A0A077ZB54_TRITR Loading...

Uncharacterized protein

AlphaFold DB , UniProt , Accession A0A077ZB54, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 173 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
1M45.5Very low53.6Low242 Ų242181.3 Ų181.3100%1.19289%0.887SS**  0110.60-75-70.617700107.4
2Y52.1Low53.7Low241 Ų241173.7 Ų173.795%0.94588%0.875SS**  trans-69126.3172.3-71-94000108.7
3G50.4Low53.8Low77 Ų77169.8 Ų169.879%0.79487%0.869SS**  trans-124.8101.1167.800000108.1
4E51.1Low54Low206 Ų206173.9 Ų173.996%0.96387%0.87SS**  trans-70.8127.7171.5-66.3-175.6132.900110.2
5G41.3Very low54.1Low68 Ų68178.5 Ų178.570%0.70187%0.873SS**  trans162.5155.6163.200000111.4
6P54.4Low53.5Low119 Ų119170.9 Ų170.977%0.77386%0.856SS**  cis-111.7147.2-4.627.5-9.8000112.3F8P6-F8 PolarHBondContact O-N 3.41Å; P6-F8 VanDerWaalsContact O-N 3.09Å
7R59.3Low53.6Low239 Ų239175.2 Ų175.290%0.90286%0.86SS**  trans-62.3111.6173.3-67.1-174.3-176.2169.12.7109.9R9R7-R9 PolarHBondContact O-N 2.95Å
8F58.8Low52.9Low200 Ų200168.9 Ų168.988%0.87785%0.848SS**  trans-52110.4166.3-107.3-101.8000109.2P6 P10P6-F8 PolarHBondContact O-N 3.41Å; P6-F8 VanDerWaalsContact O-N 3.09Å; F8-P10 WeakPolarHBondContact O-CD 3.45Å
9R60.1Low52.5Low233 Ų233166.9 Ų166.988%0.87985%0.85SS**  trans-90.6113.3163.6-72.2-169.3179.1-169.71107.5R7 R11R7-R9 PolarHBondContact O-N 2.95Å; R9-R11 PolarHBondContact O-N 3.09Å
10P57.5Low52.5Low123 Ų123166.5 Ų166.580%0.79985%0.849SS**PPolyproline II helixtrans-61133.3175.721.8-29.6000110.3F8 A12F8-P10 WeakPolarHBondContact O-CD 3.45Å; P10-A12 PolarHBondContact O-N 2.95Å
11R59.4Low52Low246 Ų246167.3 Ų167.393%0.92885%0.849SS**PPolyproline II helixtrans-63130.7173.6-88.1-178.9171-169.7-2.2109.2R9R9-R11 PolarHBondContact O-N 3.09Å
12A54.9Low52.5Low90 Ų90161.6 Ų161.674%0.74483%0.828SS**PPolyproline II helixtrans-57.8139.2169.600000110.1P10 Y14P10-A12 PolarHBondContact O-N 2.95Å; A12-Y14 PolarHBondContact O-N 3.12Å
13P54.3Low52.3Low123 Ų123154.9 Ų154.980%0.79981%0.814SS**PPolyproline II helixtrans-61134.4-177.822.1-31000110.9R15P13-R15 PolarHBondContact O-N 3.18Å; P13-R15 VanDerWaalsContact O-N 3.07Å
14Y57.3Low52.5Low227 Ų227160.5 Ų160.589%0.8982%0.819SS**  trans-52.1110.7176.7-158.3-106.4000109.2A12 G16A12-Y14 PolarHBondContact O-N 3.12Å; Y14-G16 PolarHBondContact O-N 3.41Å
15R55.8Low52.6Low243 Ų243158.6 Ų158.692%0.91781%0.812SS**  trans-69.484.1164.4-84.8-167.6-175.7-163.32.4107.4P13 R17P13-R15 PolarHBondContact O-N 3.18Å; P13-R15 VanDerWaalsContact O-N 3.07Å; R15-R17 PolarHBondContact O-N 3.29Å
16G43.6Very low52.9Low58 Ų58158.7 Ų158.760%0.59881%0.813SS**  trans-54.9106.3157.300000107.6Y14 G18Y14-G16 PolarHBondContact O-N 3.41Å; G16-G18 PolarHBondContact O-N 3.41Å
17R55.8Low52.9Low243 Ų243163.4 Ų163.492%0.91782%0.817SS**  trans-69.496.3151.2-85.4-174.4-163.7-123.92.8104.4R15 C19R15-R17 PolarHBondContact O-N 3.29Å; R17-C19 PolarHBondContact O-N 3.06Å
18G41.3Very low52.6Low63 Ų63157.1 Ų157.165%0.64981%0.807SS**  trans-47.3126.7165.400000108.1G16 L20G16-G18 PolarHBondContact O-N 3.41Å; G18-L20 PolarHBondContact O-N 3.45Å
19C44.2Very low52.6Low130 Ų130155.7 Ų155.788%0.87881%0.807SS**  trans-50103.5149.4-78.70000105.5R17 E21R17-C19 PolarHBondContact O-N 3.06Å; C19-E21 VanDerWaalsContact C-N 3.25Å; C19-E21 PolarHBondContact O-N 2.66Å
20L53.4Low52.7Low158 Ų158152.3 Ų152.383%0.82780%0.803SS**  trans-56.8106.2155.2-78.1161.6000103.9G18 V22G18-L20 PolarHBondContact O-N 3.45Å; L20-V22 VanDerWaalsContact C-N 3.25Å; L20-V22 PolarHBondContact O-N 3.19Å
21E41.9Very low52.5Low184 Ų184151.5 Ų151.586%0.8680%0.798SS**  trans-50.6103.3157.8-84.2-145.6102.800106C19 P23C19-E21 VanDerWaalsContact C-N 3.25Å; C19-E21 PolarHBondContact O-N 2.66Å; E21-P23 VanDerWaalsContact O-CD 3.29Å; E21-P23 WeakPolarHBondContact O-CD 3.47Å
22V55.6Low52.4Low122 Ų122146.5 Ų146.574%0.73980%0.797SS**  trans-73.3115.8165.4-175.40000104L20 Q24L20-V22 VanDerWaalsContact C-N 3.25Å; L20-V22 PolarHBondContact O-N 3.19Å; V22-Q24 PolarHBondContact O-N 3.42Å
23P48.1Very low52Low100 Ų100145.5 Ų145.565%0.64980%0.795SS**  trans-56.1130.4177-20.832.3000108.1E21 M25E21-P23 VanDerWaalsContact O-CD 3.29Å; E21-P23 WeakPolarHBondContact O-CD 3.47Å; P23-M25 PolarHBondContact O-N 3.49Å
24Q54.6Low52.1Low196 Ų196148.1 Ų148.192%0.91680%0.797SS**  trans-63.482.1167.9-67.717921.700107.7V22 G26V22-Q24 PolarHBondContact O-N 3.42Å; Q24-G26 PolarHBondContact O-N 3.48Å
25M53.5Low51.7Low165 Ų165145.9 Ų145.981%0.81380%0.797SS**  trans-61.8105.4166.4-87.1-81.8178.400106.2P23 Y27P23-M25 PolarHBondContact O-N 3.49Å; M25-Y27 PolarHBondContact O-N 3.1Å
26G46.6Very low51.4Low70 Ų70139.1 Ų139.172%0.72278%0.784SS**PPolyproline II helixtrans-53.6119.4-178.100000110.6Q24Q24-G26 PolarHBondContact O-N 3.48Å
27Y55.6Low51.6Low218 Ų218147 Ų14786%0.85580%0.802SS**PPolyproline II helixtrans-63.6126.3164.4-66.5-83.8000107.5M25 I29M25-Y27 PolarHBondContact O-N 3.1Å; Y27-I29 PolarHBondContact O-N 3.45Å
28P51.5Low51.3Low107 Ų107138.7 Ų138.770%0.69579%0.792SS**PPolyproline II helixtrans-61.8129.9175.524.7-31.7000109M30P28-M30 VanDerWaalsContact C-N 3.33Å; P28-M30 PolarHBondContact O-N 3.21Å
29I60.2Low51.7Low170 Ų170143.3 Ų143.387%0.87280%0.797SS**  trans-6195.7172.3-62164.5000106.7Y27Y27-I29 PolarHBondContact O-N 3.45Å
