A0A077ZQW8_TRITR Loading...

Uncharacterized protein

AlphaFold DB , UniProt , Accession A0A077ZQW8, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 321 aa.

Structure Viewer
Loading PAE data...
(Predicted Aligned Error values between residue pairs)
Error loading PAE data: please refresh the page.

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
1A70.5Confident65.3Low161 Ų161159.1 Ų159.1100%1.33185%0.846SS**  0117.9000000107.8
2K58.7Low65.4Low184 Ų184155.9 Ų155.980%0.884%0.837SS**  trans-87.8153.3175.6-74.4174.9172.7178.30108.7
3Y64.6Low65.7Low198 Ų198153.7 Ų153.778%0.77684%0.836SS**  trans155.599130.7-82.7-68.4000108.6Y5Y3-Y5 AromaticContact CD1-CE2 3.79Å; Y3-Y5 HydrophobicContact CD1-CE2 3.79Å; Y3-Y5 HydrophobicContact CE1-CE2 4.45Å
4G59.6Low65.5Low71 Ų71161 Ų16173%0.73285%0.845SS**  trans-90.5144.115700000108.9
5Y69.3Low65.2Low194 Ų194154.5 Ų154.576%0.76183%0.832SS**  trans-140.7103.2161.8-82.8-79.7000106.7Y3Y3-Y5 AromaticContact CD1-CE2 3.79Å; Y3-Y5 HydrophobicContact CD1-CE2 3.79Å; Y3-Y5 HydrophobicContact CE1-CE2 4.45Å
6E64.9Low64.7Low190 Ų190158 Ų15889%0.88884%0.838SS**  trans-88.3137.2156.1-74.2175.3159.800107
7T70.1Confident64.5Low119 Ų119156.8 Ų156.873%0.7384%0.838SS**  trans-137.593.8169.6-31.60000107.4S9T7-S9 PolarHBondContact O-N 3.4Å
8D61.5Low64.3Low159 Ų159159.2 Ų159.285%0.8584%0.843SS**  trans-62.8126.3164.3-84.4-34000109.1
9S70.1Confident64.5Low98 Ų98161.6 Ų161.669%0.68585%0.845SS**  trans-118.888.5170.4-66.50000108.1T7 Q11T7-S9 PolarHBondContact O-N 3.4Å; S9-Q11 PolarHBondContact O-N 3.31Å
10E67.9Low64.9Low191 Ų191158.3 Ų158.389%0.89383%0.828SS**  trans-64.9110.9161.9-72-168.814600108.9
11Q60.6Low65Low185 Ų185158.8 Ų158.886%0.86482%0.824SS**  trans-97.9106.6169.3-78.5-168.321.900111.2S9S9-Q11 PolarHBondContact O-N 3.31Å
12V67Low65Low121 Ų121158.9 Ų158.973%0.73380%0.797SS**  trans-7.9130.3157.2-171.20000116.8R14V12-R14 PolarHBondContact O-N 3.39Å
13P68.9Low65.6Low127 Ų127156.9 Ų156.983%0.82579%0.791SS**  trans-62120.9169.6-16.728.7000111.8G15P13-G15 PolarHBondContact O-N 3.15Å
14R63.4Low65.8Low256 Ų256156 Ų15697%0.96679%0.786SS**  trans-70.5115.3168.9-74.5-177.1173.1-163.4-1.5109.9V12V12-R14 PolarHBondContact O-N 3.39Å
15G60.3Low66.3Low63 Ų63157 Ų15765%0.64978%0.778SS**  trans-163.8124.2169.900000113.1P13P13-G15 PolarHBondContact O-N 3.15Å
16K57.2Low66.4Low211 Ų211155.2 Ų155.292%0.91778%0.777SS**  trans79.976.4156-51.4176.7-179177.60118
17V62.1Low66.5Low138 Ų138153.9 Ų153.984%0.83677%0.77SS**  trans-137.1-0.3155.3-164.70000114K19V17-K19 VanDerWaalsContact C-N 3.31Å; V17-K19 PolarHBondContact O-N 3.19Å
18E60.7Low65.9Low200 Ų200155.4 Ų155.494%0.93577%0.774SS**THydrogen-bonded Turntrans-86.732-164.7-145171.4-158.200116.3
19K67.3Low65.9Low204 Ų204153.7 Ų153.789%0.88777%0.769SS**THydrogen-bonded Turntrans-119.311.4-176.6-112.7-173.7-178.5-1740116.9V17V17-K19 VanDerWaalsContact C-N 3.31Å; V17-K19 PolarHBondContact O-N 3.19Å
20N72.5Confident65.7Low95 Ų95158 Ų15851%0.50878%0.775SS.*SBendtrans-130.214.7-171.9-120.8-31.6000115.4
21F66.9Low65.7Low169 Ų169154.6 Ų154.674%0.74177%0.77SS**SBendtrans-90.7-36.1179.9-159.8-97.8000112.5R24 V25F21-R24 PolarHBondContact O-N 3.43Å; F21-V25 HydrophobicContact CD1-CG2 4.43Å; F21-V25 HydrophobicContact CE1-CG2 4.24Å
22E71Confident65.3Low163 Ų163155.7 Ų155.776%0.76277%0.772SS**Hα-helixtrans-73.8-31.9-174.9-154.5157-161.800112.9R24 V25E22-R24 VanDerWaalsContact C-N 3.28Å; E22-R24 PolarHBondContact O-N 3.44Å; E22-V25 PolarHBondContact O-N 3.48Å
23E71.8Confident64.7Low143 Ų143153.7 Ų153.767%0.66878%0.776SS**Hα-helixtrans-71.8-22.1176.5-156.7172.1-169.300112.7
24R68.1Low64.4Low178 Ų178153.2 Ų153.267%0.67278%0.776SS**Hα-helixtrans-83.3-22.5178.1-123-178.6-70.9-169.7-3.6113.6F21 E22F21-R24 PolarHBondContact O-N 3.43Å; E22-R24 VanDerWaalsContact C-N 3.28Å; E22-R24 PolarHBondContact O-N 3.44Å
25V71.5Confident64.5Low94 Ų94150.3 Ų150.357%0.5777%0.77SS**Hα-helixtrans-81.4-20.9-179.91770000111.9F21 E22F21-V25 HydrophobicContact CD1-CG2 4.43Å; F21-V25 HydrophobicContact CE1-CG2 4.24Å; E22-V25 PolarHBondContact O-N 3.48Å
26Q71.6Confident64.4Low156 Ų156153.1 Ų153.173%0.72978%0.777SS**G310 helixtrans-83-13-179-72.1-174.8-1.800115D28Q26-D28 PolarHBondContact O-N 2.99Å
27Q66.6Low64.2Low162 Ų162151.8 Ų151.876%0.75778%0.776SS**G310 helixtrans-78.6-13.8-177.9-80.7-173.9-11.200115.1
28D57.2Low63.8Low151 Ų151154.2 Ų154.281%0.80778%0.778SS**G310 helixtrans-105.311.4-171.8-77.7-27.9000116Q26Q26-D28 PolarHBondContact O-N 2.99Å
29V61.7Low63.3Low123 Ų123152.5 Ų152.575%0.74578%0.775SS**  trans-104.780.4175.6-170.20000110.5
30K66.2Low62.6Low187 Ų187148.4 Ų148.481%0.81377%0.769SS**  trans-81.5123.4162.5-84.7179.8179.7172.70109.5F32K30-F32 PolarHBondContact O-N 3.4Å
31P67.1Low61.3Low121 Ų121149.6 Ų149.679%0.78678%0.784SS**  trans-69.6127.217327.3-29.9000109.5G33P31-G33 PolarHBondContact O-N 3.37Å; P31-G33 VanDerWaalsContact O-N 3.15Å
32F52.2Low60.5Low208 Ų208147.8 Ų147.891%0.91279%0.792SS**  trans-60.3114.4170.4-87.3-91.5000109.5K30 S34K30-F32 PolarHBondContact O-N 3.4Å; F32-S34 PolarHBondContact O-N 3.35Å
33G54.6Low59.5Low79 Ų79143.4 Ų143.481%0.81479%0.79SS**  trans-68.4107.2173.400000111.1P31 K35P31-G33 PolarHBondContact O-N 3.37Å; P31-G33 VanDerWaalsContact O-N 3.15Å; G33-K35 PolarHBondContact O-N 2.96Å
34S62.4Low58.1Low116 Ų116148.3 Ų148.381%0.81180%0.803SS**  trans-76111.1166.141.80000109.7F32F32-S34 PolarHBondContact O-N 3.35Å
35K65.3Low57.2Low196 Ų196148.7 Ų148.785%0.85281%0.811SS**PPolyproline II helixtrans-66139.8167.1-74.5179.8177.6178.10109.8G33G33-K35 PolarHBondContact O-N 2.96Å
36P58.5Low55.9Low121 Ų121149.7 Ų149.779%0.78682%0.823SS**PPolyproline II helixtrans-69.4135.5173.425.2-26.3000110.4
37M53Low54.6Low184 Ų184148.5 Ų148.591%0.90683%0.826SS**PPolyproline II helixtrans-80.7116.3174-171.8179.3-70.800108.6
38E53.1Low54Low189 Ų189149.4 Ų149.488%0.88383%0.83SS**PPolyproline II helixtrans-71.4127.6174.9-67.1-167.2157.700110.6
39L51.6Low53.3Low164 Ų164149 Ų14986%0.85983%0.833SS**PPolyproline II helixtrans-84.8143.5169.5-80.2164.1000109.9S41L39-S41 PolarHBondContact O-N 3.27Å
40P52Low53Low118 Ų118146.4 Ų146.477%0.76683%0.831SS**PPolyproline II helixtrans-67.3129.5178.926.9-31.6000111.2
41S45.8Very low52.2Low119 Ų119149.3 Ų149.383%0.83284%0.837SS**PPolyproline II helixtrans-51.9126.8175.150.30000113.5L39L39-S41 PolarHBondContact O-N 3.27Å
42C48.4Very low51.4Low132 Ų132149.6 Ų149.689%0.89284%0.837SS**  trans-136.8118.3162.9-113.50000110.8
43G51.3Low51.1Low71 Ų71144 Ų14473%0.73284%0.837SS**  trans68.197.9143.400000118.9H45G43-H45 PolarHBondContact O-N 3.34Å
44R41.9Very low50.7Low246 Ų246145.8 Ų145.893%0.92883%0.832SS**  trans-54.5120.3163.4-67.6177.4177.9-176.8-1.3111.2
45H49.2Very low49.8Very low185 Ų185148.9 Ų148.986%0.85684%0.839SS**  trans-137126.4146.4-75.9-63000109.1G43G43-H45 PolarHBondContact O-N 3.34Å
46S43.7Very low48.7Very low116 Ų116150.2 Ų150.281%0.81184%0.838SS**  trans-64.5132-178.3-153.30000110.4
47V45.5Very low48Very low131 Ų131150.2 Ų150.279%0.79484%0.84SS**  trans-117.1109.2168.9176.40000106.9
48E53.1Low47.8Very low181 Ų181150 Ų15085%0.84684%0.837SS**  trans-84.8125.7167.5-72.4-175.8165.600109.6G50E48-G50 PolarHBondContact O-N 3.44Å
49T42.6Very low48.2Very low143 Ų143149 Ų14988%0.87783%0.832SS**  trans-76.6106.8173.229.20000111
50G56.3Low48.5Very low67 Ų67146.9 Ų146.969%0.69183%0.828SS**  trans-85.3130.7166.200000112.1E48 T52E48-G50 PolarHBondContact O-N 3.44Å; G50-T52 VanDerWaalsContact C-N 3.35Å; G50-T52 PolarHBondContact O-N 2.79Å
51R48.4Very low48.2Very low249 Ų249147.5 Ų147.594%0.9483%0.829SS**SBendtrans-66.886.8168.9-79.5178.3171.3175.6-2.6109.8
52T51Low48.6Very low127 Ų127149.3 Ų149.378%0.77983%0.83SS**SBendtrans170.7117.3154.126.20000107.4G50 V54G50-T52 VanDerWaalsContact C-N 3.35Å; G50-T52 PolarHBondContact O-N 2.79Å; T52-V54 VanDerWaalsContact C-N 3.31Å; T52-V54 PolarHBondContact O-N 3.37Å
53G44.9Very low48Very low90 Ų90154.4 Ų154.493%0.92883%0.83SS**SBendtrans-70.169.2-166.600000115.9
54V47.2Very low47.6Very low116 Ų116159.3 Ų159.370%0.70384%0.839SS**  trans-138.7104.7167.8-174.90000109.5T52 R56T52-V54 VanDerWaalsContact C-N 3.31Å; T52-V54 PolarHBondContact O-N 3.37Å; V54-R56 HydrophobicContact CG1-CG 4.49Å
55L42.3Very low47.5Very low181 Ų181152.9 Ų152.995%0.94884%0.838SS**  trans-85.1110170.4-70.2170.8000109.3
56R42.9Very low47.5Very low225 Ų225147.5 Ų147.585%0.84983%0.833SS**  trans-101.8118.9163.7-82.1-174.5175.9173.4-0.3108.9V54 Q58V54-R56 HydrophobicContact CG1-CG 4.49Å; R56-Q58 PolarHBondContact O-N 3.47Å
57C44.6Very low47.2Very low120 Ų120147 Ų14781%0.81184%0.836SS**  trans-80.1110.1166.9-168.40000108.2
58Q48.6Very low47.7Very low181 Ų181151.9 Ų151.985%0.84684%0.84SS**  trans-88.1108.7166.1-71.8-170.130.200108.3R56R56-Q58 PolarHBondContact O-N 3.47Å
59Q61.4Low47.6Very low166 Ų166148.8 Ų148.878%0.77684%0.836SS**  trans-85.8137.2162.1-78.1-172.9-17.100109.4V61Q59-V61 PolarHBondContact O-N 3.25Å
