-N 3.29Å; S161-D163 VanDerWaalsContact O-N 3.12Å; D163-L165 PolarHBondContact O-N 3.21Å
164P63.6Low58.4Low114 Ų114123.3 Ų123.374%0.7467%0.674SS**PPolyproline II helixtrans-58.4120.317321.3-33.2000110.8S166P164-S166 PolarHBondContact O-N 3.31Å
165L61.7Low58.6Low92 Ų92125.3 Ų125.348%0.48267%0.669SS.*PPolyproline II helixtrans-49133.8-176.3-68170.1000112.1D163 E169 L173D163-L165 PolarHBondContact O-N 3.21Å; L165-E169 HydrophobicContact CB-CB 4.3Å; L165-E169 HydrophobicContact CD2-CB 4.2Å; L165-E169 WeakPolarHBondContact CD2-OE2 3.48Å; L165-L173 HydrophobicContact CD1-CD1 3.84Å
166S69.8Low58.9Low51 Ų51120.1 Ų120.136%0.35766%0.659SS.*PPolyproline II helixtrans-59.8147.2175175.60000110.2P164 E168 E169 Q170P164-S166 PolarHBondContact O-N 3.31Å; S166-E168 PolarHBondContact O-N 3.43Å; S166-E169 PolarHBondContact N-OE2 3.05Å; S166-E169 WeakPolarHBondContact O-CB 3.4Å; S166-E169 PolarHBondContact O-N 3.03Å; S166-Q170 PolarHBondContact O-N 3Å; S166-Q170 VanDerWaalsContact O-N 3.16Å
167P65.3Low59.1Low111 Ų111120.5 Ų120.572%0.72165%0.651SS**Hα-helixtrans-51.3-27.8175-27.634.8000114.4E171P167-E171 PolarHBondContact O-N 3.14Å
168E60Low59.2Low149 Ų149126.1 Ų126.170%0.69666%0.658SS**Hα-helixtrans-73.4-30.6175.5-69.3178.8153.600112.9S166 E171 L172S166-E168 PolarHBondContact O-N 3.43Å; E168-E171 PolarHBondContact O-N 3.32Å; E168-L172 PolarHBondContact O-N 3.37Å
169E61Low58.9Low99 Ų99131.4 Ų131.446%0.46367%0.674SS.*Hα-helixtrans-78.9-31.5176.9-65.1-178.4127.800111.8L165 S166 E171 L172 L173L165-E169 HydrophobicContact CB-CB 4.3Å; L165-E169 HydrophobicContact CD2-CB 4.2Å; L165-E169 WeakPolarHBondContact CD2-OE2 3.48Å; S166-E169 PolarHBondContact N-OE2 3.05Å; S166-E169 WeakPolarHBondContact O-CB 3.4Å; S166-E169 PolarHBondContact O-N 3.03Å; E169-E171 VanDerWaalsContact C-N 3.26Å; E169-E171 PolarHBondContact O-N 2.99Å; E169-L172 WeakPolarHBondContact O-CA 3.43Å; E169-L172 VanDerWaalsContact O-CB 3.26Å; E169-L172 WeakPolarHBondContact O-CB 3.49Å; E169-L172 PolarHBondContact O-N 2.96Å; E169-L172 VanDerWaalsContact O-N 3.1Å; E169-L173 PolarHBondContact O-N 2.97Å; E169-L173 VanDerWaalsContact O-N 3.09Å
170Q64.9Low59.3Low116 Ų116129.1 Ų129.154%0.54267%0.666SS.*Hα-helixtrans-63.1-35.6171.3-159.477.858.200111.3S166 L172 L173 D174S166-Q170 PolarHBondContact O-N 3Å; S166-Q170 VanDerWaalsContact O-N 3.16Å; Q170-L172 VanDerWaalsContact C-N 3.33Å; Q170-L173 PolarHBondContact O-N 3.5Å; Q170-D174 PolarHBondContact O-N 3.3Å
171E59.8Low59.6Low134 Ų134132.4 Ų132.463%0.62667%0.665SS**Hα-helixtrans-68.3-34.9173.1-146.6179.1-165.200110.9P167 E168 E169 L173 D174 F175P167-E171 PolarHBondContact O-N 3.14Å; E168-E171 PolarHBondContact O-N 3.32Å; E169-E171 VanDerWaalsContact C-N 3.26Å; E169-E171 PolarHBondContact O-N 2.99Å; E171-L173 PolarHBondContact O-N 2.71Å; E171-D174 WeakPolarHBondContact O-CB 3.48Å; E171-D174 PolarHBondContact O-N 3.05Å; E171-F175 WeakPolarHBondContact O-CD2 3.41Å; E171-F175 WeakPolarHBondContact O-CE2 3Å