30M62.2Low52.4Low163 Ų163144.2 Ų144.280%0.80380%0.798SS**  trans-76.6129.6174.5-66.3-142.579.500109P28P28-M30 VanDerWaalsContact C-N 3.33Å; P28-M30 PolarHBondContact O-N 3.21Å
31P53.7Low52.3Low105 Ų105146.4 Ų146.468%0.68280%0.795SS**  trans-66.9148.6-175.225.5-33.2000112.3G33P31-G33 PolarHBondContact O-N 3.22Å; P31-G33 VanDerWaalsContact O-N 3.14Å
32P57.3Low53Low142 Ų142144.8 Ų144.892%0.92279%0.792SS**SBendtrans-76.9100.3-177.130.4-32000110.1
33G45.9Very low53.2Low68 Ų68148.7 Ų148.770%0.70180%0.8SS**  trans173112.317300000113.5P31P31-G33 PolarHBondContact O-N 3.22Å; P31-G33 VanDerWaalsContact O-N 3.14Å
34H56.6Low53.7Low178 Ų178151.5 Ų151.582%0.82480%0.804SS**  trans81.479.4164-129.857.8000116.7P36H34-P36 WeakPolarHBondContact O-CD 3.25Å
35M48.5Very low53.8Low181 Ų181146.1 Ų146.189%0.89279%0.786SS**  trans-89.9105.9151.9-69.5-76.1-145.300107.4F37M35-F37 PolarHBondContact O-N 3.17Å
36P49.8Very low54.2Low100 Ų100144.1 Ų144.165%0.64979%0.785SS**  trans-67.3121.1169.427.5-30.9000108.4H34 G38H34-P36 WeakPolarHBondContact O-CD 3.25Å; P36-G38 PolarHBondContact O-N 3.32Å
37F47Very low55Low224 Ų224148.6 Ų148.698%0.98279%0.786SS**SBendtrans-58.295.8166.7-84.1-97.5000108.4M35M35-F37 PolarHBondContact O-N 3.17Å
38G49.7Very low55.1Low68 Ų68143.7 Ų143.770%0.70178%0.78SS**  trans17419.6-178.500000120.2P36P36-G38 PolarHBondContact O-N 3.32Å
39E50.2Low55.5Low161 Ų161149.3 Ų149.375%0.75279%0.788SS**  trans-148.5105.9164.8-133.7167130.300110.8R41E39-R41 HydrophobicContact CB-CG 4.39Å; E39-R41 PolarHBondContact O-N 3.47Å
40V58.4Low55.6Low149 Ų149152.9 Ų152.990%0.90379%0.79SS**  trans-69.171.6168.6-166.50000106.6N42V40-N42 PolarHBondContact O-N 2.98Å
41R52.4Low55.4Low204 Ų204147.5 Ų147.577%0.7778%0.776SS**  trans-62.7106.8173.4-83.2-174.2144.5-158.1-6.4106.7E39 F43E39-R41 HydrophobicContact CB-CG 4.39Å; E39-R41 PolarHBondContact O-N 3.47Å; R41-F43 PolarHBondContact O-N 3.23Å
42N55.3Low55.8Low149 Ų149148.8 Ų148.880%0.79779%0.785SS**  trans-9.499.6166.3-72-52.3000112.1V40 Q44V40-N42 PolarHBondContact O-N 2.98Å; N42-Q44 VanDerWaalsContact C-N 3.28Å; N42-Q44 PolarHBondContact O-N 2.84Å
43F59.3Low55.7Low204 Ų204148.1 Ų148.190%0.89578%0.782SS**  trans-58.398.2169.5-128.1-93.3000106.4R41 P45R41-F43 PolarHBondContact O-N 3.23Å; F43-P45 WeakPolarHBondContact O-CD 3.48Å
44Q58.4Low56.4Low160 Ų160147.6 Ų147.675%0.74878%0.777SS**  trans-92.196.4176.9-147.116419.600105.1N42N42-Q44 VanDerWaalsContact C-N 3.28Å; N42-Q44 PolarHBondContact O-N 2.84Å
45P57.6Low56.7Low83 Ų83145.4 Ų145.454%0.53978%0.779SS.*  trans-60.5145.2-177.225.1-34.5000109.8F43 F47F43-P45 WeakPolarHBondContact O-CD 3.48Å; P45-F47 HydrophobicContact CB-CD2 4.35Å; P45-F47 PolarHBondContact O-N 3.07Å
46P62.7Low57.4Low122 Ų122148.1 Ų148.179%0.79278%0.779SS**SBendtrans-71.311.9-168.929.7-36.8000114.6
47F62.8Low57.7Low165 Ų165149.5 Ų149.572%0.72479%0.788SS**SBendtrans-90.4123.7179.5-58.3-69.9000109.9P45 R49P45-F47 HydrophobicContact CB-CD2 4.35Å; P45-F47 PolarHBondContact O-N 3.07Å; F47-R49 PolarHBondContact O-N 3.41Å
48P57.5Low58.6Low115 Ų115150.4 Ų150.475%0.74779%0.785SS**PPolyproline II helixtrans-58126.1175.222.3-30.3000108.7R50P48-R50 PolarHBondContact O-N 2.95Å
49R61Low58.9Low225 Ų225150.7 Ų150.785%0.84979%0.787SS**PPolyproline II helixtrans-48.4116.2175.7-70.6-176-178.2-1092.1107.7F47 G51F47-R49 PolarHBondContact O-N 3.41Å; R49-G51 PolarHBondContact O-N 3.03Å
50R62.2Low59.3Low244 Ų244153.3 Ų153.392%0.92179%0.792SS**  trans-57.3107.2169.6-72-175.4-165.9-1573.9106.2P48P48-R50 PolarHBondContact O-N 2.95Å
51G57.5Low59.2Low50 Ų50152.1 Ų152.152%0.51579%0.787SS.*PPolyproline II helixtrans-55.3155.5176.300000110.7R49 C53R49-G51 PolarHBondContact O-N 3.03Å; G51-C53 PolarHBondContact O-N 2.87Å; G51-C53 VanDerWaalsContact O-N 3.16Å
52P62.7Low59.7Low133 Ų133153.8 Ų153.886%0.86479%0.794SS**PPolyproline II helixtrans-57.4122.3-17723.2-32.4000110.3G54P52-G54 PolarHBondContact O-N 3.22Å
53C55.1Low59.9Low127 Ų127156.5 Ų156.586%0.85879%0.792SS**PPolyproline II helixtrans-55.6122.1176.8-36.30000109.1G51G51-C53 PolarHBondContact O-N 2.87Å; G51-C53 VanDerWaalsContact O-N 3.16Å
54G59.1Low59.6Low58 Ų58155.5 Ų155.560%0.59879%0.793SS**PPolyproline II helixtrans-57.1152.2176.100000112.4P52 R56P52-G54 PolarHBondContact O-N 3.22Å; G54-R56 PolarHBondContact O-N 2.54Å
55P63.2Low59.5Low132 Ų132156.5 Ų156.586%0.85779%0.791SS**PPolyproline II helixtrans-63133.4-172.424.1-32.5000112.1
56R62.6Low59.5Low238 Ų238164.3 Ų164.390%0.89881%0.81SS**PPolyproline II helixtrans-67.6139.7177-69.5-176.5171.4-157.5-1.7110.8G54 R58G54-R56 PolarHBondContact O-N 2.54Å; R56-R58 PolarHBondContact O-N 2.89Å
57P58.2Low59.3Low129 Ų129167.2 Ų167.284%0.83881%0.813SS**PPolyproline II helixtrans-61.9131.2-179.822.8-31.5000111.7G59P57-G59 PolarHBondContact O-N 3.06Å
58R65.5Low59Low243 Ų243164.2 Ų164.292%0.91782%0.819SS**PPolyproline II helixtrans-55126.1178.1-95.7179.2-177.7-175.51110.5R56R56-R58 PolarHBondContact O-N 2.89Å
59G54.5Low59.1Low73 Ų73161.8 Ų161.875%0.75381%0.814SS**PPolyproline II helixtrans-59.4134.8-179.600000112.9P57P57-G59 PolarHBondContact O-N 3.06Å
60Y60.2Low58.7Low217 Ų217157.2 Ų157.285%0.85181%0.814SS**PPolyproline II helixtrans-64.6139.6170.6-71.6-92.1000110.7R62Y60-R62 PolarHBondContact O-N 2.7Å