60P57Low47.7Very low121 Ų121151 Ų15179%0.78684%0.841SS**  trans-73.1122169.129-29.9000109.7N62P60-N62 PolarHBondContact O-N 3.24Å
61V45.7Very low47.1Very low130 Ų130152 Ų15279%0.78884%0.838SS**  trans-82.892.6178.3-157.70000108.8Q59Q59-V61 PolarHBondContact O-N 3.25Å
62N54.4Low47.1Very low158 Ų158147.8 Ų147.885%0.84583%0.834SS**  trans-99.9104.9162.6-84.3-22.2000109.3P60 L64P60-N62 PolarHBondContact O-N 3.24Å; N62-L64 PolarHBondContact O-N 3.27Å
63R35.8Very low47.1Very low238 Ų238148.8 Ų148.890%0.89884%0.839SS**  trans-64.7113.3168-81.9178172.3166.9-2.3109.4
64L43.7Very low47.7Very low174 Ų174152.5 Ų152.591%0.91183%0.825SS**  trans-141.5123.2151.1-93.8166.4000108.6N62N62-L64 PolarHBondContact O-N 3.27Å
65A38.5Very low48.5Very low111 Ų111149.4 Ų149.492%0.91781%0.812SS**  trans-65.7133.4-178.200000111.2
66G49.2Very low49.7Very low73 Ų73146.2 Ų146.275%0.75380%0.802SS**  trans175.583.1177.400000111.3R68G66-R68 PolarHBondContact O-N 3.41Å
67A37.7Very low51.3Low106 Ų106141.8 Ų141.888%0.87680%0.795SS**  trans-62.4120.7177.800000111.7
68R56.7Low52.9Low233 Ų233139.7 Ų139.788%0.87978%0.776SS**  trans-140.5135.5157.8-76.2-168174.8-172.4-1109.9G66G66-R68 PolarHBondContact O-N 3.41Å
69P51Low54.4Low116 Ų116134 Ų13475%0.75376%0.76SS**  trans-76.3130.9-175.429.5-31.5000111.3S71P69-S71 VanDerWaalsContact C-N 3.35Å; P69-S71 PolarHBondContact O-N 2.99Å; P69-S71 VanDerWaalsContact O-N 3.08Å
70L44Very low55.1Low189 Ų189133 Ų13399%0.9975%0.753SS**  trans-75.886168.2-73.6166000109.1
71S43.7Very low56.2Low89 Ų89128.8 Ų128.862%0.62273%0.729SS**  trans-113.7100.2162.159.60000107.4P69P69-S71 VanDerWaalsContact C-N 3.35Å; P69-S71 PolarHBondContact O-N 2.99Å; P69-S71 VanDerWaalsContact O-N 3.08Å
72N49.1Very low58.1Low159 Ų159125.3 Ų125.385%0.8571%0.706SS**  trans168.367.8156.3-83.2-18.3000110.7
73V51.4Low59.8Low148 Ų148123.1 Ų123.190%0.89769%0.69SS**  trans-119.796.2159.5-1770000105.7
74R56Low62.2Low169 Ų169118.7 Ų118.764%0.63867%0.674SS**  trans-71.6140.3173.6-86.3-177.5-177.3-170.6-4.6109.2D78 D82R74-D78 HydrophobicContact CB-CB 4.36Å; R74-D78 HydrophobicContact CG-CB 4.46Å; R74-D82 IonicContact CZ-OD2 2.66Å; R74-D82 IonicContact NH1-OD2 2.7Å; R74-D82 PolarHBondContact NH1-OD2 3.36Å
75A64.9Low64.4Low50 Ų50115.9 Ų115.941%0.41365%0.651SS.*  trans-64.6146.4172.500000109.3N77 D78A75-N77 PolarHBondContact O-N 3.02Å; A75-D78 PolarHBondContact O-N 3.48Å
76P67.9Low66.9Low114 Ų114117.2 Ų117.274%0.7464%0.638SS**Hα-helixtrans-56.8-21.1179.517.2-28.8000113.9
77N76.3Confident68.8Low132 Ų132118.3 Ų118.371%0.70662%0.624SS**Hα-helixtrans-71.4-27174.9-69.1-22.2000113.8A75 A81A75-N77 PolarHBondContact O-N 3.02Å; N77-A81 PolarHBondContact O-N 2.82Å
78D77.8Confident71.2Confident76 Ų76117.6 Ų117.641%0.40660%0.598SS.*Hα-helixtrans-74.7-33.1-178.8-65.1-34.7000111.7R74 A75 A81 D82R74-D78 HydrophobicContact CB-CB 4.36Å; R74-D78 HydrophobicContact CG-CB 4.46Å; A75-D78 PolarHBondContact O-N 3.48Å; D78-A81 PolarHBondContact O-N 3.09Å; D78-D82 PolarHBondContact O-N 2.77Å
79A79.5Confident72.8Confident62 Ų62114 Ų11451%0.51258%0.584SS.*Hα-helixtrans-64.3-41.4176.800000111.7D82 Q83A79-D82 PolarHBondContact O-N 3Å; A79-Q83 PolarHBondContact O-N 3.41Å
80F75.8Confident74.5Confident145 Ų145111.3 Ų111.364%0.63657%0.572SS**Hα-helixtrans-66.1-42176.4-173.5-95.9000112D82 Q83 W84F80-D82 VanDerWaalsContact C-N 3.29Å; F80-D82 PolarHBondContact O-N 3.16Å; F80-Q83 PolarHBondContact O-N 3.34Å; F80-W84 WeakPolarHBondContact O-CB 3.49Å; F80-W84 PolarHBondContact O-N 3.43Å
81A81.7Confident76.4Confident33 Ų33108 Ų10827%0.27355%0.553SS.*Hα-helixtrans-62.8-36.9176.800000112.1N77 D78 R85N77-A81 PolarHBondContact O-N 2.82Å; D78-A81 PolarHBondContact O-N 3.09Å; A81-R85 WeakPolarHBondContact O-CB 3.45Å; A81-R85 VanDerWaalsContact O-CG 3.29Å; A81-R85 WeakPolarHBondContact O-CG 3.3Å; A81-R85 PolarHBondContact O-N 3.29Å; A81-R85 PolarHBondContact O-NE 3.02Å
82D85.6Confident78.6Confident56 Ų56108.7 Ų108.730%0.29955%0.547SS..Hα-helixtrans-71.9-40.6176.7-77.4-11.1000112.8R74 D78 A79 F80 R85 H86R74-D82 IonicContact CZ-OD2 2.66Å; R74-D82 IonicContact NH1-OD2 2.7Å; R74-D82 PolarHBondContact NH1-OD2 3.36Å; D78-D82 PolarHBondContact O-N 2.77Å; A79-D82 PolarHBondContact O-N 3Å; F80-D82 VanDerWaalsContact C-N 3.29Å; F80-D82 PolarHBondContact O-N 3.16Å; D82-R85 PolarHBondContact O-N 3.15Å; D82-R85 IonicContact OD1-CZ 3.18Å; D82-R85 IonicContact OD1-NE 3.9Å; D82-R85 PolarHBondContact OD1-NE 3.47Å; D82-R85 IonicContact OD1-NH2 3.36Å; D82-R85 PolarHBondContact OD1-NH2 3.34Å; D82-H86 WeakPolarHBondContact O-CB 3.5Å; D82-H86 PolarHBondContact O-N 3.5Å
83Q88.8Confident80.4Confident112 Ų112108.9 Ų108.952%0.52354%0.542SS..Hα-helixtrans-59.4-47.9172.9-177.5176.6-4.400111.2A79 F80 R85 H86 E87A79-Q83 PolarHBondContact O-N 3.41Å; F80-Q83 PolarHBondContact O-N 3.34Å; Q83-R85 VanDerWaalsContact C-N 3.33Å; Q83-R85 PolarHBondContact O-N 3.13Å; Q83-H86 WeakPolarHBondContact O-CB 3.48Å; Q83-H86 PolarHBondContact O-N 3.49Å; Q83-E87 PolarHBondContact NE2-OE1 3.04Å; Q83-E87 PolarHBondContact O-N 2.97Å
84W87.5Confident82.1Confident145 Ų145107.9 Ų107.955%0.54952%0.522SS..Hα-helixtrans-63.2-38.8179.1-167.184.1000112.2F80 H86 R88F80-W84 WeakPolarHBondContact O-CB 3.49Å; F80-W84 PolarHBondContact O-N 3.43Å; W84-H86 VanDerWaalsContact C-N 3.32Å; W84-H86 PolarHBondContact O-N 3.13Å; W84-R88 WeakPolarHBondContact O-CB 3.46Å; W84-R88 PolarHBondContact O-N 3.19Å
85R90.4Very high83.7Confident116 Ų116104.3 Ų104.344%0.43852%0.521SS..Hα-helixtrans-63.8-35.3172.7-80.1-174.4-81.4-111.44112.6A81 D82 Q83 R89A81-R85 WeakPolarHBondContact O-CB 3.45Å; A81-R85 VanDerWaalsContact O-CG 3.29Å; A81-R85 WeakPolarHBondContact O-CG 3.3Å; A81-R85 PolarHBondContact O-N 3.29Å; A81-R85 PolarHBondContact O-NE 3.02Å; D82-R85 PolarHBondContact O-N 3.15Å; D82-R85 IonicContact OD1-CZ 3.18Å; D82-R85 IonicContact OD1-NE 3.9Å; D82-R85 PolarHBondContact OD1-NE 3.47Å; D82-R85 IonicContact OD1-NH2 3.36Å; D82-R85 PolarHBondContact OD1-NH2 3.34Å; Q83-R85 VanDerWaalsContact C-N 3.33Å; Q83-R85 PolarHBondContact O-N 3.13Å; R85-R89 WeakPolarHBondContact O-CG 3.32Å; R85-R89 PolarHBondContact O-N 2.97Å
86H90.7Very high84.4Confident139 Ų139105.3 Ų105.364%0.64453%0.529SS*.Hα-helixtrans-71.7-45.3178.5-165.5-73.7000111.5D82 Q83 W84 R88 R89 A90D82-H86 WeakPolarHBondContact O-CB 3.5Å; D82-H86 PolarHBondContact O-N 3.5Å; Q83-H86 WeakPolarHBondContact O-CB 3.48Å; Q83-H86 PolarHBondContact O-N 3.49Å; W84-H86 VanDerWaalsContact C-N 3.32Å; W84-H86 PolarHBondContact O-N 3.13Å; H86-R88 PolarHBondContact O-N 3.49Å; H86-R89 PolarHBondContact O-N 3.27Å; H86-A90 PolarHBondContact O-N 3.31Å
87E88.7Confident85.5Confident96 Ų96103.9 Ų103.945%0.44954%0.535SS..Hα-helixtrans-63.2-39.4175.5-73.3177.9-174.600112.1Q83 R89 A90 M91Q83-E87 PolarHBondContact NE2-OE1 3.04Å; Q83-E87 PolarHBondContact O-N 2.97Å; E87-R89 PolarHBondContact O-N 3.48Å; E87-A90 WeakPolarHBondContact O-CB 3.46Å; E87-A90 PolarHBondContact O-N 3.41Å; E87-M91 PolarHBondContact O-N 3.03Å
88R87.4Confident86.1Confident91 Ų91100.4 Ų100.434%0.34353%0.525SS..Hα-helixtrans-60.1-45.6173.9-175.6-178.9173.4159.88.6111.9W84 H86 A90 M91 E92 E114W84-R88 WeakPolarHBondContact O-CB 3.46Å; W84-R88 PolarHBondContact O-N 3.19Å; H86-R88 PolarHBondContact O-N 3.49Å; R88-A90 VanDerWaalsContact C-N 3.33Å; R88-A90 PolarHBondContact O-N 3.33Å; R88-M91 PolarHBondContact O-N 3.41Å; R88-E92 IonicContact CZ-OE1 2.95Å; R88-E92 IonicContact NE-OE1 3.68Å; R88-E92 PolarHBondContact NE-OE1 3.22Å; R88-E92 IonicContact NH2-OE1 3.75Å; R88-E92 WeakPolarHBondContact O-CG 3.49Å; R88-E92 PolarHBondContact O-N 2.89Å; R88-E114 IonicContact CZ-OE1 3.82Å; R88-E114 IonicContact NH1-OE1 3.57Å; R88-E114 IonicContact NH2-OE1 2.88Å; R88-E114 PolarHBondContact NH2-OE1 3.04Å
89R90.4Very high86.7Confident156 Ų15697.8 Ų97.859%0.58951%0.511SS*.Hα-helixtrans-63-39.6176.4-76.7-171.2-119-156.41.1111.8R85 H86 E87 M91 E92 H93R85-R89 WeakPolarHBondContact O-CG 3.32Å; R85-R89 PolarHBondContact O-N 2.97Å; H86-R89 PolarHBondContact O-N 3.27Å; E87-R89 PolarHBondContact O-N 3.48Å; R89-M91 VanDerWaalsContact C-N 3.3Å; R89-M91 PolarHBondContact O-N 3.18Å; R89-E92 PolarHBondContact O-N 3.43Å; R89-H93 PolarHBondContact O-CD2 3.48Å; R89-H93 PolarHBondContact O-N 3Å
90A87.6Confident87.3Confident61 Ų6197.4 Ų97.450%0.50450%0.504SS..Hα-helixtrans-61.6-37.8175.300000112.4H86 E87 R88H86-A90 PolarHBondContact O-N 3.31Å; E87-A90 WeakPolarHBondContact O-CB 3.46Å; E87-A90 PolarHBondContact O-N 3.41Å; R88-A90 VanDerWaalsContact C-N 3.33Å; R88-A90 PolarHBondContact O-N 3.33Å
91M84.1Confident88.1Confident119 Ų11997.9 Ų97.959%0.58651%0.508SS*.Hα-helixtrans-73.3-32.9175.4-75.4-170.2-96.100113.7E87 R88 R89 H93 R94E87-M91 PolarHBondContact O-N 3.03Å; R88-M91 PolarHBondContact O-N 3.41Å; R89-M91 VanDerWaalsContact C-N 3.3Å; R89-M91 PolarHBondContact O-N 3.18Å; M91-H93 VanDerWaalsContact C-N 3.33Å; M91-H93 PolarHBondContact O-N 2.92Å; M91-R94 PolarHBondContact O-N 3.26Å
