A0A2K5NCW5_CERAT Loading...

Bcl-2/adenovirus E1B 19 kDa-interacting protein 2-like protein

May be a bridge molecule between BCL2 and ARHGAP1/CDC42 in promoting cell death.

AlphaFold DB , UniProt , Accession A0A2K5NCW5, Species CERAT (Cercocebus atys, Sooty mangabey), Gene BNIPL, Length 275 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
1M45.6Very low47.3Very low243 Ų243185.2 Ų185.2100%1.19790%0.899SS**  0111.30-76.2170.8147.100109.4
2R42.4Very low46.4Very low251 Ų251183.9 Ų183.995%0.94790%0.898SS**  trans-140.599.1168.8-76.7-177.5171.5166.5-3.3106.6R4R2-R4 PolarHBondContact O-N 3.45Å
3K48.4Very low45.5Very low204 Ų204178.6 Ų178.689%0.88789%0.891SS**  trans-81.2112.8177.4-74.6-178.8176.6178.70108
4R48.1Very low44.8Very low247 Ų247178.2 Ų178.293%0.93289%0.892SS**PPolyproline II helixtrans-76.1125.2164.5-82.8178.9157.4-157.8-5.1107.7R2R2-R4 PolarHBondContact O-N 3.45Å
5L51.4Low44.5Very low173 Ų173175.4 Ų175.491%0.90689%0.888SS**PPolyproline II helixtrans-92.5126.2171.6-69.7164.8000108.2
6S57.3Low43.9Very low118 Ų118177 Ų17783%0.82589%0.887SS**PPolyproline II helixtrans-88.4142.5176.4-44.50000110
7A55.9Low43.4Very low93 Ų93170.2 Ų170.277%0.76987%0.872SS**PPolyproline II helixtrans-74.2150.8177.700000112.2
8P53.1Low43.6Very low127 Ų127168.5 Ų168.583%0.82587%0.874SS**PPolyproline II helixtrans-82.7146.6-175.426.4-22.8000113.7
9E40.8Very low42.9Very low179 Ų179163.6 Ų163.684%0.83687%0.869SS**PPolyproline II helixtrans-75.3130.5176.5-70.5-167152.200112.3
10L40.9Very low42.4Very low169 Ų169162.5 Ų162.589%0.88586%0.863SS**  trans-85.6113.4171.3-69.1169.3000109.7
11R36.1Very low41.9Very low233 Ų233161.6 Ų161.688%0.87986%0.859SS**  trans-89.4110.5169.1-79.8-171.4165.4-177.1-4.2110.1
12L36.2Very low41.3Very low170 Ų170154 Ų15489%0.8984%0.842SS**  trans-87.7109.9168.5-79.5155.4000109.2
13S35.7Very low40.8Very low115 Ų115147.1 Ų147.180%0.80484%0.84SS**  trans-95.3105.8166.854.20000109.7
14L35.8Very low40.2Very low173 Ų173142.7 Ų142.791%0.90683%0.834SS**  trans-88.3114.9171.7-154.985000108.1
15T40.3Very low40.3Very low136 Ų136136.2 Ų136.283%0.83482%0.824SS**  trans-125.2115.3167.457.50000111.3
16K34.5Very low39.2Very low201 Ų201133.9 Ų133.987%0.87482%0.817SS**  trans-70.9138.1175.5-179177.5175.2179.80110.3
17G34.8Very low37.8Very low61 Ų61136.8 Ų136.863%0.62982%0.818SS**  trans-67.5-173.8165.700000112.4
18P46.8Very low36.7Very low140 Ų140137.4 Ų137.491%0.90982%0.817SS**  cis-141.8-179.525.738.6-17.8000115.6
19G30.4Very low35.7Very low75 Ų75137.8 Ų137.877%0.77382%0.817SS**  trans133.8109.2146.700000119.4
20N33.3Very low35.9Very low141 Ų141134.7 Ų134.775%0.75481%0.812SS**  97121.2126.8-137.550.1000123.2
21D32.9Very low35.5Very low145 Ų145132.4 Ų132.478%0.77581%0.81SS**  trans59.8128.8142.9-64.2-14.2000124.6