61P56.5Low58.8Low123 Ų123151 Ų15180%0.79981%0.808SS**PPolyproline II helixtrans-68.9125.4-179.226.3-32.3000111.1R63P61-R63 PolarHBondContact O-N 3.02Å
62R62.8Low59Low240 Ų240158.1 Ų158.191%0.90682%0.82SS**PPolyproline II helixtrans-65.1121.2174-75.7-172.4172.7-149.5-0.4109.8Y60 M64Y60-R62 PolarHBondContact O-N 2.7Å; R62-M64 PolarHBondContact O-N 3.38Å
63R59.3Low58.9Low205 Ų205162.7 Ų162.777%0.77482%0.82SS**  trans-60.8113175.9-155.4179.7-146.4-159.87.1109.8P61 Y65P61-R63 PolarHBondContact O-N 3.02Å; R63-Y65 PolarHBondContact O-N 3.2Å; R63-Y65 VanDerWaalsContact O-N 3.09Å
64M52.2Low59.2Low184 Ų184161.7 Ų161.791%0.90681%0.812SS**  trans-71.594174.6-78.2-97.2159.300109.8R62 R66R62-M64 PolarHBondContact O-N 3.38Å; M64-R66 PolarHBondContact O-N 2.59Å
65Y57.2Low59.1Low180 Ų180163.7 Ų163.771%0.70682%0.815SS**  trans-75.1104.2162.2-93.9-90.3000108.3R63 Q67R63-Y65 PolarHBondContact O-N 3.2Å; R63-Y65 VanDerWaalsContact O-N 3.09Å; Y65-Q67 PolarHBondContact O-N 3.14Å
66R55.8Low58.8Low248 Ų248163.4 Ų163.494%0.93681%0.813SS**  trans-58.8102.6166.1-116-179.1-178.3179.70.8108M64 A68M64-R66 PolarHBondContact O-N 2.59Å; R66-A68 PolarHBondContact O-N 3.09Å
67Q59.3Low58.2Low183 Ų183161.6 Ų161.686%0.85582%0.817SS**  trans-84.9102.3169.1-72.7177.65.100108Y65 G69Y65-Q67 PolarHBondContact O-N 3.14Å; Q67-G69 VanDerWaalsContact C-N 3.25Å; Q67-G69 PolarHBondContact O-N 2.87Å
68A57.4Low57.9Low102 Ų102159 Ų15984%0.84381%0.813SS**  trans-71.289160.400000107.3R66R66-A68 PolarHBondContact O-N 3.09Å
69G58.2Low56.9Low64 Ų64155.2 Ų155.266%0.6681%0.811SS**  trans-72.6130.8175.500000110.4Q67Q67-G69 VanDerWaalsContact C-N 3.25Å; Q67-G69 PolarHBondContact O-N 2.87Å
70P53.8Low56.9Low128 Ų128157 Ų15783%0.83181%0.81SS**  trans-69.4138.1-175.925.6-31.2000112.3Y72P70-Y72 PolarHBondContact O-N 2.9Å; P70-Y72 VanDerWaalsContact O-N 3.12Å
71S63.7Low56.4Low114 Ų114153.1 Ų153.180%0.79781%0.809SS**  trans-64.2104.9179.554.30000111.1R73S71-R73 PolarHBondContact O-N 2.73Å
72Y61.1Low55.6Low200 Ų200156.1 Ų156.178%0.78481%0.809SS**  trans-69.2112.2173.8-168.6-97.6000109.8P70P70-Y72 PolarHBondContact O-N 2.9Å; P70-Y72 VanDerWaalsContact O-N 3.12Å
73R61.8Low54.6Low228 Ų228152.1 Ų152.186%0.8681%0.805SS**PPolyproline II helixtrans-91.4120.9166.6-88.9-168.4177.4-145.41.2108.7S71S71-R73 PolarHBondContact O-N 2.73Å
74P60.4Low54Low106 Ų106146.8 Ų146.869%0.68880%0.796SS**PPolyproline II helixtrans-69.3139.1177.626.4-31.4000111.1
75P57.5Low53.9Low100 Ų100145.4 Ų145.465%0.64979%0.788SS**PPolyproline II helixtrans-75.2150.6-177.628.4-33.1000112.9
76P57.3Low53.4Low127 Ų127145.7 Ų145.783%0.82580%0.796SS**PPolyproline II helixtrans-73.3135.1-177.228.7-33.1000112.2G78P76-G78 PolarHBondContact O-N 3.14Å
77M50.2Low53.1Low200 Ų200137.1 Ų137.199%0.98579%0.785SS**  trans-66.4115.6-178.8-73.1-167170.800111.8
78G51.7Low52.8Low73 Ų73134 Ų13475%0.75378%0.779SS**  trans-121150.7174.100000112.6P76P76-G78 PolarHBondContact O-N 3.14Å
79N44.2Very low52.8Low164 Ų164135.8 Ų135.888%0.87777%0.774SS**  trans-59157.1-159.8-125.3-10.7000118.7
80P54.9Low53.2Low111 Ų111139 Ų13972%0.72178%0.776SS**  trans-98.9113-175.935.1-25.6000114.1
81V49.5Very low54.3Low136 Ų136139.4 Ų139.482%0.82477%0.765SS**  trans-146.8111.2161.3177.10000111.4
82K39Very low54.6Low185 Ų185140 Ų14080%0.80475%0.75SS**  trans29.6121.8145-69176.4176.81790122.7
83L41.5Very low55Low157 Ų157136.2 Ų136.282%0.82274%0.739SS**  trans68.8160.6139-75.4155.3000118.8
84P48.3Very low55.2Low92 Ų92133.6 Ų133.660%0.59773%0.73SS**  cis-132.6-169-28.635.5-16000112.3
85E48.1Very low55.8Low156 Ų156132.7 Ų132.773%0.72972%0.722SS**  trans82.8109.8158-71.4-174.5107.300119.8
86Q48.5Very low55.9Low185 Ų185137.8 Ų137.886%0.86473%0.728SS**  44.186.3128.2-66.2-179.8-12.500116.8
87G48.3Very low56Low69 Ų69136.3 Ų136.371%0.71172%0.717SS**  trans-164.328.9164.400000112.5
88T52.8Low56.3Low118 Ų118133.2 Ų133.272%0.72470%0.704SS**  trans-102.495.1171.451.30000107.3D90T88-D90 PolarHBondContact O-N 3.28Å
89D58.6Low56.3Low138 Ų138138.2 Ų138.274%0.73871%0.708SS**  trans-27.1107.5163.5-74.6-91.9000111.4K91D89-K91 HydrophobicContact CB-CB 4.35Å; D89-K91 PolarHBondContact O-N 2.88Å
90D67Low56.6Low131 Ų131135.5 Ų135.570%0.70170%0.699SS**G310 helixtrans-63.325.1171.2-74.6-59.3000112.8T88 Y92 H93T88-D90 PolarHBondContact O-N 3.28Å; D90-Y92 VanDerWaalsContact C-N 3.25Å; D90-Y92 PolarHBondContact O-N 3.18Å; D90-H93 PolarHBondContact O-ND1 2.76Å
91K76.8Confident56.3Low138 Ų138133.4 Ų133.460%0.669%0.692SS**G310 helixtrans-69.8-23175.3-169.2177.7-176.1-164.30112.6D89 W94D89-K91 HydrophobicContact CB-CB 4.35Å; D89-K91 PolarHBondContact O-N 2.88Å; K91-W94 PolarHBondContact O-NE1 3.12Å
92Y69.2Low56.1Low127 Ų127132 Ų13250%0.49870%0.695SS.*G310 helixtrans-125.521.4-172.4-60.7-75.6000114D90 W94 V95D90-Y92 VanDerWaalsContact C-N 3.25Å; D90-Y92 PolarHBondContact O-N 3.18Å; Y92-W94 AromaticContact CD1-CZ2 3.97Å; Y92-W94 HydrophobicContact CD1-CZ2 3.97Å; Y92-W94 HydrophobicContact CE1-CZ2 4.31Å; Y92-W94 PolarHBondContact O-N 2.99Å; Y92-V95 HydrophobicContact CD1-CG2 3.81Å; Y92-V95 HydrophobicContact CG-CG2 4.28Å; Y92-V95 WeakPolarHBondContact O-CA 2.85Å; Y92-V95 VanDerWaalsContact O-CB 3.25Å; Y92-V95 WeakPolarHBondContact O-CB 3.45Å; Y92-V95 PolarHBondContact O-N 2.97Å