92E88.2Confident88.6Confident103 Ų103100.3 Ų100.348%0.48152%0.523SS..Hα-helixtrans-69.4-28.7-179.8-79.2174.3-175.700113R88 R89R88-E92 IonicContact CZ-OE1 2.95Å; R88-E92 IonicContact NE-OE1 3.68Å; R88-E92 PolarHBondContact NE-OE1 3.22Å; R88-E92 IonicContact NH2-OE1 3.75Å; R88-E92 WeakPolarHBondContact O-CG 3.49Å; R88-E92 PolarHBondContact O-N 2.89Å; R89-E92 PolarHBondContact O-N 3.43Å
93H87.3Confident89Confident163 Ų163100.8 Ų100.876%0.75552%0.524SS*.THydrogen-bonded Turntrans-87-1.6179.1-71.7-65.6000115.2R89 M91R89-H93 PolarHBondContact O-CD2 3.48Å; R89-H93 PolarHBondContact O-N 3Å; M91-H93 VanDerWaalsContact C-N 3.33Å; M91-H93 PolarHBondContact O-N 2.92Å
94R87Confident89.2Confident128 Ų128100.3 Ų100.348%0.48352%0.521SS..SBendtrans-76.8128.9175.6-105.3-175.8178168-0.2111.2M91 L99 E103M91-R94 PolarHBondContact O-N 3.26Å; R94-L99 HydrophobicContact CB-CD2 4.31Å; R94-E103 IonicContact NH1-OE1 3Å; R94-E103 PolarHBondContact NH1-OE1 2.99Å
95P89.4Confident89.4Confident93 Ų9398.4 Ų98.460%0.60452%0.521SS*.  trans-61.3140.4175.124.8-32.1000110.3G97 A98P95-G97 PolarHBondContact O-N 3.49Å; P95-A98 HydrophobicContact CG-CB 4.22Å; P95-A98 PolarHBondContact O-N 3.28Å
96A80.1Confident89.4Confident72 Ų7295.8 Ų95.860%0.59552%0.524SS*.G310 helixtrans-58.6-23.1-171.500000114.3A98A96-A98 VanDerWaalsContact C-N 3.32Å; A96-A98 PolarHBondContact O-N 3.19Å
97G90.9Very high89.5Confident84 Ų8493.1 Ų93.187%0.86651%0.509SS*.G310 helixtrans-77.9-7.117700000115.6P95P95-G97 PolarHBondContact O-N 3.49Å
98A88.6Confident89.6Confident58 Ų5896 Ų9648%0.47952%0.516SS..G310 helixtrans-101.71.3-176.200000114.3P95 A96P95-A98 HydrophobicContact CG-CB 4.22Å; P95-A98 PolarHBondContact O-N 3.28Å; A96-A98 VanDerWaalsContact C-N 3.32Å; A96-A98 PolarHBondContact O-N 3.19Å
99L92Very high89.7Confident22 Ų2294.4 Ų94.412%0.11552%0.518CS..  trans-94127.8-177.7-63.2178000110.8R94 E103 Q104R94-L99 HydrophobicContact CB-CD2 4.31Å; L99-E103 WeakPolarHBondContact CA-OE2 3.32Å; L99-E103 HydrophobicContact CB-CB 4.01Å; L99-E103 HydrophobicContact CD2-CB 4.07Å; L99-E103 HydrophobicContact CG-CB 4.49Å; L99-Q104 HydrophobicContact CB-CG 3.89Å; L99-Q104 PolarHBondContact O-NE2 3.48Å; L99-Q104 VanDerWaalsContact O-NE2 3.09Å
100S92.3Very high89.6Confident54 Ų5489.8 Ų89.838%0.37851%0.514SS..  trans-57.8156.9167.561.60000111.2S102 E103 Q104S100-S102 PolarHBondContact O-N 2.95Å; S100-S102 PolarHBondContact OG-OG 2.94Å; S100-E103 WeakPolarHBondContact CB-OE2 3.46Å; S100-E103 PolarHBondContact N-OE2 2.97Å; S100-E103 WeakPolarHBondContact O-CB 3.4Å; S100-E103 PolarHBondContact O-N 3.47Å; S100-E103 VanDerWaalsContact OG-CG 3.3Å; S100-E103 WeakPolarHBondContact OG-CG 3.3Å; S100-E103 PolarHBondContact OG-N 3.07Å; S100-E103 PolarHBondContact OG-OE2 3.37Å; S100-Q104 WeakPolarHBondContact O-CG 3.38Å; S100-Q104 PolarHBondContact O-N 2.97Å
101Q92Very high89.7Confident155 Ų15594.4 Ų94.472%0.72452%0.518SS*.Hα-helixtrans-56.9-35.1-179.3-168.5-179.319.500112.5Q104 L105Q101-Q104 PolarHBondContact O-N 2.98Å; Q101-L105 WeakPolarHBondContact O-CG 3.45Å; Q101-L105 PolarHBondContact O-N 2.7Å
102S92Very high89.7Confident83 Ų8397.1 Ų97.158%0.5852%0.522SS*.Hα-helixtrans-67-41.1175.352.50000112.4S100 Q104 L105 A106S100-S102 PolarHBondContact O-N 2.95Å; S100-S102 PolarHBondContact OG-OG 2.94Å; S102-Q104 VanDerWaalsContact C-N 3.33Å; S102-L105 PolarHBondContact O-N 3.18Å; S102-A106 WeakPolarHBondContact O-CB 3.45Å; S102-A106 PolarHBondContact O-N 3.4Å
103E93.7Very high89.3Confident67 Ų6798.4 Ų98.431%0.31353%0.528SS..Hα-helixtrans-65.6-36.8174.4-73.6169.1126.800111.7R94 L99 S100 A106 R107R94-E103 IonicContact NH1-OE1 3Å; R94-E103 PolarHBondContact NH1-OE1 2.99Å; L99-E103 WeakPolarHBondContact CA-OE2 3.32Å; L99-E103 HydrophobicContact CB-CB 4.01Å; L99-E103 HydrophobicContact CD2-CB 4.07Å; L99-E103 HydrophobicContact CG-CB 4.49Å; S100-E103 WeakPolarHBondContact CB-OE2 3.46Å; S100-E103 PolarHBondContact N-OE2 2.97Å; S100-E103 WeakPolarHBondContact O-CB 3.4Å; S100-E103 PolarHBondContact O-N 3.47Å; S100-E103 VanDerWaalsContact OG-CG 3.3Å; S100-E103 WeakPolarHBondContact OG-CG 3.3Å; S100-E103 PolarHBondContact OG-N 3.07Å; S100-E103 PolarHBondContact OG-OE2 3.37Å; E103-A106 PolarHBondContact O-N 3.33Å; E103-R107 VanDerWaalsContact O-CB 3.3Å; E103-R107 WeakPolarHBondContact O-CB 3.44Å; E103-R107 PolarHBondContact O-N 3.02Å
104Q93.1Very high88.7Confident101 Ų10193.7 Ų93.747%0.47251%0.506SS..Hα-helixtrans-64.1-43.4174.5-66.3-178.913.700111.6L99 S100 Q101 S102 R107 W108L99-Q104 HydrophobicContact CB-CG 3.89Å; L99-Q104 PolarHBondContact O-NE2 3.48Å; L99-Q104 VanDerWaalsContact O-NE2 3.09Å; S100-Q104 WeakPolarHBondContact O-CG 3.38Å; S100-Q104 PolarHBondContact O-N 2.97Å; Q101-Q104 PolarHBondContact O-N 2.98Å; S102-Q104 VanDerWaalsContact C-N 3.33Å; Q104-R107 PolarHBondContact O-N 2.66Å; Q104-W108 WeakPolarHBondContact O-CB 2.99Å; Q104-W108 PolarHBondContact O-N 3.27Å
105L92.1Very high88.4Confident105 Ų10589.1 Ų89.155%0.5550%0.499SS..Hα-helixtrans-65.6-39.4175.8-74171.5000112.5Q101 S102 W108 S109Q101-L105 WeakPolarHBondContact O-CG 3.45Å; Q101-L105 PolarHBondContact O-N 2.7Å; S102-L105 PolarHBondContact O-N 3.18Å; L105-W108 PolarHBondContact O-N 3.39Å; L105-S109 WeakPolarHBondContact O-CB 3.41Å; L105-S109 PolarHBondContact O-N 3.47Å; L105-S109 PolarHBondContact O-OG 3.4Å
106A90.3Very high87.5Confident61 Ų6187.5 Ų87.550%0.50449%0.493SS..Hα-helixtrans-63.1-44.9174.100000111.1S102 E103 W108 S109 A110S102-A106 WeakPolarHBondContact O-CB 3.45Å; S102-A106 PolarHBondContact O-N 3.4Å; E103-A106 PolarHBondContact O-N 3.33Å; A106-W108 VanDerWaalsContact C-N 3.34Å; A106-W108 PolarHBondContact O-N 2.99Å; A106-S109 PolarHBondContact O-N 3.27Å; A106-A110 WeakPolarHBondContact O-CB 3.5Å; A106-A110 PolarHBondContact O-N 3.37Å
107R91.6Very high86.8Confident84 Ų8491.9 Ų91.932%0.31750%0.495SS..Hα-helixtrans-62.3-39.8176.2-169.2177.5-172.6-176.75.4112.1E103 Q104 R111E103-R107 VanDerWaalsContact O-CB 3.3Å; E103-R107 WeakPolarHBondContact O-CB 3.44Å; E103-R107 PolarHBondContact O-N 3.02Å; Q104-R107 PolarHBondContact O-N 2.66Å; R107-R111 WeakPolarHBondContact O-CG 3.47Å; R107-R111 PolarHBondContact O-N 3.02Å
108W91.4Very high85.7Confident156 Ų15695.4 Ų95.459%0.59148%0.482SS*.Hα-helixtrans-67.1-42.9176.5-172.786.3000111.9Q104 L105 A106 R111 R112Q104-W108 WeakPolarHBondContact O-CB 2.99Å; Q104-W108 PolarHBondContact O-N 3.27Å; L105-W108 PolarHBondContact O-N 3.39Å; A106-W108 VanDerWaalsContact C-N 3.34Å; A106-W108 PolarHBondContact O-N 2.99Å; W108-R111 PolarHBondContact O-N 2.92Å; W108-R112 PolarHBondContact O-N 3.08Å; W108-R112 VanDerWaalsContact O-N 3.08Å
109S89Confident84.7Confident57 Ų5798.4 Ų98.440%0.39949%0.49SS..Hα-helixtrans-62.9-43.9177.4-57.60000111.9L105 A106 R111 R112 E113L105-S109 WeakPolarHBondContact O-CB 3.41Å; L105-S109 PolarHBondContact O-N 3.47Å; L105-S109 PolarHBondContact O-OG 3.4Å; A106-S109 PolarHBondContact O-N 3.27Å; S109-R111 VanDerWaalsContact C-N 3.35Å; S109-R111 PolarHBondContact O-N 3.35Å; S109-R112 PolarHBondContact O-N 3.5Å; S109-E113 PolarHBondContact O-N 3.46Å
110A88.4Confident83Confident60 Ų60103.6 Ų103.650%0.49651%0.513SS..Hα-helixtrans-60.8-40176.400000112.7A106 E113 E114A106-A110 WeakPolarHBondContact O-CB 3.5Å; A106-A110 PolarHBondContact O-N 3.37Å; A110-E113 PolarHBondContact O-N 3.05Å; A110-E114 PolarHBondContact O-N 3.07Å; A110-E114 VanDerWaalsContact O-N 3.09Å
111R89.3Confident81.2Confident157 Ų157110.3 Ų110.359%0.59253%0.53SS*.Hα-helixtrans-65.8-38.6175-72.9-178-163.8-111.87.9112.4R107 W108 S109 E113 E114 G115R107-R111 WeakPolarHBondContact O-CG 3.47Å; R107-R111 PolarHBondContact O-N 3.02Å; W108-R111 PolarHBondContact O-N 2.92Å; S109-R111 VanDerWaalsContact C-N 3.35Å; S109-R111 PolarHBondContact O-N 3.35Å; R111-E113 VanDerWaalsContact C-N 3.35Å; R111-E114 PolarHBondContact O-N 3.42Å; R111-G115 PolarHBondContact O-N 2.92Å; R111-G115 VanDerWaalsContact O-N 3.16Å
112R83.9Confident79.5Confident176 Ų176108.1 Ų108.166%0.66453%0.532SS*.Hα-helixtrans-65.2-39.5178.7-169.9179.8180-177.11.3111.7W108 S109 G115 A116W108-R112 PolarHBondContact O-N 3.08Å; W108-R112 VanDerWaalsContact O-N 3.08Å; S109-R112 PolarHBondContact O-N 3.5Å; R112-G115 PolarHBondContact O-N 3.3Å; R112-A116 PolarHBondContact O-N 2.9Å
113E80.3Confident77.6Confident130 Ų130107.9 Ų107.961%0.60754%0.535SS*.Hα-helixtrans-67-37.3173.7-68.9-169.2165.300112S109 A110 R111 G115 A116 W117S109-E113 PolarHBondContact O-N 3.46Å; A110-E113 PolarHBondContact O-N 3.05Å; R111-E113 VanDerWaalsContact C-N 3.35Å; E113-G115 VanDerWaalsContact C-N 3.29Å; E113-G115 PolarHBondContact O-N 3.39Å; E113-A116 PolarHBondContact O-N 3.44Å; E113-A116 VanDerWaalsContact O-N 3.17Å; E113-W117 VanDerWaalsContact O-CD1 3.26Å; E113-W117 PolarHBondContact O-N 3Å