22G31.5Very low35.6Very low82 Ų82126.9 Ų126.985%0.84581%0.807SS**  trans166.3116.8157.100000115.4
23A32.6Very low36.1Very low108 Ų108123.8 Ų123.889%0.89380%0.797SS**  trans-63.5161.2-171.100000118.9
24S36.3Very low36Very low111 Ų111126 Ų12678%0.77680%0.8SS**  trans-71.9177.9170.1-31.30000112.7
25P48.7Very low36Very low111 Ų111121 Ų12172%0.72179%0.79SS**  cis-153.6176.441.341.5-17.4000120.1
26T28.3Very low36.3Very low124 Ų124119.9 Ų119.976%0.76179%0.788SS**  trans63.9118.3153.751.80000121.7
27Q29.6Very low36.5Very low179 Ų179115.4 Ų115.484%0.83678%0.782SS**  168.7144.292.8-116.6174.745.100112.7
28S31.8Very low36.9Very low106 Ų106119.6 Ų119.674%0.74179%0.79SS**  trans84.4100.4151.9-450000121.2
29T32.2Very low36.7Very low135 Ų135120.8 Ų120.883%0.82879%0.788SS**  trans-72.3175.5144.350.80000110.4
30P46.2Very low37.4Very low114 Ų114125.8 Ų125.874%0.7479%0.791SS**  cis-139.9163.39.738.8-19.8000115.9
31S30.7Very low38.4Very low120 Ų120125.5 Ų125.584%0.83979%0.794SS**  trans179114.713128.90000110.4
32S39.8Very low39.1Very low118 Ų118126.1 Ų126.183%0.82580%0.797SS**  trans-108.6160.6149.5-500000104.8
33P45.6Very low40.1Very low105 Ų105130.1 Ų130.168%0.68279%0.794SS**  -152.2179.652.939.8-16.7000116.9
34D34Very low40.5Very low160 Ų160133 Ų13386%0.85679%0.794SS**  trans77.4124.9154.2-60.2-21.3000120.4
35G35.2Very low40.8Very low68 Ų68135.6 Ų135.670%0.70179%0.794SS**  trans165.755.6171.700000112.3S37G35-S37 PolarHBondContact O-N 2.76Å
36S46.8Very low41.1Very low113 Ų113136.3 Ų136.379%0.7980%0.796SS**  trans-57.7129.6156.854.10000108.5
37S38.3Very low41.8Very low107 Ų107136.7 Ų136.775%0.74880%0.801SS**  trans-148.8100.7160.9-48.90000108.3G35 L39G35-S37 PolarHBondContact O-N 2.76Å; S37-L39 PolarHBondContact O-N 2.93Å
38D44.8Very low42.4Very low149 Ų149133.1 Ų133.180%0.79780%0.795SS**  trans-50.6125161-60.4-59.7000109.2E40D38-E40 PolarHBondContact O-N 3.38Å
39L42.1Very low42.9Very low165 Ų165134.6 Ų134.686%0.86480%0.795SS**  trans-83.989.1169.8-83.8155.5000107.5S37 V41S37-L39 PolarHBondContact O-N 2.93Å; L39-V41 PolarHBondContact O-N 3.39Å
40E44.2Very low43.4Very low181 Ų181133.8 Ų133.885%0.84680%0.795SS**  trans-60115.5163.4-73.6-178.613500108.8D38 D42D38-E40 PolarHBondContact O-N 3.38Å; E40-D42 VanDerWaalsContact C-N 3.3Å; E40-D42 PolarHBondContact O-N 3.01Å
41V54.2Low43.4Very low135 Ų135136.1 Ų136.182%0.81880%0.796SS**  trans-97.160.7175.8-163.10000107.9L39L39-V41 PolarHBondContact O-N 3.39Å
42D47.6Very low44.2Very low157 Ų157138.4 Ų138.484%0.8479%0.794SS**  trans-148.456.2177.2-133.76.6000111E40E40-D42 VanDerWaalsContact C-N 3.3Å; E40-D42 PolarHBondContact O-N 3.01Å
43E52.5Low44.2Very low166 Ų166141.4 Ų141.478%0.77680%0.799SS**  trans-163.864163.6-127.4177.6-17700110.7
