A0A087WPM6_MOUSE Loading...

EF-hand calcium binding domain 15

AlphaFold DB , UniProt , Accession A0A087WPM6, Species MOUSE (Mus musculus, Mouse), Gene Efcab15, Length 191 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
1M46.3Very low53Low241 Ų241173.6 Ų173.6100%1.18788%0.881SS**  079.10-69.917016600105.5
2E44.5Very low53Low191 Ų191167.8 Ų167.889%0.89387%0.868SS**  45.2114.467.5-89.9-76.4102.400111.6
3G45.3Very low53.1Low76 Ų76163.3 Ų163.378%0.78486%0.856SS**  trans16956.6178.900000116.1
4S55.7Low52.4Low107 Ų107160.4 Ų160.475%0.74886%0.856SS**  trans-66.7158.9165.8-740000113.2
5R56.4Low52.5Low252 Ų252157.8 Ų157.895%0.95185%0.849SS**  trans137.3114151.9-75.5160.2-168.5-162.55.3108.5
6G55.3Low52.5Low73 Ų73159.2 Ų159.275%0.75386%0.855SS**  cis98.996.530.300000109.6
7Q61.9Low52.4Low207 Ų207163.3 Ų163.397%0.96786%0.855SS**  trans-141.5122.8158.6-71.6-164.469.100111.2
8K54Low52.4Low202 Ų202166.6 Ų166.688%0.87885%0.854SS**  trans-75.9145.6173.9-75.8165.7166.8170.20110.5
9T62.8Low52.7Low131 Ų131163.8 Ų163.880%0.80485%0.848SS**  trans-154.6111.9142.231.20000112.6
10K54Low52.8Low190 Ų190161.8 Ų161.883%0.82685%0.846SS**  trans50.2112.3134.7-55.9-175.1-179.9-178.80118.6
11R46.8Very low52.9Low240 Ų240162.3 Ų162.391%0.90684%0.844SS**  46124.286.6-75.4-168.1-174.7-154.72.2112.5
12S53.1Low53.5Low103 Ų103160.4 Ų160.472%0.7283%0.829SS**  cis-161.2-146.912.7-65.50000109.7
13P54.6Low54.2Low110 Ų110157.4 Ų157.471%0.71483%0.826SS**  -103.1165.9-124.131.1-9.2000113.2
14S42.4Very low54.7Low123 Ų123164.3 Ų164.386%0.8683%0.829SS**  trans-134.492.1166.1-64.10000109.7L16S14-L16 PolarHBondContact O-N 3.03Å
15T54.9Low53.9Low121 Ų121166.4 Ų166.474%0.74283%0.831SS**  trans-53.3112.9162.928.80000109.9R17T15-R17 PolarHBondContact O-N 3.18Å
16L52.2Low53.5Low180 Ų180160.6 Ų160.694%0.94282%0.818SS**  trans-66.797167.5-168.773.7000108.5S14S14-L16 PolarHBondContact O-N 3.03Å
17R50.1Low52.8Low229 Ų229164.2 Ų164.286%0.86482%0.819SS**  trans-75.5122.6172.3-78.6-170170.4-136.30.9110T15T15-R17 PolarHBondContact O-N 3.18Å
18R53Low52.3Low222 Ų222159.7 Ų159.784%0.83881%0.806SS**  trans-66.7153.3165.3-84.9179.1161.9-169.4-4.3112
19P58Low51.9Low114 Ų114161.2 Ų161.274%0.7481%0.806SS**  trans-109.3167.9145.315.93.2000112.7
20P54.1Low50.8Low124 Ų124162.6 Ų162.681%0.80581%0.809SS**PPolyproline II helixtrans-98.7154.4-135.936.8-36.3000115.6
21Q55.7Low50.3Low172 Ų172158 Ų15880%0.80481%0.806SS**PPolyproline II helixtrans-80.5138.6168.2-66.8-160.6-15.300111.1
22K59.2Low50Low202 Ų202157 Ų15788%0.87881%0.809SS**PPolyproline II helixtrans-69.3137.3170.5-76.8176.7177177.90110.2
23P58.9Low49.6Very low127 Ų127161 Ų16183%0.82581%0.813SS**PPolyproline II helixtrans-76.1136.7-17728.1-32.1000112.7
24R55.5Low49.1Very low222 Ų222163.4 Ų163.484%0.83882%0.815SS**PPolyproline II helixtrans-68.5127.6164-70.3164.874.4161.71.8108.4
25N38.2Very low48.9Very low150 Ų150166 Ų16680%0.80281%0.813SS**  trans-92.9104.4167.4-159.4-12.8000108.8
26I49.3Very low48.1Very low131 Ų131165.1 Ų165.167%0.67282%0.818SS**  trans-109114.1162.9-73.9167.1000104.8
27L41.2Very low47.2Very low148 Ų148160 Ų16078%0.77581%0.81SS**  trans-151.893.7163.1-156.572.2000107.6
28T49.6Very low46.8Very low112 Ų112159.3 Ų159.369%0.68781%0.807SS**  85.3109.1101.3-47.20000111.8
29R46.1Very low46.4Very low234 Ų234156 Ų15688%0.88381%0.811SS**  trans-62.7130.5158.5-70167101.7142.61107.3
30D39.2Very low45.9Very low161 Ų161156.7 Ų156.786%0.86181%0.805SS**  trans178.7161.2130.4-93-45.7000111.1
31A43.9Very low45.4Very low94 Ų94160.5 Ų160.578%0.77781%0.808SS**  trans92.281.9168.800000117.8K33A31-K33 PolarHBondContact O-N 3.4Å
32F41Very low44.5Very low218 Ų218156.4 Ų156.496%0.95681%0.812SS**  trans-55.1119.4143-131.3-101000109.4
33K43.9Very low43.7Very low187 Ų187158.5 Ų158.581%0.81382%0.815SS**  trans-157.7116.3152.3-154.6172.2178.9-166.50112.8A31A31-K33 PolarHBondContact O-N 3.4Å
34E44.1Very low42.6Very low161 Ų161159.2 Ų159.275%0.75282%0.817SS**  trans-22.5133.9152-166.8-160118.800116.3
35Q39.2Very low42.1Very low176 Ų176156.9 Ų156.982%0.82282%0.815SS**  -167.7141.4127.8-108.1161.1-13.400114.2
36A37.2Very low42.4Very low103 Ų103153.9 Ų153.985%0.85180%0.804SS**  trans-74.6165.3-17300000114.8
37G34.9Very low41.7Very low74 Ų74155.7 Ų155.776%0.76381%0.809SS**  trans148.4104.2143.100000118.2
38R40.7Very low41.5Very low214 Ų214157 Ų15781%0.80882%0.815SS**  trans89.896.9131.7-138.8178.7-154-152.95.5118.6Q40R38-Q40 HydrophobicContact CG-CG 4.45Å
39V44.2Very low40.9Very low152 Ų152154.9 Ų154.992%0.92182%0.816SS**  trans-120.5132.9143.3160.30000108.2
40Q48.8Very low40.6Very low129 Ų129153.1 Ų153.160%0.60382%0.818SS**  trans-95.4136.3-175.6-67.4-174.556.200112R38R38-Q40 HydrophobicContact CG-CG 4.45Å
41K43.6Very low40.7Very low204 Ų204154.7 Ų154.789%0.88782%0.82SS**  trans48.2108.8139.7-69.6-178.6175.31780119.9
42G36.9Very low40.5Very low86 Ų86155.4 Ų155.489%0.88782%0.819SS**  trans-156.397.8146.800000109.4
43R41.8Very low40.4Very low245 Ų245153 Ų15393%0.92581%0.811SS**  trans-103.2119.5179.7172.9-172.9-169.3168.64.3108.3
44V34.9Very low40.2Very low143 Ų143149.9 Ų149.987%0.86781%0.812SS**  trans-152.6117.8142.7-177.30000108.9
45Q44.8Very low39.7Very low172 Ų172148 Ų14880%0.80481%0.808SS**  trans-106.3177153.6-106.2-173.45800106.3
46P45.3Very low39.9Very low87 Ų87148.3 Ų148.357%0.56581%0.814SS**  cis-121.7-173.2-5.111.717000108.9
47Q34.5Very low39.7Very low169 Ų169147.4 Ų147.479%0.7982%0.815SS**  -172134.553.3-40.1-102.1-24.900105.4
48I37.8Very low39.7Very low176 Ų176149 Ų14990%0.90382%0.82SS**  trans-132.5120.5158.5-61179.5000107.1
49G35.4Very low39.7Very low67 Ų67143.1 Ų143.169%0.69182%0.817SS**  trans-65.6148-173.200000113.1Q51G49-Q51 PolarHBondContact O-N 3.13Å
50Q41Very low39.5Very low198 Ų198142 Ų14293%0.92581%0.811SS**  trans-61.1124.5165.3-61.8176.3-42.300108.5
51Q40Very low39Very low193 Ų193142.7 Ų142.790%0.90282%0.824SS**  trans-108100.5172.4-156.3163.2-36.800109.5G49G49-Q51 PolarHBondContact O-N 3.13Å
52S39.6Very low38.7Very low109 Ų109138.2 Ų138.276%0.76281%0.814SS**  trans5.4116.3156-55.50000119.3
53Q38.9Very low38.9Very low168 Ų168142.8 Ų142.879%0.78581%0.81SS**  trans-48.4126.8147.5-169.1173.9-2.300111D55Q53-D55 WeakPolarHBondContact CG-OD2 3.17Å; Q53-D55 PolarHBondContact NE2-OD2 2.92Å
54S41.6Very low38.9Very low121 Ų121138.6 Ų138.685%0.84680%0.801SS**  trans-113.794.8164.740.50000108.2
55D33.1Very low39.2Very low123 Ų123139.2 Ų139.266%0.65879%0.794SS**  trans-79.8117.9165.3-99.4-84.7000108.7Q53Q53-D55 WeakPolarHBondContact CG-OD2 3.17Å; Q53-D55 PolarHBondContact NE2-OD2 2.92Å
56L42Very low39.2Very low182 Ų182135.4 Ų135.495%0.95379%0.792SS**  trans-157.1105.7160.4-112.8123.3000109.1
57G33.1Very low39.2Very low84 Ų84138.2 Ų138.287%0.86680%0.802SS**  trans156.756.5169.900000116.3
58A35Very low39.6Very low107 Ų107138.4 Ų138.488%0.88481%0.807SS**  trans-132.294.5163.500000109.5
59A42.1Very low40.4Very low90 Ų90140.6 Ų140.674%0.74480%0.804SS**  trans-12699.7164.800000109
60T39.1Very low40.9Very low129 Ų129146 Ų14679%0.79181%0.814SS**  trans49.999.413860.80000118.9T62T60-T62 PolarHBondContact O-N 3.27Å
61T38.3Very low41.5Very low143 Ų143148 Ų14888%0.87781%0.813SS**  trans-62.4116.9146.8-63.70000109.7
62T37.4Very low41.6Very low110 Ų110146.6 Ų146.668%0.67581%0.811SS**  trans-163.4129.5143.8-14.40000112.9T60T60-T62 PolarHBondContact O-N 3.27Å
63K41.6Very low41.9Very low183 Ų183149.3 Ų149.380%0.79682%0.816SS**  trans78.4115.3147.7-76.1168.2-176.3-174.10120.8
64E42.2Very low41.9Very low157 Ų157150.4 Ų150.473%0.73482%0.819SS**  79.5111.1124-66.3-91.6102.600118.6
65E41Very low42.1Very low155 Ų155151.6 Ų151.672%0.72482%0.816SS**  60.697.9119.8-59.2-102110.100118
66A43.4Very low42.5Very low93 Ų93150.7 Ų150.777%0.76982%0.816SS**  trans-148.669.7146.600000111.1L68A66-L68 PolarHBondContact O-N 3.02Å