93H69.2Low56.5Low119 Ų119128.3 Ų128.355%0.55169%0.688SS**Hα-helixtrans-61.5-27.3173.971-89.6000112.1D90 V95 R96 T97D90-H93 PolarHBondContact O-ND1 2.76Å; H93-V95 PolarHBondContact O-N 2.75Å; H93-R96 CarbonylContact O-C 3.46Å; H93-R96 PolarHBondContact O-N 2.69Å; H93-T97 PolarHBondContact O-N 3.25Å; H93-T97 VanDerWaalsContact O-N 3.12Å
94W66Low56.7Low174 Ų174125.6 Ų125.666%0.65968%0.681SS**Hα-helixtrans-65.2-16.9170.265.6-93000114.2K91 Y92K91-W94 PolarHBondContact O-NE1 3.12Å; Y92-W94 AromaticContact CD1-CZ2 3.97Å; Y92-W94 HydrophobicContact CD1-CZ2 3.97Å; Y92-W94 HydrophobicContact CE1-CZ2 4.31Å; Y92-W94 PolarHBondContact O-N 2.99Å
95V72.3Confident56.8Low87 Ų87129.3 Ų129.353%0.52770%0.697SS.*Hα-helixtrans-83.2-22.6172-172.80000110.7Y92 H93Y92-V95 HydrophobicContact CD1-CG2 3.81Å; Y92-V95 HydrophobicContact CG-CG2 4.28Å; Y92-V95 WeakPolarHBondContact O-CA 2.85Å; Y92-V95 VanDerWaalsContact O-CB 3.25Å; Y92-V95 WeakPolarHBondContact O-CB 3.45Å; Y92-V95 PolarHBondContact O-N 2.97Å; H93-V95 PolarHBondContact O-N 2.75Å
96R61.2Low56.6Low206 Ų206124.8 Ų124.878%0.77769%0.685SS**Hα-helixtrans-102.6-6.6-174.4-82.7-169.6-179.4-162.31.9115.1H93 D98H93-R96 CarbonylContact O-C 3.46Å; H93-R96 PolarHBondContact O-N 2.69Å; R96-D98 PolarHBondContact O-N 3.38Å
97T58.8Low56.6Low96 Ų96124.4 Ų124.459%0.58968%0.684SS**SBendtrans-63.797.1154.3-31.20000104.5H93 Q99H93-T97 PolarHBondContact O-N 3.25Å; H93-T97 VanDerWaalsContact O-N 3.12Å; T97-Q99 PolarHBondContact O-N 3.07Å
98D56.9Low56.6Low135 Ų135127.3 Ų127.372%0.72269%0.688SS**  trans-7.786.8132-49.7-66.8000107.9R96 P100R96-D98 PolarHBondContact O-N 3.38Å; D98-P100 VanDerWaalsContact C-CD 3.45Å; D98-P100 WeakPolarHBondContact O-CD 3.29Å; D98-P100 VanDerWaalsContact O-N 3.08Å
99Q51Low56.6Low178 Ų178127.8 Ų127.883%0.83269%0.686SS**  trans-58.9105.6140.1-73.9-178.85.80099.8T97 A101T97-Q99 PolarHBondContact O-N 3.07Å; Q99-A101 PolarHBondContact O-N 3.31Å
100P51.4Low56.3Low107 Ų107126.7 Ų126.770%0.69568%0.68SS**  trans-50.8111.8154.625.6-32.2000101.8D98 A102D98-P100 VanDerWaalsContact C-CD 3.45Å; D98-P100 WeakPolarHBondContact O-CD 3.29Å; D98-P100 VanDerWaalsContact O-N 3.08Å; P100-A102 PolarHBondContact O-N 3.15Å
101A48.6Very low55.9Low68 Ų68126.8 Ų126.856%0.56269%0.685SS**  trans-38.3119.6162.900000103.3Q99 T103Q99-A101 PolarHBondContact O-N 3.31Å; A101-T103 HydrophobicContact CB-CG2 4.14Å; A101-T103 WeakPolarHBondContact O-CB 3.39Å; A101-T103 PolarHBondContact O-N 3.17Å; A101-T103 PolarHBondContact O-OG1 3.4Å
102A45.4Very low55Low107 Ų107127.6 Ų127.688%0.88470%0.696SS**  trans-61.670.2174.600000106.5P100 S104P100-A102 PolarHBondContact O-N 3.15Å; A102-S104 PolarHBondContact O-N 2.85Å
103T47Very low54.6Low107 Ų107126.3 Ų126.366%0.65669%0.694SS**  trans-71.793.8167.737.40000100.1A101 N105A101-T103 HydrophobicContact CB-CG2 4.14Å; A101-T103 WeakPolarHBondContact O-CB 3.39Å; A101-T103 PolarHBondContact O-N 3.17Å; A101-T103 PolarHBondContact O-OG1 3.4Å; T103-N105 PolarHBondContact O-N 3.07Å
104S45.4Very low54.8Low99 Ų99128.5 Ų128.569%0.69271%0.705SS**  trans35.492.8160.854.10000113.1A102 A106A102-S104 PolarHBondContact O-N 2.85Å; S104-A106 PolarHBondContact O-N 2.8Å
105N49.3Very low55.6Low171 Ų171121.9 Ų121.991%0.91469%0.685SS**  trans-60.677.3143.9-76.5-6.7000106.5T103T103-N105 PolarHBondContact O-N 3.07Å
106A45.7Very low56Low60 Ų60121.2 Ų121.250%0.49668%0.676SS.*  trans-56.3147.214600000106.5S104S104-A106 PolarHBondContact O-N 2.8Å
107E46.6Very low57.1Low178 Ų178112 Ų11283%0.83264%0.643SS**  trans85.794.1159.2-55168.4132.100115.4
108T48.8Very low58.1Low130 Ų130117.1 Ų117.180%0.79865%0.653SS**SBend-157115.5100.624.80000111.6
109N54.3Low59.3Low128 Ų128113.3 Ų113.368%0.68463%0.628SS**SBendtrans61.381.9146.9-65.8-45.9000119.8
110N52.2Low60.9Low115 Ų115110 Ų11062%0.61562%0.622SS**  -160.173129.4-96.6-55.3000108.6N112 Q113N110-N112 PolarHBondContact O-N 3.14Å; N110-Q113 PolarHBondContact O-N 2.86Å
111V57.4Low62.5Low132 Ų132111.9 Ų111.980%0.862%0.616SS**THydrogen-bonded Turntrans-62.3-6.1-169.1176.50000114.4
112N57.8Low64.3Low156 Ų156109.6 Ų109.683%0.83460%0.596SS**THydrogen-bonded Turntrans-125.115.7-176.4-66-20.2000115.2N110N110-N112 PolarHBondContact O-N 3.14Å
113Q61.7Low66.4Low99 Ų99110.7 Ų110.746%0.46358%0.58SS.*SBendtrans-103.5109.5170.2-65.8-172.46.300109N110 C115 P143N110-Q113 PolarHBondContact O-N 2.86Å; Q113-C115 PolarHBondContact O-N 2.88Å; Q113-P143 HydrophobicContact CB-CG 4.48Å
114E73.3Confident68.6Low165 Ų165105.7 Ų105.777%0.77155%0.55SS*.  trans-41.1107.4177.3-173.162.6-148.200110.7Q116E114-Q116 PolarHBondContact O-N 3.08Å; E114-Q116 VanDerWaalsContact O-N 3.12Å
115C82.7Confident70.9Confident36 Ų36104.2 Ų104.224%0.24353%0.529CS..  trans-70.3110.8-177.6176.70000108.9Q113 C117 H145Q113-C115 PolarHBondContact O-N 2.88Å; C115-C117 PolarHBondContact O-N 3.14Å; C115-C117 WeakPolarHBondContact SG-CB 3.37Å; C115-C117 VanDerWaalsContact SG-SG 3.63Å; C115-H145 PolarHBondContact SG-CE1 3Å; C115-H145 PolarHBondContact SG-ND1 2.82Å; C115-H145 VanDerWaalsContact SG-ND1 3.42Å
116Q79.6Confident73Confident73 Ų7396.1 Ų96.134%0.34149%0.486SS..G310 helixtrans-81.88.5-178-48.2-176.2-19.700113.5E114 Y118 R119 C142E114-Q116 PolarHBondContact O-N 3.08Å; E114-Q116 VanDerWaalsContact O-N 3.12Å; Q116-Y118 VanDerWaalsContact C-N 3.34Å; Q116-R119 HydrophobicContact CB-CG 4.15Å; Q116-R119 VanDerWaalsContact O-CG 3.25Å; Q116-R119 WeakPolarHBondContact O-CG 3.48Å; Q116-R119 PolarHBondContact O-NE 3.34Å; Q116-R119 VanDerWaalsContact O-NE 3.1Å; Q116-R119 PolarHBondContact O-NH2 2.92Å; Q116-C142 PolarHBondContact N-SG 2.88Å