44L42.8Very low43.7Very low170 Ų170143.6 Ų143.689%0.8981%0.805SS**  trans-97.972.7159.6-80.1169000108.4T46L44-T46 PolarHBondContact O-N 3.21Å
45E42.6Very low43.9Very low165 Ų165140.6 Ų140.677%0.77180%0.797SS**  trans-64.5110.4159.5-66.7-162.9139.200108.3
46T53.3Low43.9Very low126 Ų126141 Ų14177%0.77380%0.801SS**PPolyproline II helixtrans-68.6131.2169.749.90000109L44 S48L44-T46 PolarHBondContact O-N 3.21Å; T46-S48 PolarHBondContact O-N 2.86Å
47P43.2Very low43.6Very low131 Ų131142 Ų14285%0.85179%0.793SS**PPolyproline II helixtrans-62.6126.7-178.8-17.328.9000111.2
48S42.9Very low43.8Very low104 Ų104145.5 Ų145.573%0.72780%0.797SS**PPolyproline II helixtrans-70.5140.6164.4-169.10000110.5T46T46-S48 PolarHBondContact O-N 2.86Å
49D42.4Very low43.5Very low137 Ų137143 Ų14373%0.73378%0.78SS**  trans52.6110.2162.6-73.5-20.6000119.9
50S41.8Very low43.4Very low119 Ų119142.4 Ų142.483%0.83277%0.772SS**  -166.697.2123-78.10000110.7
51E47.5Very low43.5Very low162 Ų162141.5 Ų141.576%0.75776%0.761SS**  44.6137.8128.1-63.2-73.3102.700121.3
52Q47.6Very low43Very low169 Ų169138.4 Ų138.479%0.7974%0.738SS**  trans79.369.5153.7-70.5173.60.300118.4
53L38.4Very low43Very low181 Ų181137 Ų13795%0.94873%0.731SS**  -156.469.1129.1-76.1-172.4000107.8
54D35.7Very low42.5Very low150 Ų150137.2 Ų137.280%0.80273%0.731SS**  trans-108.8115.8167.3-158.311.4000110.2G56D54-G56 PolarHBondContact O-N 3.46Å
55S38.1Very low42.7Very low98 Ų98134.4 Ų134.469%0.68572%0.717SS**  trans-56.9100.7173.548.20000109.2H57S55-H57 PolarHBondContact O-N 3.2Å
56G35.8Very low42.5Very low76 Ų76132.1 Ų132.178%0.78472%0.716SS**  trans-62.368.2169.900000112.7D54D54-G56 PolarHBondContact O-N 3.46Å
57H39.5Very low42Very low134 Ų134136.7 Ų136.762%0.6272%0.719SS**  trans-126.262.1155.1-103.6-65.9000106.6S55 F59S55-H57 PolarHBondContact O-N 3.2Å; H57-F59 PolarHBondContact O-N 2.86Å; H57-F59 VanDerWaalsContact O-N 3.11Å
58E43.4Very low42.1Very low180 Ų180135 Ų13584%0.84172%0.716SS**  trans-48.6119.9142.2-73.2-164.4127.900105.8E60E58-E60 PolarHBondContact O-N 3.27Å
59F37.9Very low42.1Very low97 Ų97138.5 Ų138.543%0.42572%0.721SS.*  trans-68.879.5175.8-80.6-99.2000107.5H57 W61 E62H57-F59 PolarHBondContact O-N 2.86Å; H57-F59 VanDerWaalsContact O-N 3.11Å; F59-W61 AromaticContact CD1-CD1 3.52Å; F59-W61 AromaticContact CD1-NE1 3.66Å; F59-W61 PolarHBondContact O-N 3.11Å; F59-E62 PolarHBondContact O-N 2.7Å; F59-E62 VanDerWaalsContact O-N 3.15Å
60E40.6Very low42.2Very low152 Ų152135.8 Ų135.871%0.7173%0.726SS**G310 helixtrans-54.1-16.7178.2-148.9172.5-16800112.3E58 E62 D63E58-E60 PolarHBondContact O-N 3.27Å; E60-E62 PolarHBondContact O-N 2.8Å; E60-E62 VanDerWaalsContact O-N 3.14Å; E60-D63 PolarHBondContact O-N 3.5Å