114E75Confident75.3Confident65 Ų65112.7 Ų112.730%0.30456%0.555SS.*Hα-helixtrans-64.2-33.9178.2-146-175.9-137.300112.4R88 A110 R111 W117 R118R88-E114 IonicContact CZ-OE1 3.82Å; R88-E114 IonicContact NH1-OE1 3.57Å; R88-E114 IonicContact NH2-OE1 2.88Å; R88-E114 PolarHBondContact NH2-OE1 3.04Å; A110-E114 PolarHBondContact O-N 3.07Å; A110-E114 VanDerWaalsContact O-N 3.09Å; R111-E114 PolarHBondContact O-N 3.42Å; E114-W117 PolarHBondContact O-N 3.44Å; E114-R118 WeakPolarHBondContact O-CG 3.41Å; E114-R118 PolarHBondContact O-N 3.01Å; E114-R118 IonicContact OE1-NH2 3.81Å; E114-R118 IonicContact OE2-CZ 3.93Å; E114-R118 IonicContact OE2-NH2 2.9Å; E114-R118 PolarHBondContact OE2-NH2 2.95Å
115G80.6Confident72.7Confident31 Ų31113.1 Ų113.132%0.3257%0.569SS.*Hα-helixtrans-61.9-48.9170.400000112.1R111 R112 E113 W117 R118 D119R111-G115 PolarHBondContact O-N 2.92Å; R111-G115 VanDerWaalsContact O-N 3.16Å; R112-G115 PolarHBondContact O-N 3.3Å; E113-G115 VanDerWaalsContact C-N 3.29Å; E113-G115 PolarHBondContact O-N 3.39Å; G115-W117 VanDerWaalsContact C-N 3.31Å; G115-W117 PolarHBondContact O-N 2.82Å; G115-R118 PolarHBondContact O-N 3.36Å; G115-D119 PolarHBondContact O-N 2.95Å; G115-D119 VanDerWaalsContact O-N 3.07Å
116A70.6Confident70.4Confident60 Ų60116.3 Ų116.350%0.49659%0.586SS.*Hα-helixtrans-62.1-36.117800000112.8R112 E113 H120R112-A116 PolarHBondContact O-N 2.9Å; E113-A116 PolarHBondContact O-N 3.44Å; E113-A116 VanDerWaalsContact O-N 3.17Å; A116-H120 WeakPolarHBondContact O-CB 3.43Å; A116-H120 PolarHBondContact O-N 3.29Å
117W66.2Low68Low164 Ų164118.7 Ų118.762%0.62160%0.596SS**Hα-helixtrans-72.8-30.4176.3-85.699.7000113.8E113 E114 G115 R121E113-W117 VanDerWaalsContact O-CD1 3.26Å; E113-W117 PolarHBondContact O-N 3Å; E114-W117 PolarHBondContact O-N 3.44Å; G115-W117 VanDerWaalsContact C-N 3.31Å; G115-W117 PolarHBondContact O-N 2.82Å; W117-R121 PolarHBondContact O-N 3.16Å
118R67.9Low65.3Low157 Ų157119.5 Ų119.559%0.59262%0.621SS**Hα-helixtrans-71.3-43.2174.1-77.4-179-145.7-112.12.4111.3E114 G115 H120 R121 S122E114-R118 WeakPolarHBondContact O-CG 3.41Å; E114-R118 PolarHBondContact O-N 3.01Å; E114-R118 IonicContact OE1-NH2 3.81Å; E114-R118 IonicContact OE2-CZ 3.93Å; E114-R118 IonicContact OE2-NH2 2.9Å; E114-R118 PolarHBondContact OE2-NH2 2.95Å; G115-R118 PolarHBondContact O-N 3.36Å; R118-H120 VanDerWaalsContact C-N 3.26Å; R118-H120 PolarHBondContact O-N 2.92Å; R118-R121 PolarHBondContact O-N 2.88Å; R118-R121 VanDerWaalsContact O-N 3.13Å; R118-S122 PolarHBondContact O-N 3.22Å
119D66.8Low62.6Low122 Ų122117.8 Ų117.865%0.65263%0.631SS**Hα-helixtrans-61.3-38.8176.8-66.3-19.6000111.1G115 R121 S122 A123G115-D119 PolarHBondContact O-N 2.95Å; G115-D119 VanDerWaalsContact O-N 3.07Å; D119-R121 VanDerWaalsContact C-N 3.32Å; D119-R121 PolarHBondContact O-N 3.3Å; D119-S122 PolarHBondContact O-N 3.37Å; D119-A123 PolarHBondContact O-N 3.42Å
120H57.1Low60.2Low131 Ų131125.8 Ų125.861%0.60665%0.652SS**Hα-helixtrans-71.5-23.7178.8-136.7-46.3000114.2A116 R118A116-H120 WeakPolarHBondContact O-CB 3.43Å; A116-H120 PolarHBondContact O-N 3.29Å; R118-H120 VanDerWaalsContact C-N 3.26Å; R118-H120 PolarHBondContact O-N 2.92Å
121R54.7Low57.9Low195 Ų195130.2 Ų130.274%0.73667%0.668SS**Hα-helixtrans-85.8-28.6174.6-98.2-171.6-102.9-139.4-3.6112.9W117 R118 D119 A123W117-R121 PolarHBondContact O-N 3.16Å; R118-R121 PolarHBondContact O-N 2.88Å; R118-R121 VanDerWaalsContact O-N 3.13Å; D119-R121 VanDerWaalsContact C-N 3.32Å; D119-R121 PolarHBondContact O-N 3.3Å; R121-A123 PolarHBondContact O-N 2.98Å
122S55.1Low55.4Low108 Ų108128.7 Ų128.776%0.75568%0.676SS**Hα-helixtrans-73.4-14.6176-162.40000113.3R118 D119R118-S122 PolarHBondContact O-N 3.22Å; D119-S122 PolarHBondContact O-N 3.37Å
123A51.8Low53.3Low78 Ų78126 Ų12665%0.64568%0.684SS**THydrogen-bonded Turntrans-97.619.4-175.200000115.3D119 R121D119-A123 PolarHBondContact O-N 3.42Å; R121-A123 PolarHBondContact O-N 2.98Å
124K47.1Very low51.4Low169 Ų169131 Ų13174%0.73570%0.697SS**  trans-131.182.9-179.9-72.6-173.1178.5-178.10113.1
125S38.5Very low49.7Very low110 Ų110132.3 Ų132.377%0.76972%0.719SS**  trans-129.584.7156.762.90000108.9
126L42.7Very low47.8Very low171 Ų171138.7 Ų138.790%0.89575%0.745SS**  trans-141.7142.3164.3-78.2179.3000110.1
127P39.5Very low46.3Very low112 Ų112143.2 Ų143.273%0.72776%0.761SS**  trans-81157.9-159.733.3-34.8000113C129P127-C129 PolarHBondContact O-N 3.49Å
128A35.7Very low45.2Very low101 Ų101144.3 Ų144.384%0.83577%0.773SS**  trans-62.9117.517800000112.2
129C33.7Very low43.8Very low119 Ų119142.2 Ų142.280%0.80478%0.783SS**  trans-96.486.9160.5-73.20000109.2P127P127-C129 PolarHBondContact O-N 3.49Å
130R39.7Very low42.5Very low225 Ų225141 Ų14185%0.84979%0.789SS**  trans-64.8137.7140.4-77.6173.8166.4160.3-4.7105.6
131D39.6Very low41.8Very low153 Ų153141.4 Ų141.482%0.81880%0.801SS**  trans131.822.8167.2-60.7-20.4000117.1
132V37.7Very low40.8Very low125 Ų125135.6 Ų135.676%0.75880%0.802SS**SBendtrans-104.5-1.4168.7-173.90000113.1
133S40.3Very low40Very low121 Ų121136.7 Ų136.785%0.84680%0.804SS**SBendtrans-949.8-175.5-57.80000115.9
134R40.1Very low39.3Very low233 Ų233142.6 Ų142.688%0.87982%0.818SS**SBendtrans-117.70.3-178.6-91.5-174.7-168.3157.13.2116.3
135A38.2Very low39Very low93 Ų93141.9 Ų141.977%0.76982%0.822SS**SBendtrans-10310.6-174.100000115
136L40.5Very low39.2Very low165 Ų165140.5 Ų140.586%0.86482%0.817SS**SBendtrans-119.711-176.5-91.7161000114.9
137D40.9Very low39.1Very low155 Ų155144 Ų14483%0.82982%0.818SS**SBendtrans-10314.5-179.8-95.6-17.8000114.3
138Q42Very low39.5Very low188 Ų188147.9 Ų147.988%0.87982%0.824SS**  trans-127.969.3-179.9-65.7-17711.200111.6
139S39Very low39.9Very low112 Ų112147.5 Ų147.578%0.78382%0.815SS**  trans-165.385.4159.4-175.90000109.4
140A38Very low40.1Very low96 Ų96148.6 Ų148.679%0.79381%0.812SS**  trans-78.3117.5167.200000108.7
141T43.1Very low40.5Very low140 Ų140142.1 Ų142.186%0.85980%0.798SS**  trans-179.4118.6139.424.60000110.1
142G34.6Very low41Very low73 Ų73143.8 Ų143.875%0.75379%0.793SS**SBendtrans91.9116.6148.500000118.9
143V38.2Very low42.3Very low132 Ų132140.9 Ų140.980%0.878%0.782SS**  trans80.492.1158.5-163.30000116.8L145V143-L145 HydrophobicContact CG1-CD1 4.32Å; V143-L145 PolarHBondContact O-N 2.97Å
144Q36.9Very low43.7Very low201 Ų201138 Ų13894%0.93976%0.759SS**  trans-73.1111.8162.3-75.1-151.6-7.100110.8
145L40.7Very low44.8Very low155 Ų155131.8 Ų131.881%0.81275%0.747SS**  trans-99.6109.8162.6-118.3122.6000109V143 R147V143-L145 HydrophobicContact CG1-CD1 4.32Å; V143-L145 PolarHBondContact O-N 2.97Å; L145-R147 PolarHBondContact O-N 3.21Å; L145-R147 VanDerWaalsContact O-N 3.16Å
146A41.8Very low46.3Very low81 Ų81132 Ų13267%0.66974%0.738SS**  trans-65.7109.8179.700000111.1K148A146-K148 PolarHBondContact O-N 3.48Å
147R41.7Very low47.8Very low244 Ų244131.9 Ų131.992%0.92174%0.739SS**  trans-71.8103.2164.4-79.5179.1166.1173.8-3.1109L145L145-R147 PolarHBondContact O-N 3.21Å; L145-R147 VanDerWaalsContact O-N 3.16Å
148K46.7Very low49.6Very low194 Ų194128.2 Ų128.284%0.84374%0.738SS**  trans-95.8105.4167.8-72.8-178.7178.3177.90109.3A146A146-K148 PolarHBondContact O-N 3.48Å
149S44.3Very low50.1Low93 Ų93124.8 Ų124.865%0.6572%0.721SS**  trans-83120.7160.257.90000108.4
150L38.9Very low51.6Low141 Ų141123.9 Ų123.974%0.73871%0.712SS**EExtended strand (participates in β ladder)trans-95106.1170.9-158.782.1000108.5
151T46.5Very low52.5Low89 Ų89127 Ų12755%0.54670%0.703SS.*EExtended strand (participates in β ladder)trans-100.9110.4172.6-34.50000107.5V162T151-V162 HydrophobicContact CG2-CG1 3.57Å
152R50.4Low53.9Low189 Ų189124.5 Ų124.571%0.71369%0.687SS**EExtended strand (participates in β ladder)trans-110.8115172.9-163.2174.8-175.8179.30.3108.3L163R152-L163 PolarHBondContact O-N 3.31Å
153A65.2Low54.6Low64 Ų64127.1 Ų127.153%0.52968%0.683SS.*EExtended strand (participates in β ladder)trans-86.713217000000108.6T160A153-T160 HydrophobicContact CB-CG2 4.21Å
154T69.1Low55.3Low60 Ų60125.2 Ų125.237%0.36868%0.675SS.*EExtended strand (participates in β ladder)trans-126.6130.4171.852.90000108.7R161T154-R161 PolarHBondContact N-O 3.08Å; T154-R161 VanDerWaalsContact N-O 3.13Å; T154-R161 PolarHBondContact O-N 3.17Å
155T64.2Low55.5Low102 Ų102119 Ų11963%0.62666%0.657SS**EExtended strand (participates in β ladder)trans-96.6122173.443.50000109.5E159 T160T155-E159 WeakPolarHBondContact CA-O 3.47Å; T155-T160 HydrophobicContact CG2-CG2 4.12Å; T155-T160 WeakPolarHBondContact CG2-OG1 3.46Å
156V69.9Low55.7Low98 Ų98121.9 Ų121.959%0.59466%0.658SS**EExtended strand (participates in β ladder)trans-129.2128.8171.5-176.70000106.9G158 E159V156-G158 VanDerWaalsContact C-N 3.3Å; V156-G158 PolarHBondContact O-N 3.47Å; V156-E159 PolarHBondContact N-O 2.98Å; V156-E159 VanDerWaalsContact N-O 3.15Å; V156-E159 PolarHBondContact O-N 3.13Å; V156-E159 VanDerWaalsContact O-N 3.13Å
157N71.2Confident55.6Low163 Ų163125.6 Ų125.687%0.87267%0.666SS**THydrogen-bonded Turntrans55.434.6-177.3-62.8-19.7000115.5E159N157-E159 PolarHBondContact O-N 3.4Å
158G79.8Confident55.4Low78 Ų78120.8 Ų120.880%0.80466%0.657SS**THydrogen-bonded Turntrans76.6-0.2-179.500000114.6V156V156-G158 VanDerWaalsContact C-N 3.3Å; V156-G158 PolarHBondContact O-N 3.47Å