117C84.3Confident75.3Confident11 Ų1196.5 Ų96.57%0.07448%0.478CS..G310 helixtrans-66.3-35.3178.1-700000112.5C115 R137 H145 M150C115-C117 PolarHBondContact O-N 3.14Å; C115-C117 WeakPolarHBondContact SG-CB 3.37Å; C115-C117 VanDerWaalsContact SG-SG 3.63Å; C117-R137 PolarHBondContact O-NH1 2.94Å; C117-H145 PolarHBondContact SG-ND1 3.49Å; C117-M150 HydrophobicContact CB-CE 3.6Å; C117-M150 WeakPolarHBondContact O-CE 3.07Å
118Y80.1Confident77.5Confident205 Ų20593.4 Ų93.480%0.80446%0.464SS*.G310 helixtrans-92.915.2-177-62.2-74.6000114Q116Q116-Y118 VanDerWaalsContact C-N 3.34Å
119R82.6Confident79.7Confident54 Ų5489 Ų8920%0.20444%0.439CS..PPolyproline II helixtrans-49147.2173-76.4-179.5-57.1-122.5-6.2111.1Q116 R137Q116-R119 HydrophobicContact CB-CG 4.15Å; Q116-R119 VanDerWaalsContact O-CG 3.25Å; Q116-R119 WeakPolarHBondContact O-CG 3.48Å; Q116-R119 PolarHBondContact O-NE 3.34Å; Q116-R119 VanDerWaalsContact O-NE 3.1Å; Q116-R119 PolarHBondContact O-NH2 2.92Å; R119-R137 PolarHBondContact O-NE 3.27Å; R119-R137 PolarHBondContact O-NH1 2.88Å; R119-R137 PolarHBondContact O-NH2 3.23Å
120P84.4Confident81.5Confident109 Ų10989.4 Ų89.471%0.70844%0.441SS*.PPolyproline II helixtrans-63.7158177.525.9-33.6000112.6R137P120-R137 PolarHBondContact O-NE 2.94Å; P120-R137 VanDerWaalsContact O-NE 3.17Å
121R86Confident83.3Confident147 Ų14787.4 Ų87.456%0.55543%0.427SS*.PPolyproline II helixtrans-77.3142.2169.4-69.5178.4-74178-1108.7R137R121-R137 HydrophobicContact CG-CG 4.44Å
122S85.3Confident84.9Confident20 Ų2085.9 Ų85.914%0.1442%0.419CS..EExtended strand (participates in β ladder)trans-130.4172.4-178.756.30000110.8Q136S122-Q136 PolarHBondContact N-O 3.43Å; S122-Q136 PolarHBondContact O-N 2.99Å
123K91Very high86.4Confident129 Ų12978.9 Ų78.956%0.56138%0.382SS*.EExtended strand (participates in β ladder)trans-82.5127.5168.6-69.6176.6-177.9173.80108.1N170K123-N170 PolarHBondContact O-N 3.05Å
124V92.1Very high87.7Confident2 Ų277.7 Ų77.71%0.01238%0.384CS..EExtended strand (participates in β ladder)trans-108.6131.1175.5-178.80000108.5T132 S133 Q136 I138 L167 R168V124-T132 CarbonylContact O-C 3.56Å; V124-T132 WeakPolarHBondContact O-CA 3.29Å; V124-S133 PolarHBondContact N-O 2.85Å; V124-S133 PolarHBondContact O-N 2.96Å; V124-Q136 HydrophobicContact CG2-CB 4.41Å; V124-I138 HydrophobicContact CG1-CD1 4.48Å; V124-I138 HydrophobicContact CG1-CG1 4.16Å; V124-I138 HydrophobicContact CG2-CG1 4.24Å; V124-L167 HydrophobicContact CG1-CB 3.92Å; V124-L167 HydrophobicContact CG1-CD2 4.16Å; V124-L167 HydrophobicContact CG1-CG 4.43Å; V124-R168 CarbonylContact C-O 3.59Å; V124-R168 VanDerWaalsContact CA-O 3.29Å; V124-R168 WeakPolarHBondContact CA-O 3.17Å
125Y93.3Very high88.3Confident68 Ų6873.9 Ų73.927%0.26737%0.369SS..EExtended strand (participates in β ladder)trans-118.6142.4175.167.8-82.3000110.9M127 L167 R168 N170Y125-M127 HydrophobicContact CD2-CG 4.41Å; Y125-M127 HydrophobicContact CE2-CG 4.05Å; Y125-L167 WeakPolarHBondContact O-CA 3.46Å; Y125-R168 HydrophobicContact CD1-CB 3.91Å; Y125-R168 WeakPolarHBondContact CD1-O 3.27Å; Y125-R168 HydrophobicContact CD2-CB 4.33Å; Y125-R168 HydrophobicContact CE1-CB 3.29Å; Y125-R168 HydrophobicContact CE1-CG 4.46Å; Y125-R168 HydrophobicContact CE2-CB 3.8Å; Y125-R168 HydrophobicContact CE2-CG 4.3Å; Y125-R168 HydrophobicContact CG-CB 4.39Å; Y125-R168 PolarHBondContact N-O 3.39Å; Y125-R168 PolarHBondContact O-N 3.32Å; Y125-R168 WeakPolarHBondContact OH-CD 3.39Å; Y125-N170 WeakPolarHBondContact CE1-OD1 3.07Å
126C94.8Very high88.6Confident1 Ų174.2 Ų74.21%0.00737%0.367CS..EExtended strand (participates in β ladder)trans-95.5120.3177-177.40000110.2Q128 C129 D130 H131 C157 C160 L167C126-Q128 PolarHBondContact O-N 3.41Å; C126-Q128 PolarHBondContact SG-N 2.79Å; C126-C129 VanDerWaalsContact SG-SG 3.67Å; C126-D130 WeakPolarHBondContact O-CA 3.2Å; C126-D130 PolarHBondContact O-N 3.26Å; C126-H131 PolarHBondContact N-O 3.27Å; C126-C157 HydrophobicContact CB-CB 4.29Å; C126-C157 VanDerWaalsContact SG-SG 3.67Å; C126-C160 VanDerWaalsContact SG-SG 3.69Å; C126-L167 HydrophobicContact CB-CD2 3.82Å
127M93.3Very high89Confident68 Ų6873 Ų7334%0.33536%0.359SS..THydrogen-bonded Turntrans-71.7-10.6177-60.5-169.8-58.800113.9Y125 W166 R168Y125-M127 HydrophobicContact CD2-CG 4.41Å; Y125-M127 HydrophobicContact CE2-CG 4.05Å; M127-W166 HydrophobicContact CB-CE3 4.32Å; M127-W166 HydrophobicContact CE-CE3 3.94Å; M127-W166 HydrophobicContact CE-CZ3 4.48Å; M127-W166 PolarHBondContact N-O 3.12Å; M127-R168 HydrophobicContact CG-CG 4.35Å; M127-R168 HydrophobicContact SD-CG 4.15Å; M127-R168 PolarHBondContact SD-NE 3.4Å
128Q93.1Very high89.2Confident113 Ų11373.5 Ų73.553%0.52836%0.361SS..THydrogen-bonded Turntrans-91.4-31.6-176.9-171.163.524.400113C126 A162 W166C126-Q128 PolarHBondContact O-N 3.41Å; C126-Q128 PolarHBondContact SG-N 2.79Å; Q128-A162 HydrophobicContact CB-CB 3.97Å; Q128-A162 HydrophobicContact CG-CB 4.23Å; Q128-W166 HydrophobicContact CB-CB 4.33Å; Q128-W166 HydrophobicContact CB-CG 4.45Å