61W45.2Very low42.5Very low163 Ų163134.8 Ų134.862%0.61771%0.71SS**G310 helixtrans-66.4-7.8174.8-21.994.3000115.1F59F59-W61 AromaticContact CD1-CD1 3.52Å; F59-W61 AromaticContact CD1-NE1 3.66Å; F59-W61 PolarHBondContact O-N 3.11Å
62E44.8Very low42.4Very low70 Ų70129.1 Ų129.133%0.32770%0.696SS.*G310 helixtrans-82.5-19.3177.3-67.4-158.2127.700114F59 E60 R201 R204F59-E62 PolarHBondContact O-N 2.7Å; F59-E62 VanDerWaalsContact O-N 3.15Å; E60-E62 PolarHBondContact O-N 2.8Å; E60-E62 VanDerWaalsContact O-N 3.14Å; E62-R201 PolarHBondContact O-NH2 2.78Å; E62-R204 IonicContact OE1-CZ 3.36Å; E62-R204 IonicContact OE1-NH1 2.77Å; E62-R204 PolarHBondContact OE1-NH1 2.85Å
63D46.6Very low42.4Very low128 Ų128123.8 Ų123.868%0.68468%0.68SS**THydrogen-bonded Turntrans-106.6-21.5-173.6-88.9-16.4000115.4E60 L65E60-D63 PolarHBondContact O-N 3.5Å; D63-L65 PolarHBondContact O-N 3.38Å
64E41.8Very low42.7Very low169 Ų169119.8 Ų119.879%0.7967%0.668SS**SBendtrans-86.31.1-178.7-72.8-160.1131.300116.1
65L48.5Very low43.4Very low112 Ų112117 Ų11759%0.58665%0.65SS**SBendtrans-95.4133.8178.1-63.2177000111.5D63 R67 R201D63-L65 PolarHBondContact O-N 3.38Å; L65-R67 PolarHBondContact O-N 3.27Å; L65-R201 PolarHBondContact O-NH1 3.28Å
66P38.5Very low43.8Very low116 Ų116113.4 Ų113.475%0.75363%0.626SS**  trans-50.7137.1-174.418-29.9000110.8A68P66-A68 PolarHBondContact O-N 2.96Å
67R42.9Very low44.4Very low223 Ų223112.5 Ų112.584%0.84261%0.611SS**  trans-58.2108.9174.1-72.7-179.7-179.2179.40.7107L65 E69L65-R67 PolarHBondContact O-N 3.27Å; R67-E69 PolarHBondContact O-N 3.05Å
68A43.9Very low44.7Very low95 Ų95113.9 Ų113.979%0.78562%0.618SS**  trans-59.5113.9166.200000106.9P66 G70P66-A68 PolarHBondContact O-N 2.96Å; A68-G70 PolarHBondContact O-N 3Å
69E43.3Very low45.1Very low178 Ų178111.2 Ų111.283%0.83260%0.6SS**  trans-55.6130174-66.4-178.3152.600108.1R67 L71R67-E69 PolarHBondContact O-N 3.05Å; E69-L71 PolarHBondContact O-N 3.18Å; E69-L71 VanDerWaalsContact O-N 3.1Å
70G45.2Very low45.8Very low80 Ų80110.8 Ų110.883%0.82560%0.602SS**  trans-63.4113.4178.100000109.1A68 G72A68-G70 PolarHBondContact O-N 3Å; G70-G72 PolarHBondContact O-N 3.26Å
71L47.3Very low46.2Very low97 Ų97105.7 Ų105.751%0.50859%0.59SS.*  trans-66.7127.1172.7-61.8168.8000108E69 E75E69-L71 PolarHBondContact O-N 3.18Å; E69-L71 VanDerWaalsContact O-N 3.1Å; L71-E75 WeakPolarHBondContact CD2-OE2 3.46Å
72G44.5Very low46.6Very low44 Ų44109.5 Ų109.545%0.45461%0.605SS.*  trans-61.7154.7-177.600000112.5G70 S74 E75 A76G70-G72 PolarHBondContact O-N 3.26Å; G72-S74 PolarHBondContact O-N 3.3Å; G72-E75 PolarHBondContact O-N 3.32Å; G72-A76 PolarHBondContact O-N 3.28Å
73A49.1Very low47.4Very low57 Ų57107.6 Ų107.647%0.47160%0.604SS.*Hα-helixtrans-50.2-31.5-178.900000114A77A73-A77 WeakPolarHBondContact O-CB 3.46Å; A73-A77 PolarHBondContact O-N 3.46Å