159E51.6Low55Low115 Ų115116.5 Ų116.554%0.53765%0.651SS.*EExtended strand (participates in β ladder)trans-98.4123.1170.7-71.4-169161.300111T155 V156 N157 R161T155-E159 WeakPolarHBondContact CA-O 3.47Å; V156-E159 PolarHBondContact N-O 2.98Å; V156-E159 VanDerWaalsContact N-O 3.15Å; V156-E159 PolarHBondContact O-N 3.13Å; V156-E159 VanDerWaalsContact O-N 3.13Å; N157-E159 PolarHBondContact O-N 3.4Å; E159-R161 PolarHBondContact O-N 3.09Å; E159-R161 IonicContact OE2-NE 3.68Å; E159-R161 IonicContact OE2-NH2 3.34Å; E159-R161 PolarHBondContact OE2-NH2 3.36Å
160T71.4Confident54.7Low94 Ų94119 Ų11958%0.57766%0.656SS**EExtended strand (participates in β ladder)trans-80.6113.5171.3-47.50000109.4A153 T155A153-T160 HydrophobicContact CB-CG2 4.21Å; T155-T160 HydrophobicContact CG2-CG2 4.12Å; T155-T160 WeakPolarHBondContact CG2-OG1 3.46Å
161R56.7Low54.8Low161 Ų161120.6 Ų120.661%0.60866%0.659SS**EExtended strand (participates in β ladder)trans-104.8128.9171.3-65.8-172176.1-171.2-0.2109.8T154 E159T154-R161 PolarHBondContact N-O 3.08Å; T154-R161 VanDerWaalsContact N-O 3.13Å; T154-R161 PolarHBondContact O-N 3.17Å; E159-R161 PolarHBondContact O-N 3.09Å; E159-R161 IonicContact OE2-NE 3.68Å; E159-R161 IonicContact OE2-NH2 3.34Å; E159-R161 PolarHBondContact OE2-NH2 3.36Å
162V71.8Confident54.5Low88 Ų88124.1 Ų124.153%0.53367%0.669SS.*EExtended strand (participates in β ladder)trans-101.5113.5178.1-177.40000108.4T151T151-V162 HydrophobicContact CG2-CG1 3.57Å
163L50.4Low53.9Low127 Ų127119.6 Ų119.667%0.66567%0.672SS**EExtended strand (participates in β ladder)trans-90.3113169.3-77.7166.4000108.8R152R152-L163 PolarHBondContact O-N 3.31Å
164C52Low53Low93 Ų93124 Ų12463%0.62869%0.687SS**EExtended strand (participates in β ladder)trans-97.9106.3168.8-75.50000108.9
165A41Very low51.8Low69 Ų69126.4 Ų126.457%0.5770%0.704SS**EExtended strand (participates in β ladder)trans-93.3117.2167.700000109.2
166W45.3Very low50.8Low216 Ų216127.8 Ų127.882%0.81871%0.711SS**  trans-92.8108166.5-93.251.7000108.8L168W166-L168 PolarHBondContact O-N 3.18Å
167L38.4Very low49.6Very low160 Ų160129.2 Ų129.284%0.83872%0.72SS**  trans-85.6103.3167.1-86.3156.4000108.4C169L167-C169 PolarHBondContact O-N 3.09Å
168L38.5Very low48.2Very low142 Ų142126 Ų12674%0.74372%0.717SS**  trans-84101.3162.8-92154.5000107.9W166 L170W166-L168 PolarHBondContact O-N 3.18Å; L168-L170 PolarHBondContact O-N 3.41Å; L168-L170 VanDerWaalsContact O-N 3.14Å
169C38Very low46.5Very low105 Ų105127.2 Ų127.271%0.70972%0.719SS**  trans-71.5100.7167.7-670000109.3L167 H171L167-C169 PolarHBondContact O-N 3.09Å; C169-H171 PolarHBondContact O-N 3.47Å
170L38.9Very low46.3Very low144 Ų144127 Ų12775%0.75474%0.737SS**  trans-83.295159.2-93.1134.1000107.8L168L168-L170 PolarHBondContact O-N 3.41Å; L168-L170 VanDerWaalsContact O-N 3.14Å
171H40Very low45Very low175 Ų175126.3 Ų126.381%0.8175%0.749SS**  trans-81.3113.2161.5-95.8-83.7000108.1C169C169-H171 PolarHBondContact O-N 3.47Å
172H39.7Very low45.1Very low164 Ų164122.6 Ų122.676%0.75976%0.761SS**  trans-81.5119.4156.5-77.87.1000107.5
173A38.1Very low43.9Very low93 Ų93121.8 Ų121.877%0.76977%0.77SS**  trans-99.3110.6166.500000107.3
174D47.6Very low44Very low158 Ų158124 Ų12485%0.84578%0.783SS**  trans-75.2132163.3-75-39.7000109
175P42.9Very low44Very low110 Ų110122.5 Ų122.571%0.71478%0.783SS**  trans-97.9170.2154.233.4-21.3000109.6
176V43.9Very low44.5Very low130 Ų130130.7 Ų130.779%0.78880%0.799SS**  trans96.190.7165.1-167.50000115
177T45.3Very low44.7Very low128 Ų128126.2 Ų126.279%0.78580%0.795SS**  164101.8102.4-53.60000108.8
178A40.9Very low45.2Very low96 Ų96123 Ų12379%0.79379%0.792SS**  trans-93.7153.5163.800000109.4
179A44.4Very low46.1Very low104 Ų104122 Ų12286%0.8679%0.792SS**  trans85.778.7166.500000118.3
180A48.1Very low46.6Very low109 Ų109122.6 Ų122.690%0.90179%0.794SS**  -89144.9129.500000106.5
181G42.8Very low47.5Very low81 Ų81124 Ų12484%0.83580%0.801SS**  cis176148.25.400000104.7
182G59.3Low47.7Very low83 Ų83122.6 Ų122.686%0.85680%0.8SS**  trans177.184.2-18000000110.8
183G46.5Very low48.4Very low70 Ų70119.5 Ų119.572%0.72279%0.794SS**  trans-81.5154.3168.400000111.2
184D53.1Low49.2Very low175 Ų175120.2 Ų120.294%0.93679%0.793SS**  172.6141.5104-99.8-22.7000111.2
185G52.2Low49.3Very low61 Ų61117.5 Ų117.563%0.62978%0.784SS**  trans111.6101.3132.400000118.9
186R50.4Low49.6Very low240 Ų240119.9 Ų119.991%0.90679%0.79SS**  trans77.4139.2134.3-63.3-176.7173.1148.3-1.3117
187T49.7Very low49.5Very low122 Ų122122.1 Ų122.175%0.74879%0.79SS**  cis-173145.45.610.70000108.4
188A49.1Very low49.5Very low92 Ų92122.9 Ų122.976%0.7679%0.788SS**  trans66.5140.5140.200000118.2
189V56.8Low49.6Very low123 Ų123123.4 Ų123.475%0.74578%0.782SS**  cis-157.8148.223.7173.70000108.1
190P49.2Very low49.8Very low116 Ų116125 Ų12575%0.75378%0.781SS**  trans-105.1147.8171.436.9-26.7000112.9
191L57.4Low49.8Very low173 Ų173130.2 Ų130.291%0.90678%0.777SS**  trans-144.1111161.3-73.6176.1000110.2
192D45.3Very low50.3Low146 Ų146132.7 Ų132.778%0.78178%0.779SS**  trans-80.6-179.7150.6-151.828.4000107
193P53.2Low50.2Low99 Ų99135.3 Ų135.364%0.64377%0.769SS**  cis-149.6176.216.643.1-20.3000119.6
194S54.8Low50.3Low108 Ų108139.3 Ų139.376%0.75577%0.769SS**  trans105.2150.2131.9-80.60000122.5
195P50.9Low50.1Low101 Ų101142.3 Ų142.366%0.65677%0.767SS**  trans-121.6161.3-151.940.3-25.2000114
196L49.3Very low50.4Low160 Ų160146.3 Ų146.384%0.83878%0.78SS**  trans-156.8114.9156.7-69.1-177.3000110.5
197F41.7Very low50.7Low177 Ų177141.5 Ų141.578%0.77678%0.776SS**  65.6118100.9-78.7-83.4000117.1
198L45.5Very low51.2Low144 Ų144139 Ų13975%0.75478%0.775SS**  156.2113.8112-80-178.8000113.8
199T41.2Very low51.5Low108 Ų108140.2 Ų140.266%0.66378%0.775SS**  49.3123.5129.2680000121.3
200T48.8Very low51.3Low137 Ų137138.6 Ų138.684%0.8478%0.775SS**  174.3130.899.733.60000113.1
201R48.7Very low51.6Low218 Ų218141.1 Ų141.182%0.82378%0.782SS**  trans13.9144.9157.4-80.3178.5170.2168.2-2.8122.1
202P53.3Low51.5Low134 Ų134139 Ų13987%0.8778%0.782SS**  -121148.212735.3-25.5000112.7
203E56.3Low52.1Low137 Ų137141.1 Ų141.164%0.6479%0.786SS**  trans-107.6156.2-171.7-146.4-171.212400111.3
204Q49.4Very low52.7Low155 Ų155148.2 Ų148.272%0.72480%0.8SS**  trans69.9103.3159.3-53.6-171.7-10.700117.7
205R48.9Very low52.5Low238 Ų238147.6 Ų147.690%0.89880%0.802SS**  46.6109.767.1-71.8-172.8173.1160.3-1.1114.7
206T57.6Low53.4Low145 Ų145153.6 Ų153.689%0.8981%0.811SS**  -157.5111130-61.50000108.5
207V57.2Low54.6Low139 Ų139152.1 Ų152.184%0.84281%0.813SS**PPolyproline II helixtrans-101.3120.1170.4172.20000106.1
208G61.1Low55.8Low69 Ų69153.8 Ų153.871%0.71182%0.816SS**PPolyproline II helixtrans-88133.117100000110.7
209P55.6Low57.2Low118 Ų118152.8 Ų152.877%0.76682%0.818SS**PPolyproline II helixtrans-98.4142.5172.534.9-26.9000112
210A52.3Low58.4Low89 Ų89156.7 Ų156.774%0.73683%0.826SS**  trans55.1111.3138.500000119.6
211D55.2Low59.2Low169 Ų169157.4 Ų157.490%0.90482%0.824SS**  trans-149.1110.4131.7-88.5-35.7000108.8
212S55.3Low59.6Low129 Ų129150.5 Ų150.590%0.90282%0.821SS**  trans-137.489.1173.3-83.40000108.1
213E58.4Low60.2Low189 Ų189153.3 Ų153.388%0.88382%0.822SS**  trans-119.496.3171.6-162.2173.7-160.800108.3
214R65.4Low60.7Low248 Ų248154.8 Ų154.894%0.93683%0.834SS**  trans-123.794.6161-85.6-168.2176.7-147.1-0.1108.2R216R214-R216 PolarHBondContact O-N 2.9Å
215A50.7Low61.3Low95 Ų95153.1 Ų153.179%0.78584%0.838SS**  trans-58.6115.4164.300000109.8
216R70.2Confident61.6Low227 Ų227150 Ų15086%0.85784%0.836SS**  trans-120105.2164.2-112.2-175.8178.9-169.7-0.4107.5R214 Y218R214-R216 PolarHBondContact O-N 2.9Å; R216-Y218 PolarHBondContact O-N 2.88Å
217C73.5Confident61.5Low129 Ų129148.1 Ų148.187%0.87283%0.828SS**PPolyproline II helixtrans-66.6120.2170.5-61.80000109.6
218Y66.7Low61.6Low213 Ų213152.7 Ų152.784%0.83583%0.83SS**PPolyproline II helixtrans-86.4134.4158-93.3-93.6000108.4R216 K220R216-Y218 PolarHBondContact O-N 2.88Å; Y218-K220 PolarHBondContact O-N 3.19Å
219P76.2Confident61.2Low122 Ų122155.9 Ų155.979%0.79284%0.836SS**PPolyproline II helixtrans-72125.2167.927.9-28.8000109.6
220K64.9Low61.7Low191 Ų191159.6 Ų159.683%0.8384%0.84SS**PPolyproline II helixtrans-69.4130.7172.2-81.4-175171.1-173.70110.6Y218Y218-K220 PolarHBondContact O-N 3.19Å
221D67.4Low61.8Low151 Ų151160 Ų16081%0.80784%0.835SS**  trans35.8108.4138.3-53.9-39.9000119.1
222G56.8Low61.9Low73 Ų73160.5 Ų160.575%0.75383%0.832SS**  8281113.200000118.4
223E65.3Low61.8Low193 Ų193163.8 Ų163.890%0.90283%0.833SS**  trans-134.195.9145.7-71.3-166.8171.500109.9
224L66.1Low61.9Low168 Ų168161.1 Ų161.188%0.8883%0.83SS**  trans-82.3103.6166.5-102.6142.4000108M226L224-M226 PolarHBondContact O-N 3.04Å; L224-M226 VanDerWaalsContact O-N 3.09Å
225C63Low61Low120 Ų120157.9 Ų157.981%0.81183%0.831SS**  trans-69.9100165.8-83.10000109.9