129C94.8Very high89.6Confident39 Ų3966.1 Ų66.126%0.26433%0.334SS..THydrogen-bonded Turntrans-134.28.2-176.267.50000113.7C126 H131 C157 C160C126-C129 VanDerWaalsContact SG-SG 3.67Å; C129-H131 PolarHBondContact O-N 2.94Å; C129-H131 VanDerWaalsContact SG-CB 3.55Å; C129-C157 VanDerWaalsContact SG-SG 3.64Å; C129-C160 HydrophobicContact CB-CB 3.9Å; C129-C160 PolarHBondContact SG-SG 3.47Å
130D91.4Very high89.7Confident136 Ų13668.4 Ų68.473%0.72734%0.343SS*.  trans54.517.7-178.4-55.6-40.1000114.8C126 T132C126-D130 WeakPolarHBondContact O-CA 3.2Å; C126-D130 PolarHBondContact O-N 3.26Å; D130-T132 PolarHBondContact O-N 2.81Å
131H91Very high89.7Confident72 Ų7268.2 Ų68.233%0.33334%0.342SS..  trans-74.1128.3175.3-175.769.6000110.4C126 C129 S133 N159C126-H131 PolarHBondContact N-O 3.27Å; C129-H131 PolarHBondContact O-N 2.94Å; C129-H131 VanDerWaalsContact SG-CB 3.55Å; H131-S133 PolarHBondContact CD2-OG 3.17Å; H131-S133 VanDerWaalsContact CD2-OG 3.25Å; H131-S133 PolarHBondContact NE2-OG 3.22Å; H131-N159 HydrophobicContact CB-CB 3.96Å
132T91Very high89.7Confident101 Ų10161.6 Ų61.662%0.6232%0.318SS*.EExtended strand (participates in β ladder)trans-105.3121.917557.90000110.2V124 D130V124-T132 CarbonylContact O-C 3.56Å; V124-T132 WeakPolarHBondContact O-CA 3.29Å; D130-T132 PolarHBondContact O-N 2.81Å
133S89.3Confident89.7Confident8 Ų864.1 Ų64.16%0.05633%0.334CS..EExtended strand (participates in β ladder)trans-105.2116.3174.3-55.90000109.6V124 H131 Q136V124-S133 PolarHBondContact N-O 2.85Å; V124-S133 PolarHBondContact O-N 2.96Å; H131-S133 PolarHBondContact CD2-OG 3.17Å; H131-S133 VanDerWaalsContact CD2-OG 3.25Å; H131-S133 PolarHBondContact NE2-OG 3.22Å; S133-Q136 VanDerWaalsContact CB-CD 3.42Å; S133-Q136 VanDerWaalsContact CB-OE1 3.3Å
134S88Confident89.3Confident75 Ų7560 Ų6052%0.52432%0.321SS..EExtended strand (participates in β ladder)trans-79153.8172.256.40000110.8Q136S134-Q136 VanDerWaalsContact C-N 3.26Å; S134-Q136 PolarHBondContact O-N 2.86Å
135D86.9Confident88.9Confident84 Ų8463.7 Ų63.745%0.44934%0.338SS..EExtended strand (participates in β ladder)trans62.523.6175.7-60.9-53000116.1M152D135-M152 WeakPolarHBondContact O-CE 3.44Å
136Q89.5Confident88.4Confident44 Ų4465.3 Ų65.321%0.20636%0.357CS..EExtended strand (participates in β ladder)trans-115.2166.5-179.5-68.5178.526.100111.3S122 V124 S133 S134 L154S122-Q136 PolarHBondContact N-O 3.43Å; S122-Q136 PolarHBondContact O-N 2.99Å; V124-Q136 HydrophobicContact CG2-CB 4.41Å; S133-Q136 VanDerWaalsContact CB-CD 3.42Å; S133-Q136 VanDerWaalsContact CB-OE1 3.3Å; S134-Q136 VanDerWaalsContact C-N 3.26Å; S134-Q136 PolarHBondContact O-N 2.86Å; Q136-L154 HydrophobicContact CB-CD1 4.43Å; Q136-L154 HydrophobicContact CB-CG 4.37Å; Q136-L154 VanDerWaalsContact OE1-CD2 3.27Å
137R87Confident87.9Confident46 Ų4674.9 Ų74.917%0.17440%0.398CS..EExtended strand (participates in β ladder)trans-133154.1178.9-64.3177.1-172.8168.24.2109.2C117 R119 P120 R121 M152 D153 L154C117-R137 PolarHBondContact O-NH1 2.94Å; R119-R137 PolarHBondContact O-NE 3.27Å; R119-R137 PolarHBondContact O-NH1 2.88Å; R119-R137 PolarHBondContact O-NH2 3.23Å; P120-R137 PolarHBondContact O-NE 2.94Å; P120-R137 VanDerWaalsContact O-NE 3.17Å; R121-R137 HydrophobicContact CG-CG 4.44Å; R137-M152 PolarHBondContact N-O 3.01Å; R137-D153 WeakPolarHBondContact CB-OD1 3.04Å; R137-D153 CarbonylContact O-C 3.34Å; R137-D153 WeakPolarHBondContact O-CA 3.47Å; R137-L154 PolarHBondContact O-N 2.91Å
138I89.3Confident87.4Confident23 Ų2375.2 Ų75.212%0.11840%0.404CS..EExtended strand (participates in β ladder)trans-83131.3170.2-60.2175.6000108.1V124 R140 R164 L167 E169V124-I138 HydrophobicContact CG1-CD1 4.48Å; V124-I138 HydrophobicContact CG1-CG1 4.16Å; V124-I138 HydrophobicContact CG2-CG1 4.24Å; I138-R140 PolarHBondContact O-N 2.73Å; I138-R140 VanDerWaalsContact O-N 3.14Å; I138-R164 HydrophobicContact CG2-CB 4.42Å; I138-L167 HydrophobicContact CD1-CB 4.16Å; I138-L167 HydrophobicContact CG1-CB 4.38Å; I138-E169 HydrophobicContact CD1-CB 4.14Å; I138-E169 HydrophobicContact CD1-CG 4.38Å
139Q88Confident86.9Confident49 Ų4975.9 Ų75.923%0.22941%0.411CS..  trans-59.2119.2176.9-167.4-167.352.100110.7L149 D153 L154 T155Q139-L149 VanDerWaalsContact NE2-CD2 3.29Å; Q139-D153 HydrophobicContact CB-CB 3.92Å; Q139-D153 HydrophobicContact CG-CB 4.18Å; Q139-L154 PolarHBondContact N-O 2.98Å; Q139-L154 VanDerWaalsContact N-O 3.09Å; Q139-T155 HydrophobicContact CB-CG2 4.35Å
140R84.9Confident86.3Confident103 Ų10377 Ų7739%0.38941%0.413SS..  trans-126.3133169.9-57171.8176-159.83109I138 C142 E169I138-R140 PolarHBondContact O-N 2.73Å; I138-R140 VanDerWaalsContact O-N 3.14Å; R140-C142 PolarHBondContact O-N 3.47Å; R140-E169 IonicContact CZ-OE1 3.61Å; R140-E169 IonicContact NH2-OE1 2.59Å; R140-E169 PolarHBondContact NH2-OE1 3.04Å; R140-E169 IonicContact NH2-OE2 3.7Å
141P84.5Confident85.9Confident105 Ų10578.7 Ų78.768%0.68242%0.421SS*.  trans-62.7128.9176.828-33.8000109.3
142C86.4Confident85.7Confident8 Ų879.1 Ų79.15%0.05442%0.424CS..  trans-86.5131.2172.6-169.10000109.1Q116 R140 S144 H145Q116-C142 PolarHBondContact N-SG 2.88Å; R140-C142 PolarHBondContact O-N 3.47Å; C142-S144 VanDerWaalsContact C-N 3.29Å; C142-S144 PolarHBondContact O-N 2.9Å; C142-S144 PolarHBondContact SG-OG 3.23Å; C142-H145 HydrophobicContact CB-CB 4.23Å; C142-H145 CarbonylContact O-C 3.57Å; C142-H145 PolarHBondContact O-N 3.25Å