67L45.1Very low42.4Very low146 Ų146145.9 Ų145.976%0.76480%0.798SS**  32.291.7122.8-126.2154.5000117R69L67-R69 HydrophobicContact CD2-CB 4.19Å
68L43.1Very low42.6Very low173 Ų173150.8 Ų150.891%0.90680%0.798SS**  trans-120.974.4159.2-91.5157.7000109.7A66A66-L68 PolarHBondContact O-N 3.02Å
69R54.8Low43.1Very low222 Ų222149.9 Ų149.984%0.83879%0.791SS**  trans-104.796.4163.2-88.1-87.3-177.2101.63.2107.5L67L67-R69 HydrophobicContact CD2-CB 4.19Å
70M47.5Very low43Very low180 Ų180153.3 Ų153.389%0.88780%0.797SS**  trans-150.395.7151.7-72.7-163.9-75.300109
71R52.2Low43Very low241 Ų241155.1 Ų155.191%0.90980%0.796SS**  trans-97.1119.3146.8-70.1-177.1-169.3130.61.6104.6
72D42.7Very low43.4Very low163 Ų163153.3 Ų153.387%0.87279%0.787SS**  trans-152.8135.1152.5-91.1-52.4000110.7
73L45.4Very low42.9Very low165 Ų165157 Ų15786%0.86479%0.79SS**  trans-59133-179.9-90.553.5000112.3
74K38.9Very low42.8Very low192 Ų192159.6 Ų159.684%0.83580%0.795SS**  trans-161.7106.5130.8-148.165.6160-172.50111.7P76K74-P76 WeakPolarHBondContact O-CD 3.14Å
75N45.3Very low42.8Very low146 Ų146156.7 Ų156.778%0.78179%0.792SS**  trans-62.6130.5154.6-173.28.6000108.1S77N75-S77 PolarHBondContact OD1-N 3.06Å; N75-S77 VanDerWaalsContact OD1-N 3.13Å
76P42.8Very low42.8Very low104 Ų104151.8 Ų151.868%0.67578%0.783SS**  -138.4125.612131.9-16.4000112.9K74K74-P76 WeakPolarHBondContact O-CD 3.14Å
77S39.3Very low43.4Very low81 Ų81153.6 Ų153.657%0.56679%0.786SS**  trans40.1121.2136.168.50000119.9N75N75-S77 PolarHBondContact OD1-N 3.06Å; N75-S77 VanDerWaalsContact OD1-N 3.13Å
78E37.5Very low43.4Very low186 Ų186154.2 Ų154.287%0.86979%0.791SS**  trans90.5129.1134.3-75.6175.1106.300120.2
79A45.1Very low43.7Very low89 Ų89152.9 Ų152.974%0.73679%0.785SS**  trans79.184.7152.900000118.1
80N39.7Very low43.1Very low162 Ų162152.1 Ų152.187%0.86678%0.781SS**  158.6103103.1-101.3-43.7000111.7
81Q39.2Very low43.5Very low167 Ų167148.6 Ų148.678%0.7878%0.775SS**  trans179.8140.5147.5-93.5-78.4-34.500103.7
82P47.1Very low42.9Very low104 Ų104144.6 Ų144.668%0.67577%0.766SS**  cis-142.815131.437.7-17.7000115.3
83Y27.5Very low43.3Very low189 Ų189142.8 Ų142.874%0.74177%0.767SS**  trans-145.498.8156.6-166.2-109.4000109.8S85Y83-S85 WeakPolarHBondContact CD1-OG 3.28Å; Y83-S85 WeakPolarHBondContact CE1-OG 3.49Å; Y83-S85 PolarHBondContact O-N 3.04Å
84W38.9Very low43.1Very low237 Ų237139.3 Ų139.390%0.89876%0.756SS**  trans-70104.1156.1-69.896.3000106.5
85S43Very low43.5Very low96 Ų96135.6 Ų135.667%0.67176%0.761SS**  trans-64.2133.2169-65.70000109.5Y83Y83-S85 WeakPolarHBondContact CD1-OG 3.28Å; Y83-S85 WeakPolarHBondContact CE1-OG 3.49Å; Y83-S85 PolarHBondContact O-N 3.04Å
86G40.3Very low43.6Very low52 Ų52133.4 Ų133.454%0.53675%0.749SS.*  trans-79.2-153.3-167.600000117
87P55.3Low44.2Very low130 Ų130135.3 Ų135.384%0.84475%0.754SS**  trans-93.5135.8-139.235.6-34.4000113.9D89P87-D89 PolarHBondContact O-N 3.42Å
88D46.3Very low45Very low160 Ų160135.2 Ų135.286%0.85675%0.753SS**  trans-85.8106.8165.2-34.4-51.4000108.4R90D88-R90 PolarHBondContact O-N 3.45Å
89D47.8Very low45.9Very low145 Ų145129.5 Ų129.578%0.77573%0.728SS**  trans-63.4102.9164-167.1-77.4000108.7P87P87-D89 PolarHBondContact O-N 3.42Å
90R43.6Very low46.7Very low205 Ų205131.6 Ų131.677%0.77473%0.726SS**  trans-131.592.2154.5-163.3174.3-173-177.11.4108.3D88 Q92D88-R90 PolarHBondContact O-N 3.45Å; R90-Q92 PolarHBondContact O-N 2.94Å
91S54.6Low48.2Very low106 Ų106129.9 Ų129.974%0.74172%0.724SS**  trans-43.9106.2159-71.30000110.4
92Q41.2Very low50.2Low158 Ų158124.3 Ų124.374%0.73870%0.699SS**  trans-120.6104.2157.3-79.9-171.6-40.500107.6R90 S94R90-Q92 PolarHBondContact O-N 2.94Å; Q92-S94 PolarHBondContact O-N 3.36Å
93S50.5Low52.2Low125 Ų125122.6 Ų122.687%0.87469%0.687SS**  trans-47126.7154.6167.40000110
94S41.1Very low55Low91 Ų91119 Ų11964%0.63669%0.687SS**  trans-178.5122.2141.7174.70000108Q92 D96Q92-S94 PolarHBondContact O-N 3.36Å; S94-D96 PolarHBondContact O-N 3.1Å
95A46.8Very low57.3Low114 Ų114118.1 Ų118.194%0.94268%0.683SS**SBendtrans-72.159.6176.900000112
96D47.7Very low59.5Low101 Ų101118 Ų11854%0.5467%0.672SS.*  trans-139.543.4-175.2-147.9-97.2000111.7S94S94-D96 PolarHBondContact O-N 3.1Å
97D54.7Low61.8Low144 Ų144118.4 Ų118.477%0.7766%0.662SS**  trans-11315.4-179.7-150.5-101.5000113.4
98S57Low63.3Low78 Ų78114.3 Ų114.355%0.54564%0.639SS.*SBendtrans-96-2.1175.1-59.20000113.9T171S98-T171 PolarHBondContact O-OG1 2.49Å
99L57.1Low65.4Low67 Ų67109 Ų10935%0.35162%0.617SS.*SBendtrans-11377172.2-62.3178.4000108.6L167L99-L167 HydrophobicContact CD2-CB 4.09Å; L99-L167 HydrophobicContact CD2-CD2 4.36Å
100L60.5Low67.3Low132 Ų132104.1 Ų104.169%0.69159%0.589SS**  trans-42.4136.7160.7-62.8176.6000108.1L102L100-L102 VanDerWaalsContact C-N 3.35Å; L100-L102 PolarHBondContact O-N 3.01Å
101P72.9Confident69.5Low127 Ų12798.4 Ų98.483%0.82557%0.571SS**  trans-60.297.2-170.720.6-30.9000110.3T103P101-T103 PolarHBondContact O-N 3.25Å
102L80Confident71.1Confident49 Ų4997.7 Ų97.726%0.25756%0.559SS.*  trans-67.9132.2179.5-66.7-179.8000107.9L100 Q106 F110 L167 T171L100-L102 VanDerWaalsContact C-N 3.35Å; L100-L102 PolarHBondContact O-N 3.01Å; L102-Q106 HydrophobicContact CB-CB 4.45Å; L102-F110 HydrophobicContact CD1-CD2 3.92Å; L102-F110 HydrophobicContact CD1-CE2 3.89Å; L102-F110 HydrophobicContact CD2-CE2 4.11Å; L102-L167 HydrophobicContact CD1-CD2 3.52Å; L102-L167 HydrophobicContact CD1-CG 4.16Å; L102-T171 HydrophobicContact CD1-CG2 4.1Å; L102-T171 HydrophobicContact CD2-CG2 4.21Å
103T89.1Confident73.3Confident69 Ų6993.3 Ų93.342%0.42354%0.54SS..  trans-63.6152.6173.862.40000110.1P101 R105 Q106 L107P101-T103 PolarHBondContact O-N 3.25Å; T103-R105 PolarHBondContact O-N 2.79Å; T103-R105 VanDerWaalsContact O-N 3.07Å; T103-Q106 WeakPolarHBondContact O-CB 3.39Å; T103-Q106 PolarHBondContact O-N 2.89Å; T103-Q106 VanDerWaalsContact OG1-CD 3.28Å; T103-Q106 VanDerWaalsContact OG1-CG 3.29Å; T103-Q106 WeakPolarHBondContact OG1-CG 2.84Å; T103-Q106 PolarHBondContact OG1-N 3.24Å; T103-Q106 PolarHBondContact OG1-OE1 3.16Å; T103-L107 PolarHBondContact O-N 3.43Å
104P87.1Confident75.1Confident113 Ų11388.2 Ų88.273%0.73450%0.502SS*.Hα-helixtrans-54.2-33.4177.6-27.834.8000113.3L107 A108P104-L107 PolarHBondContact O-N 2.96Å; P104-A108 WeakPolarHBondContact O-CB 3.28Å; P104-A108 PolarHBondContact O-N 3.31Å
105R87.1Confident77.3Confident219 Ų21989.6 Ų89.683%0.82650%0.497SS*.Hα-helixtrans-68.2-40.2176.7-172179.2-178.9-147.5-0.2112.5T103 A109T103-R105 PolarHBondContact O-N 2.79Å; T103-R105 VanDerWaalsContact O-N 3.07Å; R105-A109 PolarHBondContact O-N 3.19Å; R105-A109 VanDerWaalsContact O-N 3.12Å
106Q88.8Confident79Confident92 Ų9289.9 Ų89.943%0.4348%0.482SS..Hα-helixtrans-67.3-43.5174.9-74.5163.8-40.200110.6L102 T103 A108 A109 F110L102-Q106 HydrophobicContact CB-CB 4.45Å; T103-Q106 WeakPolarHBondContact O-CB 3.39Å; T103-Q106 PolarHBondContact O-N 2.89Å; T103-Q106 VanDerWaalsContact OG1-CD 3.28Å; T103-Q106 VanDerWaalsContact OG1-CG 3.29Å; T103-Q106 WeakPolarHBondContact OG1-CG 2.84Å; T103-Q106 PolarHBondContact OG1-N 3.24Å; T103-Q106 PolarHBondContact OG1-OE1 3.16Å; Q106-A108 VanDerWaalsContact C-N 3.31Å; Q106-A108 PolarHBondContact O-N 3.41Å; Q106-A109 WeakPolarHBondContact O-CB 3.32Å; Q106-A109 PolarHBondContact O-N 2.97Å; Q106-A109 VanDerWaalsContact O-N 3.11Å; Q106-F110 HydrophobicContact CB-CD2 4.49Å; Q106-F110 HydrophobicContact CB-CE2 4.3Å; Q106-F110 WeakPolarHBondContact O-CD2 3.16Å; Q106-F110 PolarHBondContact O-N 2.91Å
107L88.2Confident80.6Confident62 Ų6287.7 Ų87.733%0.32547%0.468SS..Hα-helixtrans-58.6-43.9177.1-17165.5000111.7T103 P104 A109 F110 Q111 F163 L167T103-L107 PolarHBondContact O-N 3.43Å; P104-L107 PolarHBondContact O-N 2.96Å; L107-A109 VanDerWaalsContact C-N 3.35Å; L107-A109 PolarHBondContact O-N 3.29Å; L107-F110 PolarHBondContact O-N 3.37Å; L107-Q111 WeakPolarHBondContact O-CG 3.36Å; L107-Q111 PolarHBondContact O-N 3.35Å; L107-F163 HydrophobicContact CD1-CE1 3.77Å; L107-F163 HydrophobicContact CD1-CZ 3.85Å; L107-L167 HydrophobicContact CD1-CD2 3.8Å