226M53.9Low61.1Low174 Ų174159.6 Ų159.686%0.85783%0.831SS**  trans-76.7112.3162.1-64.2-170.580.200109.4L224L224-M226 PolarHBondContact O-N 3.04Å; L224-M226 VanDerWaalsContact O-N 3.09Å
227S56.9Low60.6Low105 Ų105157.4 Ų157.473%0.73483%0.831SS**  trans-159.2126.2153.629.20000112.5
228R58.3Low59.3Low234 Ų234157.9 Ų157.988%0.88383%0.829SS**  trans94.682.6160.3-62-179.2164.7-170.4-5.4118.2
229T52.5Low58.7Low136 Ų136159 Ų15983%0.83483%0.832SS**  -16.8132.6125.3250000115.7
230K67.2Low57.1Low196 Ų196158.4 Ų158.485%0.85283%0.831SS**  170.1170.5103.7-122.2-169.2-179.5-1780111.1
231P54.9Low56.2Low97 Ų97152.3 Ų152.363%0.6382%0.822SS**  -126.3-178.4-10442.4-25.1000114.1
232E55.7Low55.3Low181 Ų181151.1 Ų151.185%0.84682%0.82SS**  trans70.484.3146.7-152.8169.2-157.600117.1
233E53.8Low55.3Low197 Ų197154.9 Ų154.992%0.92182%0.823SS**  trans-121.1123.2155.6-74.7-169169.100111.2
234T60.3Low55.1Low134 Ų134149.3 Ų149.382%0.82280%0.802SS**  trans-54.4144.6-179180000115.1V236T234-V236 PolarHBondContact O-N 3.06Å
235L47.4Very low55.3Low180 Ų180148.6 Ų148.694%0.94279%0.794SS**  trans-43.9119.5171.5-62.3162.6000112.9
236V52.7Low55.6Low131 Ų131148.6 Ų148.679%0.79479%0.785SS**  trans-113.2117.4159.7178.10000107.4T234 V238T234-V236 PolarHBondContact O-N 3.06Å; V236-V238 PolarHBondContact O-N 3.01Å
237E58.5Low56.5Low181 Ų181144 Ų14485%0.84677%0.767SS**  trans-57.7114.9173.6-75.9-176.9146.200110.8R239E237-R239 PolarHBondContact O-N 2.7Å; E237-R239 VanDerWaalsContact O-N 3.09Å
238V47.2Very low57.7Low139 Ų139149.6 Ų149.684%0.84277%0.772SS**  trans-73.798.2171.6178.40000108.4V236 S240V236-V238 PolarHBondContact O-N 3.01Å; V238-S240 PolarHBondContact O-N 2.79Å
239R53.1Low59Low235 Ų235141.4 Ų141.489%0.88775%0.749SS**  trans-63.8111.6167.4-60.2179.886.1177.96.6108.5E237 G241E237-R239 PolarHBondContact O-N 2.7Å; E237-R239 VanDerWaalsContact O-N 3.09Å; R239-G241 PolarHBondContact O-N 3.01Å
240S44.2Very low60.4Low111 Ų111139.4 Ų139.478%0.77674%0.737SS**  trans-73.393.6174.269.20000110.6V238V238-S240 PolarHBondContact O-N 2.79Å
241G45.3Very low61.3Low63 Ų63134.5 Ų134.565%0.64972%0.716SS**  trans-80.4116.3164.600000109.9R239 D243R239-G241 PolarHBondContact O-N 3.01Å; G241-D243 PolarHBondContact O-N 2.86Å
242V48.9Very low62.9Low125 Ų125132.9 Ų132.976%0.75871%0.706SS**  trans-82.2102.2172.7-174.80000108V244V242-V244 HydrophobicContact CG1-CG2 3.99Å; V242-V244 PolarHBondContact O-N 3.5Å
243D55.8Low64.6Low152 Ų152128 Ų12881%0.81369%0.686SS**  trans-70.593.6173.7-70.3-37000110.4G241 Q245G241-D243 PolarHBondContact O-N 2.86Å; D243-Q245 PolarHBondContact O-N 3.02Å
244V61.1Low66.4Low77 Ų77127.9 Ų127.947%0.46768%0.677SS.*  trans-89.899168.1-174.60000108.3V242 I246 V265V242-V244 HydrophobicContact CG1-CG2 3.99Å; V242-V244 PolarHBondContact O-N 3.5Å; V244-I246 PolarHBondContact O-N 3.08Å; V244-V265 HydrophobicContact CG1-CG1 4.1Å
245Q71.4Confident67.8Low152 Ų152125.4 Ų125.471%0.7166%0.658SS**  trans-76.1112.5168.8-73.8-173.65.900109.8D243 T247D243-Q245 PolarHBondContact O-N 3.02Å; Q245-T247 PolarHBondContact O-N 3.37Å
246I69.5Low69.8Low121 Ų121121.8 Ų121.862%0.62165%0.654SS**BIsolated β-bridgetrans-81.9103.4167.7-59.7176.3000107.4V244 Y263V244-I246 PolarHBondContact O-N 3.08Å; I246-Y263 HydrophobicContact CG2-CD1 3.43Å; I246-Y263 VanDerWaalsContact CG2-CD1 3.43Å; I246-Y263 HydrophobicContact CG2-CE1 4.12Å; I246-Y263 HydrophobicContact CG2-CG 3.99Å
247T73.1Confident71.6Confident77 Ų77119.1 Ų119.147%0.47265%0.653SS.*  trans-78.7157.7172.2-26.10000110.1Q245Q245-T247 PolarHBondContact O-N 3.37Å
248R81.4Confident72.9Confident222 Ų222114.7 Ų114.784%0.83864%0.638SS**  trans-40.3144.3-175.8-66.2179.7179177.60113.5T250R248-T250 PolarHBondContact O-N 3.48Å
249P85.5Confident74.9Confident62 Ų62114.9 Ų114.940%0.40362%0.624SS.*  trans-57.7130.8-179.924.1-32.4000110.3F262 Y263P249-F262 CarbonylContact C-O 3.57Å; P249-F262 VanDerWaalsContact CA-O 3.31Å; P249-F262 WeakPolarHBondContact CA-O 3.47Å; P249-Y263 HydrophobicContact CB-CD1 4.18Å; P249-Y263 HydrophobicContact CB-CE1 3.86Å; P249-Y263 HydrophobicContact CG-CE1 4.15Å
250T82.5Confident76.7Confident95 Ų95106.8 Ų106.858%0.58360%0.597SS**SBendtrans-74.3-37-174.9-49.50000111.4R248 F262 P264R248-T250 PolarHBondContact O-N 3.48Å; T250-F262 PolarHBondContact N-O 3.26Å; T250-P264 WeakPolarHBondContact OG1-CD 3.39Å
251F85.9Confident78.9Confident93 Ų93105.2 Ų105.241%0.40858%0.577SS.*EExtended strand (participates in β ladder)trans-160.5158.117355.5-85.2000110.3F262 L301F251-F262 AromaticContact CD2-CD2 3.71Å; F251-F262 HydrophobicContact CD2-CD2 3.71Å; F251-F262 HydrophobicContact CD2-CE2 4.29Å; F251-F262 HydrophobicContact CD2-CG 4.5Å; F251-F262 HydrophobicContact CE1-CB 4.29Å; F251-F262 HydrophobicContact CE2-CB 4.28Å; F251-F262 AromaticContact CE2-CD2 3.23Å; F251-F262 HydrophobicContact CE2-CD2 3.23Å; F251-F262 AromaticContact CE2-CE2 3.66Å; F251-F262 HydrophobicContact CE2-CE2 3.66Å; F251-F262 AromaticContact CE2-CG 3.84Å; F251-F262 HydrophobicContact CE2-CG 3.84Å; F251-F262 HydrophobicContact CZ-CB 4.05Å; F251-F262 AromaticContact CZ-CD2 3.79Å; F251-F262 HydrophobicContact CZ-CD2 3.79Å; F251-F262 HydrophobicContact CZ-CE2 4.4Å; F251-F262 AromaticContact CZ-CG 3.88Å; F251-F262 HydrophobicContact CZ-CG 3.88Å; F251-F262 PolarHBondContact O-N 3.48Å; F251-L301 HydrophobicContact CZ-CD2 4.17Å
252S88.3Confident81.1Confident62 Ų62105.6 Ų105.643%0.43456%0.561SS.*EExtended strand (participates in β ladder)trans-119.8132.9172.665.20000110.6M260S252-M260 CarbonylContact C-O 3.52Å; S252-M260 VanDerWaalsContact CA-O 3.24Å; S252-M260 WeakPolarHBondContact CA-O 3.4Å
253L90.8Very high83Confident80 Ų80105 Ų10542%0.41955%0.546SS..EExtended strand (participates in β ladder)trans-110.9135.2179.4-173.563.8000109.3I255 M260 F262L253-I255 HydrophobicContact CD2-CD1 3.72Å; L253-I255 HydrophobicContact CD2-CG1 4.12Å; L253-I255 HydrophobicContact CG-CD1 4.2Å; L253-I255 HydrophobicContact CG-CG1 4.03Å; L253-M260 PolarHBondContact N-O 3.38Å; L253-M260 PolarHBondContact O-N 3.16Å; L253-F262 HydrophobicContact CB-CE2 4.18Å
254R91.4Very high84.5Confident193 Ų193100.3 Ų100.373%0.72852%0.524SS*.EExtended strand (participates in β ladder)trans-108.7122171.3-79.6-173.2-176.6178.40.9109.9V258 R259R254-V258 VanDerWaalsContact CA-O 3.29Å; R254-V258 WeakPolarHBondContact CA-O 3.29Å; R254-R259 HydrophobicContact CG-CB 4.23Å; R254-R259 HydrophobicContact CG-CG 4.38Å
255I89.2Confident85.4Confident82 Ų82101.3 Ų101.342%0.42153%0.53SS..EExtended strand (participates in β ladder)trans-129125.5174.1-58.1176.9000107.4L253 G257 V258L253-I255 HydrophobicContact CD2-CD1 3.72Å; L253-I255 HydrophobicContact CD2-CG1 4.12Å; L253-I255 HydrophobicContact CG-CD1 4.2Å; L253-I255 HydrophobicContact CG-CG1 4.03Å; I255-G257 PolarHBondContact O-N 2.98Å; I255-G257 VanDerWaalsContact O-N 3.16Å; I255-V258 PolarHBondContact N-O 3.02Å; I255-V258 WeakPolarHBondContact O-CB 3.35Å; I255-V258 PolarHBondContact O-N 3.34Å
256A91Very high86Confident105 Ų105101.2 Ų101.287%0.86853%0.527SS*.THydrogen-bonded Turntrans50.638.5179.600000114.4V258A256-V258 PolarHBondContact O-N 3.49Å
257G90.7Very high86.3Confident75 Ų75105.9 Ų105.977%0.77354%0.537SS*.THydrogen-bonded Turntrans81.2-10.7-178.100000115.1I255I255-G257 PolarHBondContact O-N 2.98Å; I255-G257 VanDerWaalsContact O-N 3.16Å
258V84.9Confident85.4Confident88 Ų88109.8 Ų109.853%0.53355%0.552SS.*EExtended strand (participates in β ladder)trans-86.6128.3177.1-174.70000109.9R254 I255 A256R254-V258 VanDerWaalsContact CA-O 3.29Å; R254-V258 WeakPolarHBondContact CA-O 3.29Å; I255-V258 PolarHBondContact N-O 3.02Å; I255-V258 WeakPolarHBondContact O-CB 3.35Å; I255-V258 PolarHBondContact O-N 3.34Å; A256-V258 PolarHBondContact O-N 3.49Å
259R89.3Confident84.3Confident143 Ų143106.5 Ų106.554%0.5455%0.549SS..EExtended strand (participates in β ladder)trans-94.3113.2176.5-173.8-177-176.9-167.2-0.1110R254R254-R259 HydrophobicContact CG-CB 4.23Å; R254-R259 HydrophobicContact CG-CG 4.38Å
260M89.6Confident83.3Confident65 Ų65115 Ų11532%0.3257%0.573SS.*EExtended strand (participates in β ladder)trans-95.2138.9169.5-67-174.7176.200110.3S252 L253 F262S252-M260 CarbonylContact C-O 3.52Å; S252-M260 VanDerWaalsContact CA-O 3.24Å; S252-M260 WeakPolarHBondContact CA-O 3.4Å; L253-M260 PolarHBondContact N-O 3.38Å; L253-M260 PolarHBondContact O-N 3.16Å; M260-F262 HydrophobicContact CB-CE2 4.22Å; M260-F262 HydrophobicContact CB-CZ 4.48Å
261Q91.8Very high81.9Confident78 Ų78113.8 Ų113.836%0.36458%0.579SS.*EExtended strand (participates in β ladder)trans-122.2133.6177.7-63.1-178.89.400109.2Y263Q261-Y263 HydrophobicContact CB-CE2 3.84Å; Q261-Y263 PolarHBondContact OE1-OH 3.07Å