143P83.7Confident85.6Confident73 Ų7375.6 Ų75.647%0.47440%0.401SS..SBendtrans-65.9-32.6179.726.9-35.1000112.6Q113Q113-P143 HydrophobicContact CB-CG 4.48Å
144S83.6Confident85.6Confident42 Ų4276.5 Ų76.529%0.29441%0.405SS..SBendtrans-77.7-27.917765.70000112.9C142C142-S144 VanDerWaalsContact C-N 3.29Å; C142-S144 PolarHBondContact O-N 2.9Å; C142-S144 PolarHBondContact SG-OG 3.23Å
145H83.7Confident85.8Confident79 Ų7976.3 Ų76.337%0.36640%0.401SS..  trans-132.667.7-173.3-54.3124.1000111.9C115 C117 C142 K147 V148C115-H145 PolarHBondContact SG-CE1 3Å; C115-H145 PolarHBondContact SG-ND1 2.82Å; C115-H145 VanDerWaalsContact SG-ND1 3.42Å; C117-H145 PolarHBondContact SG-ND1 3.49Å; C142-H145 HydrophobicContact CB-CB 4.23Å; C142-H145 CarbonylContact O-C 3.57Å; C142-H145 PolarHBondContact O-N 3.25Å; H145-K147 PolarHBondContact O-N 2.95Å; H145-V148 HydrophobicContact CB-CB 3.79Å; H145-V148 HydrophobicContact CB-CG2 3.72Å; H145-V148 PolarHBondContact O-N 3.18Å
146P82.5Confident86.1Confident102 Ų10277.6 Ų77.666%0.66240%0.404SS*.THydrogen-bonded Turntrans-66.2-20.8-175.826-35.2000113.7
147K84.7Confident86.3Confident203 Ų20375.6 Ų75.688%0.88340%0.395SS*.THydrogen-bonded Turntrans-100.8-1.1-179.1-60.9-178.6-176.9175.60113.6H145H145-K147 PolarHBondContact O-N 2.95Å
148V82.5Confident86.5Confident74 Ų7477.3 Ų77.345%0.44841%0.412SS..  trans-96.2115.3-179.2179.90000108.5H145 M150H145-V148 HydrophobicContact CB-CB 3.79Å; H145-V148 HydrophobicContact CB-CG2 3.72Å; H145-V148 PolarHBondContact O-N 3.18Å; V148-M150 HydrophobicContact CG1-SD 4.5Å
149L81.7Confident86.6Confident128 Ų12881.2 Ų81.267%0.6743%0.433SS*.  trans-103.2129.9170.5-59.6-175.7000108.4Q139Q139-L149 VanDerWaalsContact NE2-CD2 3.29Å
150M82.4Confident86.9Confident62 Ų6281.7 Ų81.731%0.30544%0.441SS..  trans-84.9139175.8-65.2-63.5-160.800110.1C117 V148 M152 D153C117-M150 HydrophobicContact CB-CE 3.6Å; C117-M150 WeakPolarHBondContact O-CE 3.07Å; V148-M150 HydrophobicContact CG1-SD 4.5Å; M150-M152 PolarHBondContact O-N 2.92Å; M150-M152 VanDerWaalsContact O-N 3.15Å; M150-D153 HydrophobicContact CB-CB 4.45Å; M150-D153 WeakPolarHBondContact O-CB 3.34Å; M150-D153 PolarHBondContact O-N 2.75Å; M150-D153 VanDerWaalsContact O-N 3.14Å
151L82.6Confident87.4Confident172 Ų17278.9 Ų78.990%0.90145%0.445SS*.THydrogen-bonded Turntrans-58.8-27.8-178.9-176.763.8000113.6
152M87Confident87.8Confident81 Ų8174.6 Ų74.640%0.39942%0.418SS..THydrogen-bonded Turntrans-93.52.9-176.6-55.8-57.4-66.100113.7D135 R137 M150D135-M152 WeakPolarHBondContact O-CE 3.44Å; R137-M152 PolarHBondContact N-O 3.01Å; M150-M152 PolarHBondContact O-N 2.92Å; M150-M152 VanDerWaalsContact O-N 3.15Å
153D89.3Confident88.1Confident27 Ų2777.1 Ų77.114%0.14444%0.436CS..EExtended strand (participates in β ladder)trans-85.8124.5179.3-75.4-1000110.5R137 Q139 M150R137-D153 WeakPolarHBondContact CB-OD1 3.04Å; R137-D153 CarbonylContact O-C 3.34Å; R137-D153 WeakPolarHBondContact O-CA 3.47Å; Q139-D153 HydrophobicContact CB-CB 3.92Å; Q139-D153 HydrophobicContact CG-CB 4.18Å; M150-D153 HydrophobicContact CB-CB 4.45Å; M150-D153 WeakPolarHBondContact O-CB 3.34Å; M150-D153 PolarHBondContact O-N 2.75Å; M150-D153 VanDerWaalsContact O-N 3.14Å
154L90.2Very high88.4Confident27 Ų2780.2 Ų80.214%0.14144%0.438CS..EExtended strand (participates in β ladder)trans-88.7131.9173.2-69.8-175.3000112.1Q136 R137 Q139 L167Q136-L154 HydrophobicContact CB-CD1 4.43Å; Q136-L154 HydrophobicContact CB-CG 4.37Å; Q136-L154 VanDerWaalsContact OE1-CD2 3.27Å; R137-L154 PolarHBondContact O-N 2.91Å; Q139-L154 PolarHBondContact N-O 2.98Å; Q139-L154 VanDerWaalsContact N-O 3.09Å; L154-L167 HydrophobicContact CB-CD1 3.96Å; L154-L167 HydrophobicContact CD1-CD1 4.07Å
155T91.4Very high88.8Confident71 Ų7185.5 Ų85.544%0.43646%0.456SS..SBendtrans-92.9-27.6164.146.90000112.5Q139 R164Q139-T155 HydrophobicContact CB-CG2 4.35Å; T155-R164 WeakPolarHBondContact O-CB 3.22Å; T155-R164 PolarHBondContact O-N 3.38Å
156E93.5Very high89.2Confident111 Ų11186.5 Ų86.552%0.51946%0.457SS..BIsolated β-bridgetrans-146.3158.1-174.862.8-173.9-169.700110.8A162E156-A162 CarbonylContact C-O 3.53Å; E156-A162 WeakPolarHBondContact CA-O 3.14Å; E156-A162 WeakPolarHBondContact CB-O 3.45Å
157C93.7Very high89.7Confident2 Ų282.2 Ų82.21%0.01443%0.428CS..  trans-69126.1175.2-178.40000109.9C126 C129 N159 G161 A162 L167C126-C157 HydrophobicContact CB-CB 4.29Å; C126-C157 VanDerWaalsContact SG-SG 3.67Å; C129-C157 VanDerWaalsContact SG-SG 3.64Å; C157-N159 PolarHBondContact O-N 2.8Å; C157-N159 VanDerWaalsContact O-N 3.17Å; C157-G161 VanDerWaalsContact O-CA 3.27Å; C157-G161 WeakPolarHBondContact O-CA 3.25Å; C157-G161 PolarHBondContact O-N 2.89Å; C157-A162 HydrophobicContact CB-CB 4.29Å; C157-A162 PolarHBondContact N-O 3.25Å; C157-L167 HydrophobicContact CB-CD2 3.94Å
158P90.6Very high90Very high82 Ų8278.9 Ų78.953%0.53241%0.41SS..THydrogen-bonded Turntrans-65.5-20179.126.6-35.4000113.4
159N92.8Very high90.4Very high105 Ų10578.6 Ų78.656%0.56140%0.404SS*.THydrogen-bonded Turntrans-87.1-51.6-178.7-170.734.9000112.4H131 C157H131-N159 HydrophobicContact CB-CB 3.96Å; C157-N159 PolarHBondContact O-N 2.8Å; C157-N159 VanDerWaalsContact O-N 3.17Å