172L60.7Low60Low124 Ų124133.3 Ų133.365%0.64966%0.657SS**Hα-helixtrans-62.3-38.8174.4-117.595.2000113.1E168 E169 Q170 D174 F175E168-L172 PolarHBondContact O-N 3.37Å; E169-L172 WeakPolarHBondContact O-CA 3.43Å; E169-L172 VanDerWaalsContact O-CB 3.26Å; E169-L172 WeakPolarHBondContact O-CB 3.49Å; E169-L172 PolarHBondContact O-N 2.96Å; E169-L172 VanDerWaalsContact O-N 3.1Å; Q170-L172 VanDerWaalsContact C-N 3.33Å; L172-D174 VanDerWaalsContact C-N 3.28Å; L172-D174 PolarHBondContact O-N 2.78Å; L172-F175 WeakPolarHBondContact O-CB 3.37Å; L172-F175 PolarHBondContact O-N 2.86Å
173L61.7Low60.5Low88 Ų88128.1 Ų128.146%0.46165%0.645SS.*Hα-helixtrans-67.3-28.8175.8-79.1162000112.6L165 E169 Q170 E171 F175 T176L165-L173 HydrophobicContact CD1-CD1 3.84Å; E169-L173 PolarHBondContact O-N 2.97Å; E169-L173 VanDerWaalsContact O-N 3.09Å; Q170-L173 PolarHBondContact O-N 3.5Å; E171-L173 PolarHBondContact O-N 2.71Å; L173-F175 PolarHBondContact O-N 3.22Å; L173-T176 PolarHBondContact O-N 2.93Å; L173-T176 PolarHBondContact O-OG1 3.2Å
174D58.5Low60.1Low108 Ų108127.4 Ų127.458%0.57864%0.639SS**Hα-helixtrans-70.6-20.4177.4-143.527.9000112.3Q170 E171 L172 T176 N177Q170-D174 PolarHBondContact O-N 3.3Å; E171-D174 WeakPolarHBondContact O-CB 3.48Å; E171-D174 PolarHBondContact O-N 3.05Å; L172-D174 VanDerWaalsContact C-N 3.28Å; L172-D174 PolarHBondContact O-N 2.78Å; D174-T176 VanDerWaalsContact C-N 3.28Å; D174-T176 PolarHBondContact O-N 3.15Å; D174-N177 PolarHBondContact O-N 2.85Å
175F53.5Low59.9Low150 Ų150128.3 Ų128.366%0.65863%0.632SS**G310 helixtrans-66.2-29170.9-74.1-92.5000112.9E171 L172 L173 N177E171-F175 WeakPolarHBondContact O-CD2 3.41Å; E171-F175 WeakPolarHBondContact O-CE2 3Å; L172-F175 WeakPolarHBondContact O-CB 3.37Å; L172-F175 PolarHBondContact O-N 2.86Å; L173-F175 PolarHBondContact O-N 3.22Å; F175-N177 VanDerWaalsContact C-N 3.3Å
176T59.5Low59.7Low95 Ų95130.9 Ų130.958%0.58364%0.642SS**G310 helixtrans-74.5-21177.9-4.20000112.8L173 D174 W178L173-T176 PolarHBondContact O-N 2.93Å; L173-T176 PolarHBondContact O-OG1 3.2Å; D174-T176 VanDerWaalsContact C-N 3.28Å; D174-T176 PolarHBondContact O-N 3.15Å; T176-W178 VanDerWaalsContact C-N 3.27Å; T176-W178 PolarHBondContact O-N 2.87Å
177N56.8Low59Low128 Ų128137.1 Ų137.168%0.68466%0.664SS**G310 helixtrans-84.64-178-72-5.2000113.9D174 F175D174-N177 PolarHBondContact O-N 2.85Å; F175-N177 VanDerWaalsContact C-N 3.3Å
178W59.5Low58.4Low214 Ų214139.3 Ų139.381%0.81166%0.66SS**G310 helixtrans-97-1177.1-165.6-87.5000113.7T176T176-W178 VanDerWaalsContact C-N 3.27Å; T176-W178 PolarHBondContact O-N 2.87Å
179F45.5Very low58.3Low266 Ų266138.4 Ų138.4100%1.16766%0.656SS**  trans-880169.4-96.6-77.7000112.5

Retrieved 179 of 179 residues in 152.3 ms (Link to these results)