262F90.3Very high80.3Confident71 Ų71117.2 Ų117.231%0.31160%0.6SS.*EExtended strand (participates in β ladder)trans-108.8128.7179.4-62.5-88.9000109.7P249 T250 F251 L253 M260P249-F262 CarbonylContact C-O 3.57Å; P249-F262 VanDerWaalsContact CA-O 3.31Å; P249-F262 WeakPolarHBondContact CA-O 3.47Å; T250-F262 PolarHBondContact N-O 3.26Å; F251-F262 AromaticContact CD2-CD2 3.71Å; F251-F262 HydrophobicContact CD2-CD2 3.71Å; F251-F262 HydrophobicContact CD2-CE2 4.29Å; F251-F262 HydrophobicContact CD2-CG 4.5Å; F251-F262 HydrophobicContact CE1-CB 4.29Å; F251-F262 HydrophobicContact CE2-CB 4.28Å; F251-F262 AromaticContact CE2-CD2 3.23Å; F251-F262 HydrophobicContact CE2-CD2 3.23Å; F251-F262 AromaticContact CE2-CE2 3.66Å; F251-F262 HydrophobicContact CE2-CE2 3.66Å; F251-F262 AromaticContact CE2-CG 3.84Å; F251-F262 HydrophobicContact CE2-CG 3.84Å; F251-F262 HydrophobicContact CZ-CB 4.05Å; F251-F262 AromaticContact CZ-CD2 3.79Å; F251-F262 HydrophobicContact CZ-CD2 3.79Å; F251-F262 HydrophobicContact CZ-CE2 4.4Å; F251-F262 AromaticContact CZ-CG 3.88Å; F251-F262 HydrophobicContact CZ-CG 3.88Å; F251-F262 PolarHBondContact O-N 3.48Å; L253-F262 HydrophobicContact CB-CE2 4.18Å; M260-F262 HydrophobicContact CB-CE2 4.22Å; M260-F262 HydrophobicContact CB-CZ 4.48Å
263Y90.5Very high77.9Confident112 Ų112117.3 Ų117.344%0.43961%0.611SS.*  trans-112.4129.3179.3-66.9-90.7000109.6I246 P249 Q261 V265I246-Y263 HydrophobicContact CG2-CD1 3.43Å; I246-Y263 VanDerWaalsContact CG2-CD1 3.43Å; I246-Y263 HydrophobicContact CG2-CE1 4.12Å; I246-Y263 HydrophobicContact CG2-CG 3.99Å; P249-Y263 HydrophobicContact CB-CD1 4.18Å; P249-Y263 HydrophobicContact CB-CE1 3.86Å; P249-Y263 HydrophobicContact CG-CE1 4.15Å; Q261-Y263 HydrophobicContact CB-CE2 3.84Å; Q261-Y263 PolarHBondContact OE1-OH 3.07Å; Y263-V265 PolarHBondContact O-N 3.49Å
264P85.5Confident75.4Confident53 Ų53121.1 Ų121.134%0.34463%0.632SS.*  trans-72.2126.9171.829.9-29000108.6T250T250-P264 WeakPolarHBondContact OG1-CD 3.39Å
265V81.4Confident72.9Confident98 Ų98116.8 Ų116.859%0.59464%0.637SS**BIsolated β-bridgetrans-98.3104.5172.3-1780000107.8V244 Y263 R267V244-V265 HydrophobicContact CG1-CG1 4.1Å; Y263-V265 PolarHBondContact O-N 3.49Å; V265-R267 HydrophobicContact CG1-CG 4.49Å
266K83.1Confident70.6Confident151 Ų151121.6 Ų121.666%0.65766%0.66SS**  trans-89.6105.2173.8-166.5173-175.9178.10108.5
267R76.9Confident67.9Low218 Ų218122.4 Ų122.482%0.82366%0.66SS**  trans-82.4117.7166.4-72.4-172.3178.8-179.10.3108.6V265V265-R267 HydrophobicContact CG1-CG 4.49Å
268M53.9Low65.3Low159 Ų159124.4 Ų124.478%0.78366%0.661SS**  trans-89.4106166.3-109.5170.947.500108R270M268-R270 PolarHBondContact O-N 3.33Å
269I58.4Low63.2Low154 Ų154125.3 Ų125.379%0.7967%0.672SS**  trans-83.9108.7163.4-59176.1000105.8G271I269-G271 PolarHBondContact O-N 3.17Å
270R64.8Low60.4Low241 Ų241127.5 Ų127.591%0.90968%0.681SS**THydrogen-bonded Turntrans-73.9108176.6-150.3176-173.2170.60.6106.9M268M268-R270 PolarHBondContact O-N 3.33Å
271G52.5Low57.8Low68 Ų68129.6 Ų129.670%0.70170%0.702SS**THydrogen-bonded Turntrans158.2-6.8171.200000120.4I269I269-G271 PolarHBondContact O-N 3.17Å
272I51.1Low55Low165 Ų165133.2 Ų133.285%0.84672%0.72SS**  trans-136.8122.4178-61.2178.9000109
273G39.5Very low52.2Low65 Ų65135.8 Ų135.867%0.6774%0.741SS**  trans-59.2148.6-18000000112.9
274D38.1Very low49.4Very low160 Ų160139 Ų13986%0.85677%0.765SS**SBendtrans52104.6165.2-59.3-19.3000118.4
275A38.1Very low47Very low101 Ų101144 Ų14484%0.83579%0.789SS**  trans56.273.3145.700000118.1
276M40.3Very low44.5Very low183 Ų183142.7 Ų142.790%0.90180%0.795SS**  trans-148.1116.1147.8-88.1-150.9-7400113S278M276-S278 PolarHBondContact O-N 3.34Å
277S36.1Very low42.1Very low123 Ų123142.1 Ų142.186%0.8681%0.808SS**  trans-70.5103.2160.341.10000109.3
278S35.9Very low40Very low116 Ų116144 Ų14481%0.81182%0.816SS**  trans-92114.3176.1-175.70000110.7M276M276-S278 PolarHBondContact O-N 3.34Å
279S39.7Very low39.3Very low108 Ų108141 Ų14176%0.75582%0.816SS**  trans-102.9112.6168.7-53.90000108
280Y31.7Very low38.3Very low188 Ų188146.1 Ų146.174%0.73783%0.825SS**  trans-74.7123.7179.2-173.9-102.5000111Q282Y280-Q282 HydrophobicContact CE1-CB 4.44Å; Y280-Q282 HydrophobicContact CE1-CG 3.72Å; Y280-Q282 WeakPolarHBondContact OH-CG 3.45Å; Y280-Q282 PolarHBondContact OH-NE2 2.93Å
281S34.6Very low37.2Very low109 Ų109138.4 Ų138.476%0.76281%0.813SS**  trans-126.1120.4166.149.10000109.8
282Q33.3Very low36.8Very low155 Ų155147.3 Ų147.372%0.72483%0.825SS**  trans-80.1142.7170.5-101.5175.67.200110.6Y280Y280-Q282 HydrophobicContact CE1-CB 4.44Å; Y280-Q282 HydrophobicContact CE1-CG 3.72Å; Y280-Q282 WeakPolarHBondContact OH-CG 3.45Å; Y280-Q282 PolarHBondContact OH-NE2 2.93Å
283T30.1Very low36.4Very low125 Ų125146.3 Ų146.377%0.76782%0.821SS**  trans-66.3129.1-16843.30000115.2
284L32.1Very low37.3Very low179 Ų179148.7 Ų148.794%0.93782%0.815SS**  trans-117131.2144.5-87.8170.1000108.4
285N35.2Very low38.8Very low159 Ų159144.4 Ų144.485%0.8580%0.795SS**  trans-63.6143.2-166.8-74.1-42.7000114.5
286G29.5Very low40.2Very low70 Ų70143.9 Ų143.972%0.72278%0.784SS**  trans77.395.4139.100000117.8
287C33.2Very low41.7Very low138 Ų138138.7 Ų138.793%0.93277%0.765SS**  trans-176.2114.6130.6-99.10000110.6A289C287-A289 PolarHBondContact O-N 3.34Å
288R32.5Very low43.5Very low259 Ų259135.5 Ų135.598%0.97774%0.741SS**  trans-73.9115.7168.1-87.1-179.2176.5-171.50.1108.8
289A39.6Very low45.3Very low95 Ų95134.6 Ų134.679%0.78572%0.723SS**  trans-148.5123.4153.700000109C287 A291C287-A289 PolarHBondContact O-N 3.34Å; A289-A291 PolarHBondContact O-N 3.5Å
290R36.2Very low47.3Very low261 Ų261134.5 Ų134.599%0.98571%0.713SS**  trans-71.4109.5176.8-75.5177.3169.8179.5-3.3108.8
291A41.6Very low49.7Very low79 Ų79129.8 Ų129.865%0.65370%0.7SS**  trans-145.8143.6162.500000108.8A289 L293A289-A291 PolarHBondContact O-N 3.5Å; A291-L293 PolarHBondContact O-N 3.34Å; A291-L293 VanDerWaalsContact O-N 3.14Å
292R45.4Very low52.2Low255 Ų255128.3 Ų128.396%0.96269%0.687SS**  trans-45.3114.5-172.9-70.4175.6172.4-135.9-0.6111.5E294R292-E294 PolarHBondContact O-N 3.35Å
293L41.7Very low54.7Low144 Ų144123.1 Ų123.175%0.75467%0.67SS**  trans-77.2115.3-179.2-105.992.3000110.3A291A291-L293 PolarHBondContact O-N 3.34Å; A291-L293 VanDerWaalsContact O-N 3.14Å
294E58.2Low57.5Low116 Ų116120.2 Ų120.254%0.54265%0.652SS.*  trans-55.7145.9157.2-75.2-66.6129.200110.2R292 Q299R292-E294 PolarHBondContact O-N 3.35Å; E294-Q299 PolarHBondContact O-NE2 3.49Å
295P69.6Low60Low69 Ų69114.2 Ų114.245%0.44863%0.628SS.*  trans-54.9141.4-179.316.8-26.7000111.3S297 V298P295-S297 PolarHBondContact O-N 2.98Å; P295-V298 HydrophobicContact CG-CG2 3.95Å; P295-V298 PolarHBondContact O-N 3.23Å
296P68.3Low62.5Low91 Ų91110.5 Ų110.559%0.59161%0.608SS**Hα-helixtrans-53.1-29.4-172.4-26.632.1000114.5V298 Q299 I300P296-V298 VanDerWaalsContact C-N 3.33Å; P296-V298 PolarHBondContact O-N 3.43Å; P296-Q299 PolarHBondContact O-N 2.94Å; P296-I300 WeakPolarHBondContact O-CG1 3.48Å; P296-I300 PolarHBondContact O-N 3.3Å; P296-I300 VanDerWaalsContact O-N 3.13Å
297S71.4Confident65.4Low73 Ų73112.3 Ų112.351%0.5160%0.6SS.*Hα-helixtrans-62.6-36.9177.1510000113.1P295 L301P295-S297 PolarHBondContact O-N 2.98Å; S297-L301 WeakPolarHBondContact O-CD1 3.34Å; S297-L301 WeakPolarHBondContact O-CG 3.39Å; S297-L301 PolarHBondContact O-N 3.49Å; S297-L301 VanDerWaalsContact O-N 3.1Å
298V73.7Confident67.9Low57 Ų57109.2 Ų109.235%0.34557%0.572SS.*Hα-helixtrans-72.5-40.3-180179.60000110.1P295 P296 I300 L301 V302P295-V298 HydrophobicContact CG-CG2 3.95Å; P295-V298 PolarHBondContact O-N 3.23Å; P296-V298 VanDerWaalsContact C-N 3.33Å; P296-V298 PolarHBondContact O-N 3.43Å; V298-I300 VanDerWaalsContact C-N 3.34Å; V298-I300 PolarHBondContact O-N 3.46Å; V298-L301 PolarHBondContact O-N 3.32Å; V298-V302 HydrophobicContact CG1-CG2 4.39Å; V298-V302 VanDerWaalsContact O-CG2 3.29Å; V298-V302 WeakPolarHBondContact O-CG2 3.29Å; V298-V302 PolarHBondContact O-N 2.89Å
299Q74Confident70.6Confident96 Ų96101.7 Ų101.745%0.44955%0.554SS.*Hα-helixtrans-63-41177.4-60.6-174.625.500111.8E294 P296 V302 A303E294-Q299 PolarHBondContact O-NE2 3.49Å; P296-Q299 PolarHBondContact O-N 2.94Å; Q299-V302 PolarHBondContact O-N 2.97Å; Q299-A303 WeakPolarHBondContact O-CB 3.33Å; Q299-A303 PolarHBondContact O-N 2.97Å
300I82Confident73Confident107 Ų107105.9 Ų105.955%0.54955%0.549SS..Hα-helixtrans-65.7-44.1176.5-65.9166.2000110.9P296 V298 V302 A303 V304P296-I300 WeakPolarHBondContact O-CG1 3.48Å; P296-I300 PolarHBondContact O-N 3.3Å; P296-I300 VanDerWaalsContact O-N 3.13Å; V298-I300 VanDerWaalsContact C-N 3.34Å; V298-I300 PolarHBondContact O-N 3.46Å; I300-V302 VanDerWaalsContact C-N 3.35Å; I300-V302 PolarHBondContact O-N 2.99Å; I300-A303 PolarHBondContact O-N 3.38Å; I300-V304 HydrophobicContact CG2-CG2 4.36Å; I300-V304 VanDerWaalsContact O-CG2 3.31Å; I300-V304 WeakPolarHBondContact O-CG2 3.34Å; I300-V304 PolarHBondContact O-N 3.13Å
301L82.4Confident75.4Confident88 Ų8897 Ų9746%0.46153%0.525SS..Hα-helixtrans-60.4-43.5177-83159.2000112.1F251 S297 V298 V304 A305F251-L301 HydrophobicContact CZ-CD2 4.17Å; S297-L301 WeakPolarHBondContact O-CD1 3.34Å; S297-L301 WeakPolarHBondContact O-CG 3.39Å; S297-L301 PolarHBondContact O-N 3.49Å; S297-L301 VanDerWaalsContact O-N 3.1Å; V298-L301 PolarHBondContact O-N 3.32Å; L301-V304 PolarHBondContact O-N 3.29Å; L301-A305 WeakPolarHBondContact O-CB 3.3Å; L301-A305 PolarHBondContact O-N 3.07Å