108A88.3Confident82Confident44 Ų4481.8 Ų81.836%0.36444%0.437SS..Hα-helixtrans-60.3-43.4174.600000112P104 Q106 F110 Q111 D112P104-A108 WeakPolarHBondContact O-CB 3.28Å; P104-A108 PolarHBondContact O-N 3.31Å; Q106-A108 VanDerWaalsContact C-N 3.31Å; Q106-A108 PolarHBondContact O-N 3.41Å; A108-F110 PolarHBondContact O-N 3.47Å; A108-Q111 PolarHBondContact O-N 3.44Å; A108-D112 PolarHBondContact O-N 2.98Å
109A88.8Confident83Confident49 Ų4981.7 Ų81.741%0.40544%0.436SS..Hα-helixtrans-61.5-43.2175.700000112R105 Q106 L107 Q111 D112 I113R105-A109 PolarHBondContact O-N 3.19Å; R105-A109 VanDerWaalsContact O-N 3.12Å; Q106-A109 WeakPolarHBondContact O-CB 3.32Å; Q106-A109 PolarHBondContact O-N 2.97Å; Q106-A109 VanDerWaalsContact O-N 3.11Å; L107-A109 VanDerWaalsContact C-N 3.35Å; L107-A109 PolarHBondContact O-N 3.29Å; A109-Q111 VanDerWaalsContact C-N 3.35Å; A109-Q111 PolarHBondContact O-N 3.3Å; A109-D112 PolarHBondContact O-N 3.41Å; A109-I113 VanDerWaalsContact O-CG1 3.25Å; A109-I113 WeakPolarHBondContact O-CG1 3.37Å; A109-I113 PolarHBondContact O-N 2.81Å
110F89.3Confident83.8Confident42 Ų4279.7 Ų79.718%0.18443%0.428CS..Hα-helixtrans-64.8-37.3175.4-72.7-64.3000112.6L102 Q106 L107 A108 I113 F114 F163 L167 L170 T171L102-F110 HydrophobicContact CD1-CD2 3.92Å; L102-F110 HydrophobicContact CD1-CE2 3.89Å; L102-F110 HydrophobicContact CD2-CE2 4.11Å; Q106-F110 HydrophobicContact CB-CD2 4.49Å; Q106-F110 HydrophobicContact CB-CE2 4.3Å; Q106-F110 WeakPolarHBondContact O-CD2 3.16Å; Q106-F110 PolarHBondContact O-N 2.91Å; L107-F110 PolarHBondContact O-N 3.37Å; A108-F110 PolarHBondContact O-N 3.47Å; F110-I113 PolarHBondContact O-N 2.91Å; F110-F114 WeakPolarHBondContact O-CB 3.5Å; F110-F114 PolarHBondContact O-N 2.98Å; F110-F163 HydrophobicContact CB-CE2 4.28Å; F110-F163 HydrophobicContact CB-CZ 4.29Å; F110-L167 HydrophobicContact CB-CD1 3.89Å; F110-L167 HydrophobicContact CG-CD1 4.36Å; F110-L170 HydrophobicContact CD1-CD1 3.78Å; F110-L170 HydrophobicContact CE1-CB 4.05Å; F110-L170 HydrophobicContact CE1-CD1 3.84Å; F110-T171 HydrophobicContact CZ-CG2 4.46Å
111Q88.9Confident84.2Confident84 Ų8479.9 Ų79.939%0.39344%0.437SS..Hα-helixtrans-63.8-41.4174.1-75.7-177.20.200112.1L107 A108 A109 I113 F114 K115 F163L107-Q111 WeakPolarHBondContact O-CG 3.36Å; L107-Q111 PolarHBondContact O-N 3.35Å; A108-Q111 PolarHBondContact O-N 3.44Å; A109-Q111 VanDerWaalsContact C-N 3.35Å; A109-Q111 PolarHBondContact O-N 3.3Å; Q111-I113 VanDerWaalsContact C-N 3.34Å; Q111-F114 PolarHBondContact O-N 3.22Å; Q111-K115 VanDerWaalsContact O-CG 3.31Å; Q111-K115 WeakPolarHBondContact O-CG 3.18Å; Q111-K115 PolarHBondContact O-N 3.04Å; Q111-F163 HydrophobicContact CB-CE2 4.29Å; Q111-F163 HydrophobicContact CB-CZ 4.31Å; Q111-F163 HydrophobicContact CG-CE1 3.99Å; Q111-F163 HydrophobicContact CG-CE2 3.67Å; Q111-F163 HydrophobicContact CG-CZ 3.31Å
112D89Confident84.2Confident91 Ų9178.2 Ų78.249%0.48742%0.424SS..Hα-helixtrans-67.5-38.7178.7-71.8-20.1000111.5A108 A109 K115 L116A108-D112 PolarHBondContact O-N 2.98Å; A109-D112 PolarHBondContact O-N 3.41Å; D112-K115 PolarHBondContact O-N 3.33Å; D112-K115 IonicContact OD1-NZ 2.85Å; D112-K115 PolarHBondContact OD1-NZ 3.35Å; D112-L116 PolarHBondContact O-N 3.19Å
113I87.6Confident84Confident66 Ų6677.9 Ų77.934%0.33843%0.433SS..Hα-helixtrans-62.7-47.6171.1-62.6165.2000109.8A109 F110 Q111 K115 L116 F117 F166A109-I113 VanDerWaalsContact O-CG1 3.25Å; A109-I113 WeakPolarHBondContact O-CG1 3.37Å; A109-I113 PolarHBondContact O-N 2.81Å; F110-I113 PolarHBondContact O-N 2.91Å; Q111-I113 VanDerWaalsContact C-N 3.34Å; I113-K115 VanDerWaalsContact C-N 3.26Å; I113-K115 PolarHBondContact O-N 3.39Å; I113-L116 WeakPolarHBondContact O-CA 3.2Å; I113-L116 VanDerWaalsContact O-CB 3.25Å; I113-L116 WeakPolarHBondContact O-CB 3.29Å; I113-L116 PolarHBondContact O-N 2.85Å; I113-F117 HydrophobicContact CG2-CD2 3.88Å; I113-F117 HydrophobicContact CG2-CE2 3.56Å; I113-F117 VanDerWaalsContact O-CD2 3.26Å; I113-F117 WeakPolarHBondContact O-CD2 3.29Å; I113-F117 PolarHBondContact O-N 3.33Å; I113-F166 HydrophobicContact CB-CZ 4.39Å; I113-F166 HydrophobicContact CG2-CE1 4.34Å; I113-F166 HydrophobicContact CG2-CZ 3.72Å
114F87.6Confident83.7Confident18 Ų1876 Ų768%0.07942%0.421CS..Hα-helixtrans-56.3-40.2179.7-175.7-99.4000112.3F110 Q111 L116 F117 S118 G123 V125 F163 F166F110-F114 WeakPolarHBondContact O-CB 3.5Å; F110-F114 PolarHBondContact O-N 2.98Å; Q111-F114 PolarHBondContact O-N 3.22Å; F114-L116 PolarHBondContact O-N 3.15Å; F114-F117 CarbonylContact O-C 3.49Å; F114-F117 WeakPolarHBondContact O-CA 3.49Å; F114-F117 PolarHBondContact O-N 2.9Å; F114-S118 WeakPolarHBondContact O-CB 3.37Å; F114-S118 PolarHBondContact O-N 3.38Å; F114-S118 PolarHBondContact O-OG 3.41Å; F114-G123 WeakPolarHBondContact CE1-O 3.5Å; F114-V125 HydrophobicContact CD2-CG2 4.05Å; F114-V125 HydrophobicContact CE2-CG2 3.55Å; F114-V125 HydrophobicContact CZ-CG2 3.99Å; F114-F163 HydrophobicContact CB-CD2 3.79Å; F114-F163 HydrophobicContact CB-CE2 4Å; F114-F163 HydrophobicContact CD1-CD2 4.05Å; F114-F163 AromaticContact CD2-CD2 3.92Å; F114-F163 HydrophobicContact CD2-CD2 3.92Å; F114-F163 HydrophobicContact CE1-CB 4.33Å; F114-F163 HydrophobicContact CE2-CB 4.29Å; F114-F163 HydrophobicContact CE2-CD2 4.49Å; F114-F163 AromaticContact CG-CD2 3.66Å; F114-F163 HydrophobicContact CG-CD2 3.66Å; F114-F163 HydrophobicContact CG-CE2 4.37Å; F114-F163 HydrophobicContact CZ-CB 4.19Å; F114-F166 HydrophobicContact CB-CD1 4.13Å; F114-F166 HydrophobicContact CB-CE1 4.05Å; F114-F166 HydrophobicContact CD2-CB 3.79Å; F114-F166 AromaticContact CD2-CD1 3.79Å; F114-F166 HydrophobicContact CD2-CD1 3.79Å; F114-F166 HydrophobicContact CD2-CD2 4.15Å; F114-F166 HydrophobicContact CD2-CE1 4.37Å; F114-F166 AromaticContact CD2-CG 3.65Å; F114-F166 HydrophobicContact CD2-CG 3.65Å; F114-F166 HydrophobicContact CE2-CB 3.98Å; F114-F166 HydrophobicContact CE2-CG 4.3Å; F114-F166 HydrophobicContact CG-CD1 4.44Å
115K86.6Confident83.5Confident121 Ų12171 Ų7153%0.52639%0.388SS..Hα-helixtrans-60.7-30.3174.7-69.4167.4-162159.30113.4Q111 D112 I113 F117Q111-K115 VanDerWaalsContact O-CG 3.31Å; Q111-K115 WeakPolarHBondContact O-CG 3.18Å; Q111-K115 PolarHBondContact O-N 3.04Å; D112-K115 PolarHBondContact O-N 3.33Å; D112-K115 IonicContact OD1-NZ 2.85Å; D112-K115 PolarHBondContact OD1-NZ 3.35Å; I113-K115 VanDerWaalsContact C-N 3.26Å; I113-K115 PolarHBondContact O-N 3.39Å; K115-F117 VanDerWaalsContact C-N 3.28Å
116L83.3Confident83.4Confident119 Ų11962.8 Ų62.862%0.62336%0.361SS*.Hα-helixtrans-69-31.1173.5-59.9173.4000111.6D112 I113 F114D112-L116 PolarHBondContact O-N 3.19Å; I113-L116 WeakPolarHBondContact O-CA 3.2Å; I113-L116 VanDerWaalsContact O-CB 3.25Å; I113-L116 WeakPolarHBondContact O-CB 3.29Å; I113-L116 PolarHBondContact O-N 2.85Å; F114-L116 PolarHBondContact O-N 3.15Å
117F81.8Confident83.2Confident56 Ų5662.4 Ų62.425%0.24636%0.36CS..Hα-helixtrans-87.7-23.9178.6-72-85.3000113.7I113 F114 K115 V125 S129 A133 F166I113-F117 HydrophobicContact CG2-CD2 3.88Å; I113-F117 HydrophobicContact CG2-CE2 3.56Å; I113-F117 VanDerWaalsContact O-CD2 3.26Å; I113-F117 WeakPolarHBondContact O-CD2 3.29Å; I113-F117 PolarHBondContact O-N 3.33Å; F114-F117 CarbonylContact O-C 3.49Å; F114-F117 WeakPolarHBondContact O-CA 3.49Å; F114-F117 PolarHBondContact O-N 2.9Å; K115-F117 VanDerWaalsContact C-N 3.28Å; F117-V125 HydrophobicContact CB-CG2 3.81Å; F117-S129 CarbonylContact O-C 3.15Å; F117-S129 WeakPolarHBondContact O-CB 3.3Å; F117-A133 HydrophobicContact CB-CB 4.4Å; F117-A133 HydrophobicContact CD1-CB 3.24Å; F117-A133 HydrophobicContact CE1-CB 3.61Å; F117-A133 HydrophobicContact CG-CB 3.98Å; F117-F166 HydrophobicContact CD2-CE2 4.08Å; F117-F166 HydrophobicContact CD2-CZ 4.17Å; F117-F166 HydrophobicContact CE2-CE2 4.44Å; F117-F166 HydrophobicContact CE2-CZ 4.44Å