160C94.3Very high90.4Very high58 Ų5876.3 Ų76.339%0.39239%0.392SS..THydrogen-bonded Turntrans-111.9-3.5-172.769.40000114.7C126 C129 A162C126-C160 VanDerWaalsContact SG-SG 3.69Å; C129-C160 HydrophobicContact CB-CB 3.9Å; C129-C160 PolarHBondContact SG-SG 3.47Å; C160-A162 PolarHBondContact O-N 3.16Å; C160-A162 WeakPolarHBondContact SG-CB 3.46Å
161G93.5Very high89.6Confident45 Ų4577 Ų7746%0.46441%0.408SS..  trans6517.1-175.500000113.9C157C157-G161 VanDerWaalsContact O-CA 3.27Å; C157-G161 WeakPolarHBondContact O-CA 3.25Å; C157-G161 PolarHBondContact O-N 2.89Å
162A93.1Very high88.5Confident14 Ų1474.5 Ų74.512%0.11640%0.399CS..  trans-66.1141.6175.300000109.7Q128 E156 C157 C160 W166Q128-A162 HydrophobicContact CB-CB 3.97Å; Q128-A162 HydrophobicContact CG-CB 4.23Å; E156-A162 CarbonylContact C-O 3.53Å; E156-A162 WeakPolarHBondContact CA-O 3.14Å; E156-A162 WeakPolarHBondContact CB-O 3.45Å; C157-A162 HydrophobicContact CB-CB 4.29Å; C157-A162 PolarHBondContact N-O 3.25Å; C160-A162 PolarHBondContact O-N 3.16Å; C160-A162 WeakPolarHBondContact SG-CB 3.46Å; A162-W166 HydrophobicContact CB-CB 4Å; A162-W166 HydrophobicContact CB-CG 4.18Å
163S93Very high86.3Confident61 Ų6182.8 Ų82.843%0.42744%0.437SS..BIsolated β-bridgetrans-62.9161.8179.665.30000112.2F165 W166S163-F165 PolarHBondContact O-N 3.22Å; S163-W166 PolarHBondContact O-N 3.3Å
164R90.4Very high86.2Confident138 Ų13885.6 Ų85.652%0.52145%0.452SS..G310 helixtrans-47.9-23.2174.570.7175.1-173169.91.1115.4I138 T155 W166 L167I138-R164 HydrophobicContact CG2-CB 4.42Å; T155-R164 WeakPolarHBondContact O-CB 3.22Å; T155-R164 PolarHBondContact O-N 3.38Å; R164-W166 PolarHBondContact O-N 3.46Å; R164-L167 PolarHBondContact O-N 3.09Å; R164-L167 VanDerWaalsContact O-N 3.14Å
165F91.1Very high86Confident154 Ų15488.6 Ų88.668%0.67547%0.468SS*.G310 helixtrans-61.3-31177.2-177.3-95.6000112.6S163S163-F165 PolarHBondContact O-N 3.22Å
166W93.1Very high85.7Confident100 Ų10089.6 Ų89.638%0.37947%0.47SS..G310 helixtrans-90.5-4178.5-59.799.1000113.1M127 Q128 A162 S163 R164M127-W166 HydrophobicContact CB-CE3 4.32Å; M127-W166 HydrophobicContact CE-CE3 3.94Å; M127-W166 HydrophobicContact CE-CZ3 4.48Å; M127-W166 PolarHBondContact N-O 3.12Å; Q128-W166 HydrophobicContact CB-CB 4.33Å; Q128-W166 HydrophobicContact CB-CG 4.45Å; A162-W166 HydrophobicContact CB-CB 4Å; A162-W166 HydrophobicContact CB-CG 4.18Å; S163-W166 PolarHBondContact O-N 3.3Å; R164-W166 PolarHBondContact O-N 3.46Å
167L92.6Very high85.2Confident11 Ų1188.4 Ų88.46%0.05847%0.467CS..EExtended strand (participates in β ladder)trans-93.5135.5177.4-62.5178.2000109.8V124 Y125 C126 I138 L154 C157 R164V124-L167 HydrophobicContact CG1-CB 3.92Å; V124-L167 HydrophobicContact CG1-CD2 4.16Å; V124-L167 HydrophobicContact CG1-CG 4.43Å; Y125-L167 WeakPolarHBondContact O-CA 3.46Å; C126-L167 HydrophobicContact CB-CD2 3.82Å; I138-L167 HydrophobicContact CD1-CB 4.16Å; I138-L167 HydrophobicContact CG1-CB 4.38Å; L154-L167 HydrophobicContact CB-CD1 3.96Å; L154-L167 HydrophobicContact CD1-CD1 4.07Å; C157-L167 HydrophobicContact CB-CD2 3.94Å; R164-L167 PolarHBondContact O-N 3.09Å; R164-L167 VanDerWaalsContact O-N 3.14Å
168R92.1Very high84.7Confident133 Ų13393.8 Ų93.850%0.50250%0.495SS..EExtended strand (participates in β ladder)trans-127.7137.3174.9-72.4-169.1177.8-149.59.2110.4V124 Y125 M127V124-R168 CarbonylContact C-O 3.59Å; V124-R168 VanDerWaalsContact CA-O 3.29Å; V124-R168 WeakPolarHBondContact CA-O 3.17Å; Y125-R168 HydrophobicContact CD1-CB 3.91Å; Y125-R168 WeakPolarHBondContact CD1-O 3.27Å; Y125-R168 HydrophobicContact CD2-CB 4.33Å; Y125-R168 HydrophobicContact CE1-CB 3.29Å; Y125-R168 HydrophobicContact CE1-CG 4.46Å; Y125-R168 HydrophobicContact CE2-CB 3.8Å; Y125-R168 HydrophobicContact CE2-CG 4.3Å; Y125-R168 HydrophobicContact CG-CB 4.39Å; Y125-R168 PolarHBondContact N-O 3.39Å; Y125-R168 PolarHBondContact O-N 3.32Å; Y125-R168 WeakPolarHBondContact OH-CD 3.39Å; M127-R168 HydrophobicContact CG-CG 4.35Å; M127-R168 HydrophobicContact SD-CG 4.15Å; M127-R168 PolarHBondContact SD-NE 3.4Å
169E89.9Confident84.3Confident69 Ų6994.5 Ų94.532%0.32249%0.493SS..EExtended strand (participates in β ladder)trans-90.7127.3173.360.8-169.3-160.700109.5I138 R140 A171I138-E169 HydrophobicContact CD1-CB 4.14Å; I138-E169 HydrophobicContact CD1-CG 4.38Å; R140-E169 IonicContact CZ-OE1 3.61Å; R140-E169 IonicContact NH2-OE1 2.59Å; R140-E169 PolarHBondContact NH2-OE1 3.04Å; R140-E169 IonicContact NH2-OE2 3.7Å; E169-A171 PolarHBondContact O-N 3.4Å
170N82.4Confident83.7Confident80 Ų8093.8 Ų93.843%0.42849%0.488SS..EExtended strand (participates in β ladder)trans-85.695.7160.8-71.9-23.7000105.9K123 Y125 V172K123-N170 PolarHBondContact O-N 3.05Å; Y125-N170 WeakPolarHBondContact CE1-OD1 3.07Å; N170-V172 PolarHBondContact O-N 3.23Å; N170-V172 VanDerWaalsContact O-N 3.07Å
171A64.8Low82.9Confident77 Ų7796.5 Ų96.564%0.63650%0.495SS*.  trans-61.4110.8163.500000106.7E169 E173E169-A171 PolarHBondContact O-N 3.4Å; A171-E173 PolarHBondContact O-N 3.2Å
172V59.6Low82Confident119 Ų119100.8 Ų100.872%0.72150%0.498SS*.  trans-76.6110.1162.1-179.10000103.7N170N170-V172 PolarHBondContact O-N 3.23Å; N170-V172 VanDerWaalsContact O-N 3.07Å
173E41.7Very low81Confident254 Ų254108.7 Ų108.7100%1.18753%0.532SS*.  trans-59.90169.3-71.2-178.6148.900111.2A171A171-E173 PolarHBondContact O-N 3.2Å

Retrieved 173 of 173 residues in 125.7 ms (Link to these results)