302V86.2Confident77.5Confident78 Ų7898.4 Ų98.447%0.47352%0.521SS..Hα-helixtrans-64.6-43.7177.1172.70000110.9V298 Q299 I300 A305 I306V298-V302 HydrophobicContact CG1-CG2 4.39Å; V298-V302 VanDerWaalsContact O-CG2 3.29Å; V298-V302 WeakPolarHBondContact O-CG2 3.29Å; V298-V302 PolarHBondContact O-N 2.89Å; Q299-V302 PolarHBondContact O-N 2.97Å; I300-V302 VanDerWaalsContact C-N 3.35Å; I300-V302 PolarHBondContact O-N 2.99Å; V302-A305 PolarHBondContact O-N 3Å; V302-I306 HydrophobicContact CG1-CD1 3.73Å; V302-I306 HydrophobicContact CG1-CG1 4.44Å; V302-I306 VanDerWaalsContact O-CG1 3.25Å; V302-I306 WeakPolarHBondContact O-CG1 3.24Å; V302-I306 PolarHBondContact O-N 3.47Å
303A84.9Confident79.8Confident46 Ų4692.5 Ų92.538%0.3850%0.502SS..Hα-helixtrans-62.6-44.9177.500000112.4Q299 I300 A305 I306 I307Q299-A303 WeakPolarHBondContact O-CB 3.33Å; Q299-A303 PolarHBondContact O-N 2.97Å; I300-A303 PolarHBondContact O-N 3.38Å; A303-A305 PolarHBondContact O-N 3.18Å; A303-I306 PolarHBondContact O-N 3.48Å; A303-I307 WeakPolarHBondContact O-CG1 3.47Å; A303-I307 PolarHBondContact O-N 3.31Å
304V88.8Confident81.9Confident64 Ų6487.5 Ų87.539%0.38848%0.481SS..Hα-helixtrans-62.8-43.1177.3172.70000111I300 L301 I306 I307 Q308I300-V304 HydrophobicContact CG2-CG2 4.36Å; I300-V304 VanDerWaalsContact O-CG2 3.31Å; I300-V304 WeakPolarHBondContact O-CG2 3.34Å; I300-V304 PolarHBondContact O-N 3.13Å; L301-V304 PolarHBondContact O-N 3.29Å; V304-I306 PolarHBondContact O-N 3.4Å; V304-I307 PolarHBondContact O-N 3.35Å; V304-Q308 WeakPolarHBondContact O-CG 3.42Å; V304-Q308 PolarHBondContact O-N 3.18Å
305A85.8Confident83.3Confident53 Ų5387.6 Ų87.644%0.43848%0.482SS..Hα-helixtrans-62.2-43.3176.900000112.1L301 V302 A303 I307 Q308 V309L301-A305 WeakPolarHBondContact O-CB 3.3Å; L301-A305 PolarHBondContact O-N 3.07Å; V302-A305 PolarHBondContact O-N 3Å; A303-A305 PolarHBondContact O-N 3.18Å; A305-I307 PolarHBondContact O-N 3.29Å; A305-Q308 PolarHBondContact O-N 3.13Å; A305-V309 VanDerWaalsContact O-CG2 3.3Å; A305-V309 WeakPolarHBondContact O-CG2 3.45Å; A305-V309 PolarHBondContact O-N 3.45Å
306I88.3Confident84.3Confident81 Ų8189.2 Ų89.242%0.41549%0.49SS..Hα-helixtrans-62.8-42.9177.9-69.7166.9000111.2V302 A303 V304 V309 R310V302-I306 HydrophobicContact CG1-CD1 3.73Å; V302-I306 HydrophobicContact CG1-CG1 4.44Å; V302-I306 VanDerWaalsContact O-CG1 3.25Å; V302-I306 WeakPolarHBondContact O-CG1 3.24Å; V302-I306 PolarHBondContact O-N 3.47Å; A303-I306 PolarHBondContact O-N 3.48Å; V304-I306 PolarHBondContact O-N 3.4Å; I306-V309 PolarHBondContact O-N 3.46Å; I306-R310 WeakPolarHBondContact O-CG 3.31Å; I306-R310 PolarHBondContact O-N 3.47Å; I306-R310 VanDerWaalsContact O-N 3.08Å
307I88.9Confident85.3Confident108 Ų10890.7 Ų90.755%0.55449%0.489SS*.Hα-helixtrans-62.5-45.8177.8-67.6166.6000110.2A303 V304 A305 V309 R310 T311A303-I307 WeakPolarHBondContact O-CG1 3.47Å; A303-I307 PolarHBondContact O-N 3.31Å; V304-I307 PolarHBondContact O-N 3.35Å; A305-I307 PolarHBondContact O-N 3.29Å; I307-V309 PolarHBondContact O-N 3.1Å; I307-R310 PolarHBondContact O-N 3.44Å; I307-T311 PolarHBondContact O-N 3.14Å; I307-T311 PolarHBondContact O-OG1 3.27Å
308Q86.1Confident86Confident74 Ų7494.2 Ų94.235%0.34650%0.495SS..Hα-helixtrans-66.6-37.2-179.3-72.1-159-13.200113.5V304 A305 R310 T311 L312V304-Q308 WeakPolarHBondContact O-CG 3.42Å; V304-Q308 PolarHBondContact O-N 3.18Å; A305-Q308 PolarHBondContact O-N 3.13Å; Q308-R310 VanDerWaalsContact C-N 3.31Å; Q308-R310 PolarHBondContact O-N 3.41Å; Q308-T311 WeakPolarHBondContact CA-OG1 3.31Å; Q308-T311 PolarHBondContact O-N 3.2Å; Q308-T311 PolarHBondContact O-OG1 3.29Å; Q308-L312 WeakPolarHBondContact O-CB 3.37Å; Q308-L312 WeakPolarHBondContact O-CG 3.34Å; Q308-L312 PolarHBondContact O-N 2.95Å
309V90.1Very high86.3Confident100 Ų10094.8 Ų94.861%0.60651%0.513SS*.Hα-helixtrans-64.1-39.2174.1171.20000110.8A305 I306 I307 K313A305-V309 VanDerWaalsContact O-CG2 3.3Å; A305-V309 WeakPolarHBondContact O-CG2 3.45Å; A305-V309 PolarHBondContact O-N 3.45Å; I306-V309 PolarHBondContact O-N 3.46Å; I307-V309 PolarHBondContact O-N 3.1Å; V309-K313 WeakPolarHBondContact O-CB 3.25Å; V309-K313 PolarHBondContact O-N 2.9Å
310R88.5Confident86.2Confident183 Ų18395 Ų9569%0.69153%0.525SS*.Hα-helixtrans-66.8-41.8176.7-73.1177.4178.5-1750.3112.3I306 I307 Q308 K313 A314I306-R310 WeakPolarHBondContact O-CG 3.31Å; I306-R310 PolarHBondContact O-N 3.47Å; I306-R310 VanDerWaalsContact O-N 3.08Å; I307-R310 PolarHBondContact O-N 3.44Å; Q308-R310 VanDerWaalsContact C-N 3.31Å; Q308-R310 PolarHBondContact O-N 3.41Å; R310-K313 PolarHBondContact O-N 2.95Å; R310-A314 PolarHBondContact O-N 3.03Å
311T87.1Confident84.8Confident75 Ų75101.4 Ų101.446%0.4656%0.555SS.*Hα-helixtrans-66.3-41.7176.750.30000111.8I307 Q308 K313 A314 E315I307-T311 PolarHBondContact O-N 3.14Å; I307-T311 PolarHBondContact O-OG1 3.27Å; Q308-T311 WeakPolarHBondContact CA-OG1 3.31Å; Q308-T311 PolarHBondContact O-N 3.2Å; Q308-T311 PolarHBondContact O-OG1 3.29Å; T311-K313 VanDerWaalsContact C-N 3.34Å; T311-K313 PolarHBondContact O-N 3.48Å; T311-A314 PolarHBondContact O-N 3.4Å; T311-E315 WeakPolarHBondContact O-CG 3.42Å; T311-E315 PolarHBondContact O-N 3.39Å
312L86.6Confident84.9Confident109 Ų109102.1 Ų102.157%0.57156%0.56SS**Hα-helixtrans-63.8-39.9176-76.1170.6000112Q308 E315 V316Q308-L312 WeakPolarHBondContact O-CB 3.37Å; Q308-L312 WeakPolarHBondContact O-CG 3.34Å; Q308-L312 PolarHBondContact O-N 2.95Å; L312-E315 PolarHBondContact O-N 3.49Å; L312-V316 VanDerWaalsContact O-CG2 3.32Å; L312-V316 WeakPolarHBondContact O-CG2 3.47Å; L312-V316 PolarHBondContact O-N 3.09Å
313K92Very high84.8Confident130 Ų130103.3 Ų103.357%0.56556%0.564SS**Hα-helixtrans-61.2-44.2174.9-176176.8174.7-177.70111.7V309 R310 T311 E315 V316 E317V309-K313 WeakPolarHBondContact O-CB 3.25Å; V309-K313 PolarHBondContact O-N 2.9Å; R310-K313 PolarHBondContact O-N 2.95Å; T311-K313 VanDerWaalsContact C-N 3.34Å; T311-K313 PolarHBondContact O-N 3.48Å; K313-E315 PolarHBondContact O-N 3.42Å; K313-V316 PolarHBondContact O-N 3.34Å; K313-E317 WeakPolarHBondContact CE-OE1 3.29Å; K313-E317 IonicContact NZ-OE1 3.72Å; K313-E317 WeakPolarHBondContact O-CG 3.32Å; K313-E317 PolarHBondContact O-N 3.41Å
314A87.2Confident84.8Confident39 Ų39106.5 Ų106.532%0.32258%0.575SS.*Hα-helixtrans-64.7-38.7179.100000112.7R310 T311 E317 K318R310-A314 PolarHBondContact O-N 3.03Å; T311-A314 PolarHBondContact O-N 3.4Å; A314-E317 PolarHBondContact O-N 3.14Å; A314-K318 VanDerWaalsContact O-CG 3.32Å; A314-K318 WeakPolarHBondContact O-CG 3.43Å; A314-K318 PolarHBondContact O-N 3.37Å
315E88.4Confident84.6Confident119 Ų119109 Ų10956%0.55659%0.586SS**Hα-helixtrans-69-36.8176.6-69.2-61.612300112.2T311 L312 K313 K318 G319T311-E315 WeakPolarHBondContact O-CG 3.42Å; T311-E315 PolarHBondContact O-N 3.39Å; L312-E315 PolarHBondContact O-N 3.49Å; K313-E315 PolarHBondContact O-N 3.42Å; E315-K318 PolarHBondContact O-N 3.16Å; E315-K318 IonicContact OE1-NZ 3.41Å; E315-K318 PolarHBondContact OE1-NZ 3.46Å; E315-G319 PolarHBondContact O-N 3.37Å; E315-G319 VanDerWaalsContact O-N 3.13Å
316V90Very high84.5Confident103 Ų103112.5 Ų112.562%0.62460%0.595SS**Hα-helixtrans-66.4-39.2174.11720000111.6L312 K313 G319L312-V316 VanDerWaalsContact O-CG2 3.32Å; L312-V316 WeakPolarHBondContact O-CG2 3.47Å; L312-V316 PolarHBondContact O-N 3.09Å; K313-V316 PolarHBondContact O-N 3.34Å; V316-G319 PolarHBondContact O-N 3.24Å
317E88.3Confident84.3Confident121 Ų121114.6 Ų114.657%0.56561%0.607SS**Hα-helixtrans-68.2-36.4176.6-75.2174.5177.500112K313 A314 S320K313-E317 WeakPolarHBondContact CE-OE1 3.29Å; K313-E317 IonicContact NZ-OE1 3.72Å; K313-E317 WeakPolarHBondContact O-CG 3.32Å; K313-E317 PolarHBondContact O-N 3.41Å; A314-E317 PolarHBondContact O-N 3.14Å; E317-S320 PolarHBondContact O-N 3.28Å
318K87Confident83.9Confident148 Ų148115.1 Ų115.164%0.64361%0.611SS**Hα-helixtrans-69.9-30.1176-74.2175.1-172.7172.30114A314 E315 S320A314-K318 VanDerWaalsContact O-CG 3.32Å; A314-K318 WeakPolarHBondContact O-CG 3.43Å; A314-K318 PolarHBondContact O-N 3.37Å; E315-K318 PolarHBondContact O-N 3.16Å; E315-K318 IonicContact OE1-NZ 3.41Å; E315-K318 PolarHBondContact OE1-NZ 3.46Å; K318-S320 VanDerWaalsContact C-N 3.31Å
319G79.5Confident83.7Confident69 Ų69118.2 Ų118.271%0.71163%0.631SS**THydrogen-bonded Turntrans-84.41.8179.200000115.1E315 V316E315-G319 PolarHBondContact O-N 3.37Å; E315-G319 VanDerWaalsContact O-N 3.13Å; V316-G319 PolarHBondContact O-N 3.24Å
320S72.1Confident83.2Confident101 Ų101119.8 Ų119.871%0.70663%0.633SS**THydrogen-bonded Turntrans-109.69-175.3-1710000114.3E317 K318E317-S320 PolarHBondContact O-N 3.28Å; K318-S320 VanDerWaalsContact C-N 3.31Å
321M52Low82.7Confident240 Ų240114 Ų114100%1.18263%0.628SS**  trans-107.60169.8-61.6-159.791.500110.3

Retrieved 321 of 321 residues in 129.7 ms (Link to these results)