118S83.4Confident83.1Confident19 Ų1964.4 Ų64.413%0.13337%0.368CS..  trans-102.462-174.972.70000112.7F114 S120F114-S118 WeakPolarHBondContact O-CB 3.37Å; F114-S118 PolarHBondContact O-N 3.38Å; F114-S118 PolarHBondContact O-OG 3.41Å; S118-S120 PolarHBondContact O-N 2.72Å
119C78Confident83Confident76 Ų7662.5 Ų62.551%0.51435%0.352SS..  trans-72.3-10.7177.9-70.40000114.1S129C119-S129 PolarHBondContact N-OG 2.9Å
120S74.3Confident82.8Confident26 Ų2661.2 Ų61.218%0.18234%0.338CS..SBendtrans-70.2145.5177.1175.90000112.2S118 T122 G123 S129S118-S120 PolarHBondContact O-N 2.72Å; S120-T122 PolarHBondContact O-N 3.28Å; S120-T122 PolarHBondContact OG-N 3.06Å; S120-T122 PolarHBondContact OG-OG1 3.44Å; S120-G123 PolarHBondContact O-N 2.93Å; S120-S129 WeakPolarHBondContact CB-OG 3.18Å; S120-S129 PolarHBondContact N-OG 3.43Å
121P68.1Low82.6Confident135 Ų13565 Ų6588%0.87735%0.354SS*.THydrogen-bonded Turntrans-61.3-14.5174.426.8-37.2000114.2G123P121-G123 VanDerWaalsContact C-N 3.26Å
122T72.9Confident82.5Confident92 Ų9264.6 Ų64.656%0.56435%0.354SS*.THydrogen-bonded Turntrans-75.8-13.817651.70000113.2S120 T124S120-T122 PolarHBondContact O-N 3.28Å; S120-T122 PolarHBondContact OG-N 3.06Å; S120-T122 PolarHBondContact OG-OG1 3.44Å; T122-T124 WeakPolarHBondContact CB-OG1 3.32Å; T122-T124 PolarHBondContact O-N 3.41Å; T122-T124 PolarHBondContact OG1-OG1 2.82Å
123G76Confident82.3Confident42 Ų4260.7 Ų60.743%0.43333%0.334SS..SBendtrans67.721.2-175.200000113F114 S120 P121F114-G123 WeakPolarHBondContact CE1-O 3.5Å; S120-G123 PolarHBondContact O-N 2.93Å; P121-G123 VanDerWaalsContact C-N 3.26Å
124T81.8Confident82.2Confident31 Ų3158.4 Ų58.419%0.1932%0.323CS..SBendtrans-120.2158.8178.958.80000110.6T122 D126 I160T122-T124 WeakPolarHBondContact CB-OG1 3.32Å; T122-T124 PolarHBondContact O-N 3.41Å; T122-T124 PolarHBondContact OG1-OG1 2.82Å; T124-D126 PolarHBondContact O-N 2.76Å; T124-I160 HydrophobicContact CG2-CG2 3.6Å; T124-I160 WeakPolarHBondContact OG1-CG2 3.44Å
125V84.9Confident82Confident6 Ų666.7 Ų66.74%0.03635%0.354CS..BIsolated β-bridgetrans-89.7101.3176.3177.20000108.3F114 F117 M130 V161F114-V125 HydrophobicContact CD2-CG2 4.05Å; F114-V125 HydrophobicContact CE2-CG2 3.55Å; F114-V125 HydrophobicContact CZ-CG2 3.99Å; F117-V125 HydrophobicContact CB-CG2 3.81Å; V125-M130 HydrophobicContact CG1-CB 4.1Å; V125-V161 HydrophobicContact CB-CB 3.97Å; V125-V161 HydrophobicContact CB-CG1 4.32Å; V125-V161 HydrophobicContact CG1-CB 4.43Å; V125-V161 PolarHBondContact N-O 3.01Å; V125-V161 VanDerWaalsContact N-O 3.13Å; V125-V161 PolarHBondContact O-N 3.34Å
126D84.4Confident81.9Confident48 Ų4867 Ų6726%0.25736%0.361SS..  trans-99173.817478.2-48.4000111.1T124 Q128 S129 M130T124-D126 PolarHBondContact O-N 2.76Å; D126-Q128 PolarHBondContact O-N 3.46Å; D126-Q128 WeakPolarHBondContact OD2-CB 3.38Å; D126-Q128 PolarHBondContact OD2-N 2.81Å; D126-S129 PolarHBondContact O-N 3.19Å; D126-S129 WeakPolarHBondContact OD1-CB 3.48Å; D126-S129 PolarHBondContact OD1-N 2.91Å; D126-S129 PolarHBondContact OD1-OG 3.03Å; D126-M130 WeakPolarHBondContact O-CB 3.36Å; D126-M130 PolarHBondContact O-N 3.01Å
127M84.9Confident81.8Confident83 Ų8364.6 Ų64.641%0.40936%0.358SS..Hα-helixtrans-57-35.4179.7-174.6164.254.600113.5K131 M146 L150M127-K131 WeakPolarHBondContact O-CB 3.24Å; M127-K131 PolarHBondContact O-N 3.42Å; M127-K131 VanDerWaalsContact O-N 3.14Å; M127-M146 HydrophobicContact CG-CG 3.84Å; M127-M146 HydrophobicContact SD-CG 4.46Å; M127-L150 HydrophobicContact CB-CD1 3.7Å; M127-L150 HydrophobicContact CG-CD1 4.2Å
128Q85Confident81.9Confident104 Ų10464.9 Ų64.949%0.48638%0.377SS..Hα-helixtrans-72.8-44.6178.1-60.7-55.9-4200111.6D126 M130 K131 I132D126-Q128 PolarHBondContact O-N 3.46Å; D126-Q128 WeakPolarHBondContact OD2-CB 3.38Å; D126-Q128 PolarHBondContact OD2-N 2.81Å; Q128-M130 PolarHBondContact O-N 2.94Å; Q128-K131 WeakPolarHBondContact O-CB 3.11Å; Q128-K131 PolarHBondContact O-N 3.44Å; Q128-I132 WeakPolarHBondContact O-CG1 3.31Å; Q128-I132 PolarHBondContact O-N 3.39Å
129S86.9Confident81.8Confident4 Ų467.3 Ų67.33%0.02839%0.387CS..Hα-helixtrans-66.6-39.7-179.6-52.40000111.6F117 C119 S120 D126 K131 I132 A133F117-S129 CarbonylContact O-C 3.15Å; F117-S129 WeakPolarHBondContact O-CB 3.3Å; C119-S129 PolarHBondContact N-OG 2.9Å; S120-S129 WeakPolarHBondContact CB-OG 3.18Å; S120-S129 PolarHBondContact N-OG 3.43Å; D126-S129 PolarHBondContact O-N 3.19Å; D126-S129 WeakPolarHBondContact OD1-CB 3.48Å; D126-S129 PolarHBondContact OD1-N 2.91Å; D126-S129 PolarHBondContact OD1-OG 3.03Å; S129-K131 VanDerWaalsContact C-N 3.34Å; S129-K131 PolarHBondContact O-N 2.86Å; S129-I132 PolarHBondContact O-N 3.22Å; S129-A133 WeakPolarHBondContact O-CB 3.27Å; S129-A133 PolarHBondContact O-N 2.86Å
130M84.4Confident81.9Confident22 Ų2271.8 Ų71.811%0.10840%0.401CS..Hα-helixtrans-62.1-41.3174.2-166.4164.386.400111.9V125 D126 Q128 I132 A133 L134 M146 A149 L150V125-M130 HydrophobicContact CG1-CB 4.1Å; D126-M130 WeakPolarHBondContact O-CB 3.36Å; D126-M130 PolarHBondContact O-N 3.01Å; Q128-M130 PolarHBondContact O-N 2.94Å; M130-I132 PolarHBondContact O-N 2.89Å; M130-A133 PolarHBondContact O-N 3.37Å; M130-L134 HydrophobicContact CG-CD1 3.83Å; M130-L134 HydrophobicContact CG-CG 4.29Å; M130-L134 WeakPolarHBondContact O-CB 3.28Å; M130-L134 VanDerWaalsContact O-CG 3.25Å; M130-L134 WeakPolarHBondContact O-CG 3.45Å; M130-L134 PolarHBondContact O-N 3.35Å; M130-M146 HydrophobicContact CB-SD 4.06Å; M130-M146 HydrophobicContact CE-CG 3.77Å; M130-M146 VanDerWaalsContact CE-O 3.29Å; M130-M146 WeakPolarHBondContact CE-O 3.25Å; M130-M146 HydrophobicContact CE-SD 3.19Å; M130-M146 WeakPolarHBondContact CE-SD 3.23Å; M130-M146 HydrophobicContact CG-SD 3.88Å; M130-M146 HydrophobicContact SD-SD 4.39Å; M130-A149 HydrophobicContact CE-CB 3.76Å; M130-L150 HydrophobicContact CE-CB 4.35Å; M130-L150 HydrophobicContact CE-CD1 4.41Å; M130-L150 HydrophobicContact CE-CD2 3.91Å; M130-L150 HydrophobicContact CE-CG 3.5Å; M130-L150 HydrophobicContact SD-CD2 3.74Å; M130-L150 HydrophobicContact SD-CG 4.05Å
131K84.8Confident82.2Confident121 Ų12171.9 Ų71.953%0.52640%0.399SS..Hα-helixtrans-59.8-43.6174.6-176.4179.3178.9177.70112.6M127 Q128 S129 R135 M146M127-K131 WeakPolarHBondContact O-CB 3.24Å; M127-K131 PolarHBondContact O-N 3.42Å; M127-K131 VanDerWaalsContact O-N 3.14Å; Q128-K131 WeakPolarHBondContact O-CB 3.11Å; Q128-K131 PolarHBondContact O-N 3.44Å; S129-K131 VanDerWaalsContact C-N 3.34Å; S129-K131 PolarHBondContact O-N 2.86Å; K131-R135 VanDerWaalsContact O-CB 3.27Å; K131-R135 WeakPolarHBondContact O-CB 3.1Å; K131-R135 PolarHBondContact O-N 3.46Å; K131-M146 HydrophobicContact CB-CE 3.72Å; K131-M146 HydrophobicContact CG-CE 4.05Å
132I86.4Confident83Confident76 Ų7666.9 Ų66.939%0.3937%0.372SS..Hα-helixtrans-66.2-47.2178.8-67164.7000110.1Q128 S129 M130 L134 R135 N136Q128-I132 WeakPolarHBondContact O-CG1 3.31Å; Q128-I132 PolarHBondContact O-N 3.39Å; S129-I132 PolarHBondContact O-N 3.22Å; M130-I132 PolarHBondContact O-N 2.89Å; I132-L134 PolarHBondContact O-N 3.34Å; I132-R135 PolarHBondContact O-N 3.32Å; I132-N136 PolarHBondContact O-N 2.99Å; I132-N136 PolarHBondContact O-ND2 3.12Å; I132-N136 PolarHBondContact O-OD1 2.92Å
133A85.6Confident83.6Confident9 Ų967.7 Ų67.77%0.07438%0.379CS..Hα-helixtrans-62.6-44.7-178.800000112.4F117 S129 M130 R135 N136 A137F117-A133 HydrophobicContact CB-CB 4.4Å; F117-A133 HydrophobicContact CD1-CB 3.24Å; F117-A133 HydrophobicContact CE1-CB 3.61Å; F117-A133 HydrophobicContact CG-CB 3.98Å; S129-A133 WeakPolarHBondContact O-CB 3.27Å; S129-A133 PolarHBondContact O-N 2.86Å; M130-A133 PolarHBondContact O-N 3.37Å; A133-R135 PolarHBondContact O-N 2.55Å; A133-N136 WeakPolarHBondContact O-CB 3.34Å; A133-N136 PolarHBondContact O-N 3.17Å; A133-A137 PolarHBondContact O-N 2.79Å
134L84.3Confident84Confident18 Ų1873.4 Ų73.49%0.09439%0.394CS..Hα-helixtrans-64.1-40.6175.9-70.2170000111.8M130 I132 N136 A137 G138 I139 L141 M146M130-L134 HydrophobicContact CG-CD1 3.83Å; M130-L134 HydrophobicContact CG-CG 4.29Å; M130-L134 WeakPolarHBondContact O-CB 3.28Å; M130-L134 VanDerWaalsContact O-CG 3.25Å; M130-L134 WeakPolarHBondContact O-CG 3.45Å; M130-L134 PolarHBondContact O-N 3.35Å; I132-L134 PolarHBondContact O-N 3.34Å; L134-N136 VanDerWaalsContact C-N 3.32Å; L134-N136 PolarHBondContact O-N 2.75Å; L134-A137 CarbonylContact O-C 3.58Å; L134-A137 WeakPolarHBondContact O-CA 3.46Å; L134-A137 WeakPolarHBondContact O-CB 3.33Å; L134-A137 PolarHBondContact O-N 3.05Å; L134-A137 VanDerWaalsContact O-N 3.12Å; L134-G138 PolarHBondContact O-N 3.22Å; L134-G138 VanDerWaalsContact O-N 3.12Å; L134-I139 CarbonylContact C-O 3.55Å; L134-I139 HydrophobicContact CB-CB 4.41Å; L134-I139 HydrophobicContact CD2-CB 4.4Å; L134-I139 HydrophobicContact CD2-CD1 4.36Å; L134-I139 HydrophobicContact CD2-CG2 4.44Å; L134-I139 PolarHBondContact O-N 3.49Å; L134-L141 HydrophobicContact CD1-CD1 3.4Å; L134-L141 HydrophobicContact CD1-CG 3.96Å; L134-M146 HydrophobicContact CD1-CE 3.94Å; L134-M146 HydrophobicContact CD1-SD 3.81Å
135R84.4Confident84.2Confident193 Ų19373.2 Ų73.273%0.72839%0.391SS*.Hα-helixtrans-62-40.3174.3-172.2-176.2-176.5-162.11.1111.8K131 I132 A133 A137 G138 I139K131-R135 VanDerWaalsContact O-CB 3.27Å; K131-R135 WeakPolarHBondContact O-CB 3.1Å; K131-R135 PolarHBondContact O-N 3.46Å; I132-R135 PolarHBondContact O-N 3.32Å; A133-R135 PolarHBondContact O-N 2.55Å; R135-A137 VanDerWaalsContact C-N 3.27Å; R135-A137 PolarHBondContact O-N 3.06Å; R135-G138 PolarHBondContact O-N 3.28Å; R135-I139 PolarHBondContact N-O 3.14Å
136N84.1Confident84.3Confident126 Ų12673.3 Ų73.367%0.67439%0.392SS*.Hα-helixtrans-65.8-31.6175.8-67.4-14.7000111.9I132 A133 L134 G138I132-N136 PolarHBondContact O-N 2.99Å; I132-N136 PolarHBondContact O-ND2 3.12Å; I132-N136 PolarHBondContact O-OD1 2.92Å; A133-N136 WeakPolarHBondContact O-CB 3.34Å; A133-N136 PolarHBondContact O-N 3.17Å; L134-N136 VanDerWaalsContact C-N 3.32Å; L134-N136 PolarHBondContact O-N 2.75Å; N136-G138 PolarHBondContact O-N 2.92Å
137A81.3Confident84.4Confident70 Ų7074.2 Ų74.258%0.57940%0.401SS*.THydrogen-bonded Turntrans-78.3-2.617200000113.8A133 L134 R135 I139A133-A137 PolarHBondContact O-N 2.79Å; L134-A137 CarbonylContact O-C 3.58Å; L134-A137 WeakPolarHBondContact O-CA 3.46Å; L134-A137 WeakPolarHBondContact O-CB 3.33Å; L134-A137 PolarHBondContact O-N 3.05Å; L134-A137 VanDerWaalsContact O-N 3.12Å; R135-A137 VanDerWaalsContact C-N 3.27Å; R135-A137 PolarHBondContact O-N 3.06Å; A137-I139 VanDerWaalsContact C-N 3.35Å
138G83.6Confident84.6Confident61 Ų6174.8 Ų74.863%0.62940%0.403SS*.THydrogen-bonded Turntrans82.37.8-178.600000114.8L134 R135 N136L134-G138 PolarHBondContact O-N 3.22Å; L134-G138 VanDerWaalsContact O-N 3.12Å; R135-G138 PolarHBondContact O-N 3.28Å; N136-G138 PolarHBondContact O-N 2.92Å
139I82.2Confident84.6Confident70 Ų7070.1 Ų70.136%0.35938%0.381SS..  trans-97.4127.3-180-58.1170.8000108.8L134 R135 A137 L141 I183L134-I139 CarbonylContact C-O 3.55Å; L134-I139 HydrophobicContact CB-CB 4.41Å; L134-I139 HydrophobicContact CD2-CB 4.4Å; L134-I139 HydrophobicContact CD2-CD1 4.36Å; L134-I139 HydrophobicContact CD2-CG2 4.44Å; L134-I139 PolarHBondContact O-N 3.49Å; R135-I139 PolarHBondContact N-O 3.14Å; A137-I139 VanDerWaalsContact C-N 3.35Å; I139-L141 HydrophobicContact CG2-CD2 3.73Å; I139-L141 HydrophobicContact CG2-CG 4.15Å; I139-I183 HydrophobicContact CG2-CG2 4.36Å
140Q80.5Confident84.6Confident171 Ų17171.1 Ų71.180%0.79939%0.387SS*.  trans-111.2116.9174.4-79.7165.692.600109
141L79.8Confident84.9Confident28 Ų2879 Ų7915%0.14742%0.415CS..  trans-107.4144.3173.7-55.1-173.8000110.6L134 I139 E145 M146 I183L134-L141 HydrophobicContact CD1-CD1 3.4Å; L134-L141 HydrophobicContact CD1-CG 3.96Å; I139-L141 HydrophobicContact CG2-CD2 3.73Å; I139-L141 HydrophobicContact CG2-CG 4.15Å; L141-E145 WeakPolarHBondContact CA-OE2 3.19Å; L141-E145 HydrophobicContact CB-CB 4.2Å; L141-E145 WeakPolarHBondContact CB-OE2 3.25Å; L141-M146 HydrophobicContact CB-CE 4.02Å; L141-I183 HydrophobicContact CD1-CD1 4.18Å; L141-I183 HydrophobicContact CD1-CG1 3.81Å; L141-I183 HydrophobicContact CD2-CB 4.25Å; L141-I183 HydrophobicContact CD2-CG1 4.17Å; L141-I183 HydrophobicContact CD2-CG2 3.52Å
142G84.9Confident85Confident30 Ų3075 Ų7531%0.30940%0.399SS..  trans-67.7161.9166.200000112Q144 E145 M146G142-Q144 VanDerWaalsContact C-N 3.28Å; G142-Q144 PolarHBondContact O-N 3.19Å; G142-E145 PolarHBondContact N-OE2 3.19Å; G142-E145 PolarHBondContact O-N 3.21Å; G142-M146 PolarHBondContact O-N 3.5Å
143P84.8Confident85.1Confident108 Ų10872 Ų7270%0.70139%0.386SS*.Hα-helixtrans-58.2-37.7-179.7-2332.6000113.6C147P143-C147 PolarHBondContact O-N 3.37Å; P143-C147 VanDerWaalsContact O-N 3.15Å; P143-C147 PolarHBondContact O-SG 3.02Å; P143-C147 VanDerWaalsContact O-SG 3.35Å
144Q85.8Confident85.4Confident162 Ų16272.9 Ų72.976%0.75739%0.389SS*.Hα-helixtrans-68.5-45.7-179.7-67.9-177.4-8.300111.7G142 M146 C147 E148G142-Q144 VanDerWaalsContact C-N 3.28Å; G142-Q144 PolarHBondContact O-N 3.19Å; Q144-M146 VanDerWaalsContact C-N 3.3Å; Q144-M146 PolarHBondContact O-N 2.92Å; Q144-C147 PolarHBondContact O-N 2.91Å; Q144-E148 PolarHBondContact O-N 3.23Å
145E85.9Confident85.6Confident28 Ų2876 Ų7613%0.13141%0.405CS..Hα-helixtrans-62.6-38.7177.8-55.4170.9150.200111.4L141 G142 E148 A149 S186L141-E145 WeakPolarHBondContact CA-OE2 3.19Å; L141-E145 HydrophobicContact CB-CB 4.2Å; L141-E145 WeakPolarHBondContact CB-OE2 3.25Å; G142-E145 PolarHBondContact N-OE2 3.19Å; G142-E145 PolarHBondContact O-N 3.21Å; E145-E148 PolarHBondContact O-N 3.05Å; E145-A149 VanDerWaalsContact O-CB 3.31Å; E145-A149 WeakPolarHBondContact O-CB 3.29Å; E145-A149 PolarHBondContact O-N 3.43Å; E145-S186 WeakPolarHBondContact CG-OG 3.46Å; E145-S186 WeakPolarHBondContact OE1-CB 3.31Å; E145-S186 PolarHBondContact OE1-OG 2.85Å
146M86.2Confident85.8Confident8 Ų871.5 Ų71.54%0.03940%0.396CS..Hα-helixtrans-61-46175.5-167.574.366.600111.4M127 M130 K131 L134 L141 G142 Q144 A149 L150M127-M146 HydrophobicContact CG-CG 3.84Å; M127-M146 HydrophobicContact SD-CG 4.46Å; M130-M146 HydrophobicContact CB-SD 4.06Å; M130-M146 HydrophobicContact CE-CG 3.77Å; M130-M146 VanDerWaalsContact CE-O 3.29Å; M130-M146 WeakPolarHBondContact CE-O 3.25Å; M130-M146 HydrophobicContact CE-SD 3.19Å; M130-M146 WeakPolarHBondContact CE-SD 3.23Å; M130-M146 HydrophobicContact CG-SD 3.88Å; M130-M146 HydrophobicContact SD-SD 4.39Å; K131-M146 HydrophobicContact CB-CE 3.72Å; K131-M146 HydrophobicContact CG-CE 4.05Å; L134-M146 HydrophobicContact CD1-CE 3.94Å; L134-M146 HydrophobicContact CD1-SD 3.81Å; L141-M146 HydrophobicContact CB-CE 4.02Å; G142-M146 PolarHBondContact O-N 3.5Å; Q144-M146 VanDerWaalsContact C-N 3.3Å; Q144-M146 PolarHBondContact O-N 2.92Å; M146-A149 PolarHBondContact O-N 3.46Å; M146-L150 PolarHBondContact O-N 3.05Å
147C87.3Confident85.9Confident67 Ų6768.3 Ų68.345%0.45339%0.393SS..Hα-helixtrans-63.5-40.9176.7-72.10000111.9P143 Q144 R151P143-C147 PolarHBondContact O-N 3.37Å; P143-C147 VanDerWaalsContact O-N 3.15Å; P143-C147 PolarHBondContact O-SG 3.02Å; P143-C147 VanDerWaalsContact O-SG 3.35Å; Q144-C147 PolarHBondContact O-N 2.91Å; C147-R151 WeakPolarHBondContact O-CB 3.18Å; C147-R151 PolarHBondContact O-N 3.44Å
148E87.8Confident86.1Confident95 Ų9569.3 Ų69.344%0.44439%0.388SS..Hα-helixtrans-66.4-42.3176.2-71.5-171.2169.300112.2Q144 E145 R151 L152 T182Q144-E148 PolarHBondContact O-N 3.23Å; E145-E148 PolarHBondContact O-N 3.05Å; E148-R151 PolarHBondContact O-N 3.26Å; E148-L152 WeakPolarHBondContact O-CB 3.4Å; E148-L152 VanDerWaalsContact O-CG 3.29Å; E148-L152 WeakPolarHBondContact O-CG 3.34Å; E148-L152 PolarHBondContact O-N 3.12Å; E148-T182 HydrophobicContact CB-CG2 3.91Å; E148-T182 VanDerWaalsContact OE2-CG2 3.28Å; E148-T182 WeakPolarHBondContact OE2-CG2 3.44Å
149A85.8Confident86.1Confident5 Ų569.3 Ų69.34%0.04139%0.389CS..Hα-helixtrans-62.8-43.5176.800000111.8M130 E145 M146 L152 A153 I183M130-A149 HydrophobicContact CE-CB 3.76Å; E145-A149 VanDerWaalsContact O-CB 3.31Å; E145-A149 WeakPolarHBondContact O-CB 3.29Å; E145-A149 PolarHBondContact O-N 3.43Å; M146-A149 PolarHBondContact O-N 3.46Å; A149-L152 PolarHBondContact O-N 3.46Å; A149-A153 WeakPolarHBondContact O-CB 3.45Å; A149-A153 PolarHBondContact O-N 2.97Å; A149-I183 HydrophobicContact CB-CD1 4.44Å; A149-I183 HydrophobicContact CB-CG1 4.47Å
150L87.8Confident86.2Confident26 Ų2669.4 Ų69.414%0.13639%0.389CS..Hα-helixtrans-60.7-47.4173.7-82.5173.4000111.3M127 M130 M146 L152 A153 D154 V161M127-L150 HydrophobicContact CB-CD1 3.7Å; M127-L150 HydrophobicContact CG-CD1 4.2Å; M130-L150 HydrophobicContact CE-CB 4.35Å; M130-L150 HydrophobicContact CE-CD1 4.41Å; M130-L150 HydrophobicContact CE-CD2 3.91Å; M130-L150 HydrophobicContact CE-CG 3.5Å; M130-L150 HydrophobicContact SD-CD2 3.74Å; M130-L150 HydrophobicContact SD-CG 4.05Å; M146-L150 PolarHBondContact O-N 3.05Å; L150-L152 PolarHBondContact O-N 3.12Å; L150-A153 CarbonylContact O-C 3.47Å; L150-A153 PolarHBondContact O-N 3.43Å; L150-D154 VanDerWaalsContact O-CB 3.27Å; L150-D154 WeakPolarHBondContact O-CB 3.37Å; L150-D154 PolarHBondContact O-N 3.23Å; L150-V161 HydrophobicContact CD2-CG2 3.89Å
151R89.2Confident86.6Confident187 Ų18761.5 Ų61.571%0.70635%0.353SS*.Hα-helixtrans-64.6-29-178.7-173.316668.2111.1-2.3113.3C147 E148C147-R151 WeakPolarHBondContact O-CB 3.18Å; C147-R151 PolarHBondContact O-N 3.44Å; E148-R151 PolarHBondContact O-N 3.26Å
152L87.9Confident87.1Confident37 Ų3761.8 Ų61.819%0.19436%0.357CS..Hα-helixtrans-78.9-27.7173.9-70.9170.4000112.4E148 A149 L150 Q178 C179 T182E148-L152 WeakPolarHBondContact O-CB 3.4Å; E148-L152 VanDerWaalsContact O-CG 3.29Å; E148-L152 WeakPolarHBondContact O-CG 3.34Å; E148-L152 PolarHBondContact O-N 3.12Å; A149-L152 PolarHBondContact O-N 3.46Å; L150-L152 PolarHBondContact O-N 3.12Å; L152-Q178 HydrophobicContact CD2-CG 4.48Å; L152-C179 VanDerWaalsContact CB-SG 3.5Å; L152-T182 HydrophobicContact CD1-CG2 4.29Å; L152-T182 VanDerWaalsContact CD1-OG1 3.3Å; L152-T182 WeakPolarHBondContact CD1-OG1 3.4Å
153A88.4Confident87.3Confident14 Ų1462.9 Ų62.912%0.11635%0.353CS..Hα-helixtrans-84.9-25.417900000113.4A149 L150 L155 V161 D165 V169A149-A153 WeakPolarHBondContact O-CB 3.45Å; A149-A153 PolarHBondContact O-N 2.97Å; L150-A153 CarbonylContact O-C 3.47Å; L150-A153 PolarHBondContact O-N 3.43Å; A153-L155 PolarHBondContact O-N 3.49Å; A153-V161 HydrophobicContact CB-CG1 4.47Å; A153-V161 HydrophobicContact CB-CG2 3.87Å; A153-D165 WeakPolarHBondContact O-CB 3.45Å; A153-V169 HydrophobicContact CB-CG2 4.13Å
154D91Very high87.4Confident26 Ų2664.1 Ų64.114%0.13935%0.348CS..  trans-78.5103.8174.2177.68.2000109.8L150 G157 D158 G159 V161L150-D154 VanDerWaalsContact O-CB 3.27Å; L150-D154 WeakPolarHBondContact O-CB 3.37Å; L150-D154 PolarHBondContact O-N 3.23Å; D154-G157 VanDerWaalsContact OD1-CA 3.23Å; D154-G157 WeakPolarHBondContact OD1-CA 3.33Å; D154-G157 PolarHBondContact OD1-N 3.41Å; D154-G157 WeakPolarHBondContact OD2-CA 3.39Å; D154-D158 PolarHBondContact OD1-N 3.46Å; D154-G159 VanDerWaalsContact OD2-CA 3.28Å; D154-G159 WeakPolarHBondContact OD2-CA 3.48Å; D154-G159 PolarHBondContact OD2-N 2.89Å; D154-V161 HydrophobicContact CB-CG2 4.34Å
155L89.1Confident87.7Confident83 Ų8356.7 Ų56.744%0.43531%0.313SS..SBendtrans-91.3-27.5-173.6-58.3-179.4000112.8A153 D165 V169A153-L155 PolarHBondContact O-N 3.49Å; L155-D165 HydrophobicContact CB-CB 4.44Å; L155-D165 HydrophobicContact CD1-CB 4.44Å; L155-D165 HydrophobicContact CG-CB 4.18Å; L155-V169 HydrophobicContact CD2-CG2 4.38Å; L155-V169 HydrophobicContact CG-CG2 4.5Å
156D88.7Confident87.8Confident99 Ų9956.4 Ų56.453%0.52931%0.312SS..SBendtrans-96-13179.265.3-3.1000113.1D158D156-D158 PolarHBondContact OD1-N 3.27Å
157G86.1Confident87.9Confident59 Ų5956.6 Ų56.661%0.60831%0.313SS*.  trans79.921.4171.100000113.5D154 G159D154-G157 VanDerWaalsContact OD1-CA 3.23Å; D154-G157 WeakPolarHBondContact OD1-CA 3.33Å; D154-G157 PolarHBondContact OD1-N 3.41Å; D154-G157 WeakPolarHBondContact OD2-CA 3.39Å; G157-G159 PolarHBondContact O-N 3.45Å
158D85.4Confident88Confident91 Ų9153.8 Ų53.849%0.48730%0.295SS..SBendtrans-80.7-4.8-179.883.4-11.9000112.9D154 D156 I160D154-D158 PolarHBondContact OD1-N 3.46Å; D156-D158 PolarHBondContact OD1-N 3.27Å; D158-I160 VanDerWaalsContact C-N 3.34Å; D158-I160 WeakPolarHBondContact OD1-CA 3.36Å; D158-I160 WeakPolarHBondContact OD1-CB 3.27Å; D158-I160 PolarHBondContact OD1-N 2.7Å
159G82.9Confident88Confident62 Ų6249.9 Ų49.964%0.63928%0.278SS*.SBendtrans83.27-178.900000114.1D154 G157D154-G159 VanDerWaalsContact OD2-CA 3.28Å; D154-G159 WeakPolarHBondContact OD2-CA 3.48Å; D154-G159 PolarHBondContact OD2-N 2.89Å; G157-G159 PolarHBondContact O-N 3.45Å
160I85Confident88Confident71 Ų7152 Ų5236%0.36429%0.289SS..SBendtrans-134.1128.2-176-55.8177.9000108.9T124 D158 S162T124-I160 HydrophobicContact CG2-CG2 3.6Å; T124-I160 WeakPolarHBondContact OG1-CG2 3.44Å; D158-I160 VanDerWaalsContact C-N 3.34Å; D158-I160 WeakPolarHBondContact OD1-CA 3.36Å; D158-I160 WeakPolarHBondContact OD1-CB 3.27Å; D158-I160 PolarHBondContact OD1-N 2.7Å; I160-S162 PolarHBondContact O-N 3.22Å
161V89.3Confident88Confident6 Ų652.7 Ų52.74%0.03629%0.293CS..BIsolated β-bridgetrans-82.5109.1177.3176.70000109.4V125 L150 A153 D154 D165 F166V125-V161 HydrophobicContact CB-CB 3.97Å; V125-V161 HydrophobicContact CB-CG1 4.32Å; V125-V161 HydrophobicContact CG1-CB 4.43Å; V125-V161 PolarHBondContact N-O 3.01Å; V125-V161 VanDerWaalsContact N-O 3.13Å; V125-V161 PolarHBondContact O-N 3.34Å; L150-V161 HydrophobicContact CD2-CG2 3.89Å; A153-V161 HydrophobicContact CB-CG1 4.47Å; A153-V161 HydrophobicContact CB-CG2 3.87Å; D154-V161 HydrophobicContact CB-CG2 4.34Å; V161-D165 HydrophobicContact CG1-CB 4.22Å; V161-F166 HydrophobicContact CG1-CB 4.36Å
162S89.6Confident87.9Confident33 Ų3346.1 Ų46.123%0.23127%0.272CS..  trans-79.2170.4174.983.70000111.5I160 K164 D165 F166I160-S162 PolarHBondContact O-N 3.22Å; S162-K164 PolarHBondContact O-N 3.13Å; S162-K164 PolarHBondContact OG-N 3.38Å; S162-D165 WeakPolarHBondContact CB-OD2 3.48Å; S162-D165 PolarHBondContact N-OD2 3.34Å; S162-D165 PolarHBondContact O-N 2.83Å; S162-D165 PolarHBondContact OG-N 3.28Å; S162-D165 PolarHBondContact OG-OD2 3.43Å; S162-F166 WeakPolarHBondContact O-CB 3.35Å; S162-F166 PolarHBondContact O-N 3Å
163F88.4Confident87.8Confident54 Ų5450.7 Ų50.724%0.23730%0.297CS..Hα-helixtrans-62.1-31.9173.9-178.2-113.1000112.3L107 F110 Q111 F114 F166 L167L107-F163 HydrophobicContact CD1-CE1 3.77Å; L107-F163 HydrophobicContact CD1-CZ 3.85Å; F110-F163 HydrophobicContact CB-CE2 4.28Å; F110-F163 HydrophobicContact CB-CZ 4.29Å; Q111-F163 HydrophobicContact CB-CE2 4.29Å; Q111-F163 HydrophobicContact CB-CZ 4.31Å; Q111-F163 HydrophobicContact CG-CE1 3.99Å; Q111-F163 HydrophobicContact CG-CE2 3.67Å; Q111-F163 HydrophobicContact CG-CZ 3.31Å; F114-F163 HydrophobicContact CB-CD2 3.79Å; F114-F163 HydrophobicContact CB-CE2 4Å; F114-F163 HydrophobicContact CD1-CD2 4.05Å; F114-F163 AromaticContact CD2-CD2 3.92Å; F114-F163 HydrophobicContact CD2-CD2 3.92Å; F114-F163 HydrophobicContact CE1-CB 4.33Å; F114-F163 HydrophobicContact CE2-CB 4.29Å; F114-F163 HydrophobicContact CE2-CD2 4.49Å; F114-F163 AromaticContact CG-CD2 3.66Å; F114-F163 HydrophobicContact CG-CD2 3.66Å; F114-F163 HydrophobicContact CG-CE2 4.37Å; F114-F163 HydrophobicContact CZ-CB 4.19Å; F163-F166 HydrophobicContact CD2-CD1 4.48Å; F163-L167 HydrophobicContact CD1-CD1 4.09Å; F163-L167 HydrophobicContact CD2-CD1 3.85Å; F163-L167 HydrophobicContact CE1-CD1 3.59Å; F163-L167 HydrophobicContact CE1-CD2 4.27Å; F163-L167 HydrophobicContact CE2-CD1 3.31Å; F163-L167 HydrophobicContact CG-CD1 4.22Å; F163-L167 HydrophobicContact CZ-CD1 3.16Å; F163-L167 HydrophobicContact CZ-CD2 4.4Å; F163-L167 HydrophobicContact CZ-CG 4.41Å; F163-L167 WeakPolarHBondContact O-CD1 3.48Å; F163-L167 PolarHBondContact O-N 2.85Å
164K88.8Confident87.7Confident133 Ų13356.3 Ų56.358%0.57832%0.321SS*.Hα-helixtrans-67.9-43.4178.6-173.1-179.5178.8-176.40110.7S162 L167 G168S162-K164 PolarHBondContact O-N 3.13Å; S162-K164 PolarHBondContact OG-N 3.38Å; K164-L167 PolarHBondContact O-N 2.81Å; K164-G168 PolarHBondContact O-N 2.93Å
165D90.3Very high87.5Confident7 Ų759.5 Ų59.54%0.03733%0.331CS..Hα-helixtrans-67.1-42.5178.8-48.5-51.9000110.7A153 L155 V161 S162 L167 G168 V169A153-D165 WeakPolarHBondContact O-CB 3.45Å; L155-D165 HydrophobicContact CB-CB 4.44Å; L155-D165 HydrophobicContact CD1-CB 4.44Å; L155-D165 HydrophobicContact CG-CB 4.18Å; V161-D165 HydrophobicContact CG1-CB 4.22Å; S162-D165 WeakPolarHBondContact CB-OD2 3.48Å; S162-D165 PolarHBondContact N-OD2 3.34Å; S162-D165 PolarHBondContact O-N 2.83Å; S162-D165 PolarHBondContact OG-N 3.28Å; S162-D165 PolarHBondContact OG-OD2 3.43Å; D165-L167 VanDerWaalsContact C-N 3.32Å; D165-L167 PolarHBondContact O-N 3.25Å; D165-G168 PolarHBondContact O-N 3.23Å; D165-G168 VanDerWaalsContact O-N 3.12Å; D165-V169 VanDerWaalsContact O-CG2 3.25Å; D165-V169 WeakPolarHBondContact O-CG2 3.48Å; D165-V169 PolarHBondContact O-N 2.91Å
166F88.4Confident87.4Confident22 Ų2258.1 Ų58.110%0.09632%0.323CS..Hα-helixtrans-56-45.1173.7-178.9-102.7000112.5I113 F114 F117 V161 S162 F163 L170I113-F166 HydrophobicContact CB-CZ 4.39Å; I113-F166 HydrophobicContact CG2-CE1 4.34Å; I113-F166 HydrophobicContact CG2-CZ 3.72Å; F114-F166 HydrophobicContact CB-CD1 4.13Å; F114-F166 HydrophobicContact CB-CE1 4.05Å; F114-F166 HydrophobicContact CD2-CB 3.79Å; F114-F166 AromaticContact CD2-CD1 3.79Å; F114-F166 HydrophobicContact CD2-CD1 3.79Å; F114-F166 HydrophobicContact CD2-CD2 4.15Å; F114-F166 HydrophobicContact CD2-CE1 4.37Å; F114-F166 AromaticContact CD2-CG 3.65Å; F114-F166 HydrophobicContact CD2-CG 3.65Å; F114-F166 HydrophobicContact CE2-CB 3.98Å; F114-F166 HydrophobicContact CE2-CG 4.3Å; F114-F166 HydrophobicContact CG-CD1 4.44Å; F117-F166 HydrophobicContact CD2-CE2 4.08Å; F117-F166 HydrophobicContact CD2-CZ 4.17Å; F117-F166 HydrophobicContact CE2-CE2 4.44Å; F117-F166 HydrophobicContact CE2-CZ 4.44Å; V161-F166 HydrophobicContact CG1-CB 4.36Å; S162-F166 WeakPolarHBondContact O-CB 3.35Å; S162-F166 PolarHBondContact O-N 3Å; F163-F166 HydrophobicContact CD2-CD1 4.48Å; F166-L170 HydrophobicContact CD1-CD1 3.98Å; F166-L170 HydrophobicContact CD2-CD1 4.43Å; F166-L170 HydrophobicContact CE1-CD1 3.32Å; F166-L170 HydrophobicContact CE1-CG 4.33Å; F166-L170 HydrophobicContact CE2-CD1 3.83Å; F166-L170 HydrophobicContact CE2-CG 4.3Å; F166-L170 HydrophobicContact CG-CD1 4.5Å; F166-L170 HydrophobicContact CZ-CD1 3.23Å; F166-L170 HydrophobicContact CZ-CG 4.16Å; F166-L170 WeakPolarHBondContact O-CB 3.39Å; F166-L170 WeakPolarHBondContact O-CG 3.39Å; F166-L170 PolarHBondContact O-N 2.52Å
167L89.1Confident87.3Confident11 Ų1156.1 Ų56.16%0.05832%0.321CS..Hα-helixtrans-61.6-51.1173.2-103.371.6000110.9L99 L102 L107 F110 F163 K164 D165 V169 L170 T171L99-L167 HydrophobicContact CD2-CB 4.09Å; L99-L167 HydrophobicContact CD2-CD2 4.36Å; L102-L167 HydrophobicContact CD1-CD2 3.52Å; L102-L167 HydrophobicContact CD1-CG 4.16Å; L107-L167 HydrophobicContact CD1-CD2 3.8Å; F110-L167 HydrophobicContact CB-CD1 3.89Å; F110-L167 HydrophobicContact CG-CD1 4.36Å; F163-L167 HydrophobicContact CD1-CD1 4.09Å; F163-L167 HydrophobicContact CD2-CD1 3.85Å; F163-L167 HydrophobicContact CE1-CD1 3.59Å; F163-L167 HydrophobicContact CE1-CD2 4.27Å; F163-L167 HydrophobicContact CE2-CD1 3.31Å; F163-L167 HydrophobicContact CG-CD1 4.22Å; F163-L167 HydrophobicContact CZ-CD1 3.16Å; F163-L167 HydrophobicContact CZ-CD2 4.4Å; F163-L167 HydrophobicContact CZ-CG 4.41Å; F163-L167 WeakPolarHBondContact O-CD1 3.48Å; F163-L167 PolarHBondContact O-N 2.85Å; K164-L167 PolarHBondContact O-N 2.81Å; D165-L167 VanDerWaalsContact C-N 3.32Å; D165-L167 PolarHBondContact O-N 3.25Å; L167-V169 PolarHBondContact O-N 2.85Å; L167-L170 PolarHBondContact O-N 3.01Å; L167-T171 WeakPolarHBondContact O-CB 3.29Å; L167-T171 WeakPolarHBondContact O-CG2 3.07Å; L167-T171 PolarHBondContact O-N 3.44Å; L167-T171 PolarHBondContact O-OG1 2.93Å
168G88.1Confident87.3Confident9 Ų956.6 Ų56.69%0.09331%0.307CS..Hα-helixtrans-55.8-38.6-178.600000112.7K164 D165 D172K164-G168 PolarHBondContact O-N 2.93Å; D165-G168 PolarHBondContact O-N 3.23Å; D165-G168 VanDerWaalsContact O-N 3.12Å; G168-D172 WeakPolarHBondContact O-CB 3.49Å; G168-D172 PolarHBondContact O-N 3.27Å
169V88.6Confident87.2Confident13 Ų1352.8 Ų52.88%0.07929%0.287CS..Hα-helixtrans-71.3-41.1176.5176.20000112A153 L155 D165 L167 D172 L176A153-V169 HydrophobicContact CB-CG2 4.13Å; L155-V169 HydrophobicContact CD2-CG2 4.38Å; L155-V169 HydrophobicContact CG-CG2 4.5Å; D165-V169 VanDerWaalsContact O-CG2 3.25Å; D165-V169 WeakPolarHBondContact O-CG2 3.48Å; D165-V169 PolarHBondContact O-N 2.91Å; L167-V169 PolarHBondContact O-N 2.85Å; V169-D172 VanDerWaalsContact O-O 3.12Å; V169-L176 WeakPolarHBondContact O-CB 3.4Å; V169-L176 PolarHBondContact O-N 2.9Å
170L86.1Confident87.2Confident50 Ų5054 Ų5426%0.26228%0.277SS..Hα-helixtrans-79.2-29.9-177.2-72.2-171000114F110 F166 L167 L176F110-L170 HydrophobicContact CD1-CD1 3.78Å; F110-L170 HydrophobicContact CE1-CB 4.05Å; F110-L170 HydrophobicContact CE1-CD1 3.84Å; F166-L170 HydrophobicContact CD1-CD1 3.98Å; F166-L170 HydrophobicContact CD2-CD1 4.43Å; F166-L170 HydrophobicContact CE1-CD1 3.32Å; F166-L170 HydrophobicContact CE1-CG 4.33Å; F166-L170 HydrophobicContact CE2-CD1 3.83Å; F166-L170 HydrophobicContact CE2-CG 4.3Å; F166-L170 HydrophobicContact CG-CD1 4.5Å; F166-L170 HydrophobicContact CZ-CD1 3.23Å; F166-L170 HydrophobicContact CZ-CG 4.16Å; F166-L170 WeakPolarHBondContact O-CB 3.39Å; F166-L170 WeakPolarHBondContact O-CG 3.39Å; F166-L170 PolarHBondContact O-N 2.52Å; L167-L170 PolarHBondContact O-N 3.01Å; L170-L176 HydrophobicContact CD2-CD1 4Å
171T87.1Confident87.1Confident39 Ų3952.1 Ų52.124%0.23927%0.273CS..Hα-helixtrans-84.5-23.8178.359.30000112S98 L102 F110 L167S98-T171 PolarHBondContact O-OG1 2.49Å; L102-T171 HydrophobicContact CD1-CG2 4.1Å; L102-T171 HydrophobicContact CD2-CG2 4.21Å; F110-T171 HydrophobicContact CZ-CG2 4.46Å; L167-T171 WeakPolarHBondContact O-CB 3.29Å; L167-T171 WeakPolarHBondContact O-CG2 3.07Å; L167-T171 PolarHBondContact O-N 3.44Å; L167-T171 PolarHBondContact O-OG1 2.93Å
172D88.1Confident86.7Confident49 Ų4952.5 Ų52.526%0.26228%0.275SS..  trans-89.5104.4172.5-175.9-25.6000110.6G168 V169 H174 R175 L176G168-D172 WeakPolarHBondContact O-CB 3.49Å; G168-D172 PolarHBondContact O-N 3.27Å; V169-D172 VanDerWaalsContact O-O 3.12Å; D172-H174 PolarHBondContact O-N 2.96Å; D172-H174 WeakPolarHBondContact OD1-CA 3.26Å; D172-H174 VanDerWaalsContact OD1-CB 3.29Å; D172-H174 WeakPolarHBondContact OD1-CB 3.33Å; D172-H174 PolarHBondContact OD1-N 3.5Å; D172-R175 HydrophobicContact CB-CB 3.83Å; D172-R175 HydrophobicContact CB-CG 3.72Å; D172-R175 PolarHBondContact O-N 3.11Å; D172-R175 PolarHBondContact OD1-N 3.31Å; D172-R175 WeakPolarHBondContact OD2-CG 2.96Å; D172-L176 WeakPolarHBondContact O-CB 3.25Å; D172-L176 PolarHBondContact O-N 3.49Å
173N85.6Confident86.1Confident133 Ų13352 Ų5271%0.71127%0.27SS*.Hα-helixtrans-56.1-35.3176.9-79-47.2000113.4A177N173-A177 WeakPolarHBondContact O-CB 3.25Å; N173-A177 PolarHBondContact O-N 3.33Å
174H86.8Confident85.3Confident132 Ų13253.2 Ų53.261%0.61129%0.285SS*.Hα-helixtrans-71-43.3179.4176.4-85.7000110.6D172 A177 Q178D172-H174 PolarHBondContact O-N 2.96Å; D172-H174 WeakPolarHBondContact OD1-CA 3.26Å; D172-H174 VanDerWaalsContact OD1-CB 3.29Å; D172-H174 WeakPolarHBondContact OD1-CB 3.33Å; D172-H174 PolarHBondContact OD1-N 3.5Å; H174-A177 PolarHBondContact O-N 3.49Å; H174-Q178 WeakPolarHBondContact O-CB 3.46Å; H174-Q178 PolarHBondContact O-N 2.91Å
175R86.5Confident84.2Confident94 Ų9454.4 Ų54.436%0.35529%0.286SS..Hα-helixtrans-63-48175.7-69.1-84.3159.4-165.4-4.3111.5D172 A177 Q178 C179D172-R175 HydrophobicContact CB-CB 3.83Å; D172-R175 HydrophobicContact CB-CG 3.72Å; D172-R175 PolarHBondContact O-N 3.11Å; D172-R175 PolarHBondContact OD1-N 3.31Å; D172-R175 WeakPolarHBondContact OD2-CG 2.96Å; R175-A177 VanDerWaalsContact C-N 3.33Å; R175-A177 PolarHBondContact O-N 3.39Å; R175-Q178 WeakPolarHBondContact O-CB 3.48Å; R175-Q178 PolarHBondContact O-N 2.95Å; R175-Q178 VanDerWaalsContact O-N 3.16Å; R175-C179 PolarHBondContact O-N 3.07Å
176L86Confident82.7Confident53 Ų5356.5 Ų56.528%0.27730%0.301SS..Hα-helixtrans-57.5-48.1176.4-178.858.6000111V169 L170 D172 Q178 C179 M180V169-L176 WeakPolarHBondContact O-CB 3.4Å; V169-L176 PolarHBondContact O-N 2.9Å; L170-L176 HydrophobicContact CD2-CD1 4Å; D172-L176 WeakPolarHBondContact O-CB 3.25Å; D172-L176 PolarHBondContact O-N 3.49Å; L176-Q178 VanDerWaalsContact C-N 3.31Å; L176-Q178 PolarHBondContact O-N 3.36Å; L176-C179 PolarHBondContact O-N 3.24Å; L176-M180 HydrophobicContact CD1-CG 4.11Å; L176-M180 HydrophobicContact CG-CG 4.43Å; L176-M180 WeakPolarHBondContact O-CB 3.42Å; L176-M180 VanDerWaalsContact O-CG 3.24Å; L176-M180 WeakPolarHBondContact O-CG 3.4Å; L176-M180 PolarHBondContact O-N 2.99Å
177A86.6Confident81.2Confident58 Ų5859.8 Ų59.848%0.47933%0.327SS..Hα-helixtrans-60.8-40.5177.400000111.8N173 H174 R175 M180 A181N173-A177 WeakPolarHBondContact O-CB 3.25Å; N173-A177 PolarHBondContact O-N 3.33Å; H174-A177 PolarHBondContact O-N 3.49Å; R175-A177 VanDerWaalsContact C-N 3.33Å; R175-A177 PolarHBondContact O-N 3.39Å; A177-M180 PolarHBondContact O-N 3.27Å; A177-A181 WeakPolarHBondContact O-CB 3.09Å; A177-A181 PolarHBondContact O-N 3.48Å
178Q86Confident79.5Confident69 Ų6968.7 Ų68.732%0.32236%0.36SS..Hα-helixtrans-63.7-47.9177.3-172.9177.44.800111.8L152 H174 R175 L176 A181 T182L152-Q178 HydrophobicContact CD2-CG 4.48Å; H174-Q178 WeakPolarHBondContact O-CB 3.46Å; H174-Q178 PolarHBondContact O-N 2.91Å; R175-Q178 WeakPolarHBondContact O-CB 3.48Å; R175-Q178 PolarHBondContact O-N 2.95Å; R175-Q178 VanDerWaalsContact O-N 3.16Å; L176-Q178 VanDerWaalsContact C-N 3.31Å; L176-Q178 PolarHBondContact O-N 3.36Å; Q178-A181 PolarHBondContact O-N 3.36Å; Q178-T182 PolarHBondContact O-N 3.12Å; Q178-T182 PolarHBondContact O-OG1 2.99Å; Q178-T182 VanDerWaalsContact O-OG1 3.06Å
179C84.1Confident77.5Confident10 Ų1074 Ų747%0.06839%0.393CS..Hα-helixtrans-58.3-48.4175.3-77.40000111.6L152 R175 L176 A181 T182 I183L152-C179 VanDerWaalsContact CB-SG 3.5Å; R175-C179 PolarHBondContact O-N 3.07Å; L176-C179 PolarHBondContact O-N 3.24Å; C179-A181 VanDerWaalsContact C-N 3.33Å; C179-A181 PolarHBondContact O-N 3.07Å; C179-T182 WeakPolarHBondContact O-CB 3.4Å; C179-T182 PolarHBondContact O-N 3.47Å; C179-I183 PolarHBondContact O-N 3.07Å
180M82.6Confident75.7Confident87 Ų8779.8 Ų79.843%0.42943%0.432SS..Hα-helixtrans-65.7-35179-69.3-63.5103.100112.6L176 A177 I183 S184L176-M180 HydrophobicContact CD1-CG 4.11Å; L176-M180 HydrophobicContact CG-CG 4.43Å; L176-M180 WeakPolarHBondContact O-CB 3.42Å; L176-M180 VanDerWaalsContact O-CG 3.24Å; L176-M180 WeakPolarHBondContact O-CG 3.4Å; L176-M180 PolarHBondContact O-N 2.99Å; A177-M180 PolarHBondContact O-N 3.27Å; M180-I183 HydrophobicContact CE-CD1 3.49Å; M180-I183 VanDerWaalsContact CE-CD1 3.49Å; M180-I183 PolarHBondContact O-N 2.78Å; M180-S184 WeakPolarHBondContact O-CB 3.48Å; M180-S184 PolarHBondContact O-N 3.3Å; M180-S184 PolarHBondContact O-OG 2.98Å
181A83.9Confident73.7Confident33 Ų3384.5 Ų84.527%0.27349%0.493SS..Hα-helixtrans-68.3-35.7176.300000111.8A177 Q178 C179 S184 R185A177-A181 WeakPolarHBondContact O-CB 3.09Å; A177-A181 PolarHBondContact O-N 3.48Å; Q178-A181 PolarHBondContact O-N 3.36Å; C179-A181 VanDerWaalsContact C-N 3.33Å; C179-A181 PolarHBondContact O-N 3.07Å; A181-S184 PolarHBondContact O-N 2.95Å; A181-R185 VanDerWaalsContact O-CB 3.28Å; A181-R185 WeakPolarHBondContact O-CB 3.41Å; A181-R185 WeakPolarHBondContact O-CG 3.37Å; A181-R185 PolarHBondContact O-N 3.43Å; A181-R185 PolarHBondContact O-NE 2.98Å
182T79Confident73Confident14 Ų1486.8 Ų86.89%0.08651%0.506CS..Hα-helixtrans-62-47.7173-57.90000110.5E148 L152 Q178 C179 S184 R185 S186E148-T182 HydrophobicContact CB-CG2 3.91Å; E148-T182 VanDerWaalsContact OE2-CG2 3.28Å; E148-T182 WeakPolarHBondContact OE2-CG2 3.44Å; L152-T182 HydrophobicContact CD1-CG2 4.29Å; L152-T182 VanDerWaalsContact CD1-OG1 3.3Å; L152-T182 WeakPolarHBondContact CD1-OG1 3.4Å; Q178-T182 PolarHBondContact O-N 3.12Å; Q178-T182 PolarHBondContact O-OG1 2.99Å; Q178-T182 VanDerWaalsContact O-OG1 3.06Å; C179-T182 WeakPolarHBondContact O-CB 3.4Å; C179-T182 PolarHBondContact O-N 3.47Å; T182-S184 VanDerWaalsContact C-N 3.32Å; T182-S184 PolarHBondContact O-N 3.44Å; T182-R185 PolarHBondContact O-N 3.33Å; T182-S186 PolarHBondContact O-OG 3.46Å; T182-S186 VanDerWaalsContact O-OG 3.1Å
183I77.1Confident72.2Confident21 Ų2188.8 Ų88.811%0.10852%0.519CS..Hα-helixtrans-61.3-37.6177.4-70.4163.2000112.6I139 L141 A149 C179 M180I139-I183 HydrophobicContact CG2-CG2 4.36Å; L141-I183 HydrophobicContact CD1-CD1 4.18Å; L141-I183 HydrophobicContact CD1-CG1 3.81Å; L141-I183 HydrophobicContact CD2-CB 4.25Å; L141-I183 HydrophobicContact CD2-CG1 4.17Å; L141-I183 HydrophobicContact CD2-CG2 3.52Å; A149-I183 HydrophobicContact CB-CD1 4.44Å; A149-I183 HydrophobicContact CB-CG1 4.47Å; C179-I183 PolarHBondContact O-N 3.07Å; M180-I183 HydrophobicContact CE-CD1 3.49Å; M180-I183 VanDerWaalsContact CE-CD1 3.49Å; M180-I183 PolarHBondContact O-N 2.78Å
184S73.1Confident71.5Confident81 Ų8186.3 Ų86.357%0.56651%0.508SS*.Hα-helixtrans-83.5-23.3-176.4-58.40000114.2M180 A181 T182M180-S184 WeakPolarHBondContact O-CB 3.48Å; M180-S184 PolarHBondContact O-N 3.3Å; M180-S184 PolarHBondContact O-OG 2.98Å; A181-S184 PolarHBondContact O-N 2.95Å; T182-S184 VanDerWaalsContact C-N 3.32Å; T182-S184 PolarHBondContact O-N 3.44Å
185R65.4Low70.6Confident157 Ų15783.6 Ų83.659%0.59250%0.502SS*.Hα-helixtrans-77.4-27.5-175.5-83.5178.9-77.5-166.1-0.3113.3A181 T182A181-R185 VanDerWaalsContact O-CB 3.28Å; A181-R185 WeakPolarHBondContact O-CB 3.41Å; A181-R185 WeakPolarHBondContact O-CG 3.37Å; A181-R185 PolarHBondContact O-N 3.43Å; A181-R185 PolarHBondContact O-NE 2.98Å; T182-R185 PolarHBondContact O-N 3.33Å
186S59.2Low69.6Low51 Ų5183 Ų8336%0.35751%0.511SS..THydrogen-bonded Turntrans-96.6-8.1-171.550.50000113.8E145 T182 R188E145-S186 WeakPolarHBondContact CG-OG 3.46Å; E145-S186 WeakPolarHBondContact OE1-CB 3.31Å; E145-S186 PolarHBondContact OE1-OG 2.85Å; T182-S186 PolarHBondContact O-OG 3.46Å; T182-S186 VanDerWaalsContact O-OG 3.1Å; S186-R188 PolarHBondContact O-N 2.82Å
187S55.3Low68.5Low92 Ų9285 Ų8564%0.64353%0.527SS*.THydrogen-bonded Turntrans-75.6-1.4165.5-102.10000114.7P189S187-P189 WeakPolarHBondContact O-CD 3.44Å
188R55.3Low67.2Low198 Ų19886.9 Ų86.975%0.74753%0.53SS*.SBendtrans-77.9116.9172-65.7-175.3-173.1-121.80.6108S186 C190S186-R188 PolarHBondContact O-N 2.82Å; R188-C190 PolarHBondContact O-N 3.5Å
189P45.9Very low65.8Low120 Ų12088.3 Ų88.378%0.77955%0.546SS*.  trans-62.5124.5173.524.5-27.2000107.4S187 G191S187-P189 WeakPolarHBondContact O-CD 3.44Å; P189-G191 PolarHBondContact O-N 3.47Å
190C50.5Low64.2Low135 Ų13594.8 Ų94.891%0.91259%0.586SS**  trans-53.1114.1166.8-58.70000107.3R188R188-C190 PolarHBondContact O-N 3.5Å
191G43.5Very low62.6Low149 Ų14995.5 Ų95.5100%1.53660%0.6SS**  trans-80.20174.400000111.7P189P189-G191 PolarHBondContact O-N 3.47Å

Retrieved 191 of 191 residues in 287.9 ms (Link to these results)