74S45.2Very low48.8Very low97 Ų97102.5 Ų102.568%0.67858%0.578SS**Hα-helixtrans-67.6-35176.8-168.10000113.4G72 E78G72-S74 PolarHBondContact O-N 3.3Å; S74-E78 WeakPolarHBondContact O-CG 3.48Å; S74-E78 PolarHBondContact O-N 3.27Å
75E48.4Very low50.9Low91 Ų9198.3 Ų98.343%0.42556%0.559SS.*Hα-helixtrans-83.3-31.4-179.3-157.1179.6163.200111.2L71 G72 R79L71-E75 WeakPolarHBondContact CD2-OE2 3.46Å; G72-E75 PolarHBondContact O-N 3.32Å; E75-R79 VanDerWaalsContact O-CG 3.31Å; E75-R79 WeakPolarHBondContact O-CG 3.17Å; E75-R79 PolarHBondContact O-N 2.83Å
76A48.1Very low52.9Low23 Ų2396.6 Ų96.619%0.1955%0.545CS..Hα-helixtrans-63-43.4167.200000111.3G72 R79 L80 A169G72-A76 PolarHBondContact O-N 3.28Å; A76-R79 PolarHBondContact O-N 3.19Å; A76-L80 WeakPolarHBondContact O-CB 3.43Å; A76-L80 WeakPolarHBondContact O-CD1 3.46Å; A76-L80 WeakPolarHBondContact O-CG 3.46Å; A76-L80 PolarHBondContact O-N 3.48Å; A76-A169 HydrophobicContact CB-CB 4.44Å
77A47.1Very low55.4Low56 Ų5695.9 Ų95.946%0.46354%0.535SS..Hα-helixtrans-64.7-40.6175.600000113.2A73 R79 L80 G81A73-A77 WeakPolarHBondContact O-CB 3.46Å; A73-A77 PolarHBondContact O-N 3.46Å; A77-R79 VanDerWaalsContact C-N 3.34Å; A77-R79 PolarHBondContact O-N 3.46Å; A77-L80 PolarHBondContact O-N 2.87Å; A77-G81 PolarHBondContact O-N 3.21Å
78E46.8Very low57.8Low164 Ų16487.4 Ų87.477%0.76651%0.508SS*.Hα-helixtrans-62-38.7172.7-78.7-109.9132.600112S74 G81S74-E78 WeakPolarHBondContact O-CG 3.48Å; S74-E78 PolarHBondContact O-N 3.27Å; E78-G81 PolarHBondContact O-N 3Å
79R51.3Low60Low123 Ų12386.9 Ų86.946%0.46450%0.503SS..Hα-helixtrans-71.7-30.8174.7-69.4-175.2106.8985.1113.3E75 A76 A77 G81 C84E75-R79 VanDerWaalsContact O-CG 3.31Å; E75-R79 WeakPolarHBondContact O-CG 3.17Å; E75-R79 PolarHBondContact O-N 2.83Å; A76-R79 PolarHBondContact O-N 3.19Å; A77-R79 VanDerWaalsContact C-N 3.34Å; A77-R79 PolarHBondContact O-N 3.46Å; R79-G81 PolarHBondContact O-N 3.13Å; R79-C84 PolarHBondContact O-SG 2.96Å
80L51.9Low62Low88 Ų8879.2 Ų79.246%0.46147%0.472SS..Hα-helixtrans-68.3-19.4177.4-76161.7000113.2A76 A77 L166A76-L80 WeakPolarHBondContact O-CB 3.43Å; A76-L80 WeakPolarHBondContact O-CD1 3.46Å; A76-L80 WeakPolarHBondContact O-CG 3.46Å; A76-L80 PolarHBondContact O-N 3.48Å; A77-L80 PolarHBondContact O-N 2.87Å; L80-L166 HydrophobicContact CD2-CB 4.42Å; L80-L166 HydrophobicContact CD2-CD2 4.2Å; L80-L166 VanDerWaalsContact CD2-O 3.26Å; L80-L166 WeakPolarHBondContact CD2-O 3.42Å
81G50.2Low63.6Low46 Ų4685.5 Ų85.547%0.47448%0.48SS..SBendtrans-82-24.8-161.700000118.6A77 E78 R79A77-G81 PolarHBondContact O-N 3.21Å; E78-G81 PolarHBondContact O-N 3Å; R79-G81 PolarHBondContact O-N 3.13Å
82R52.6Low65.5Low243 Ų24385.8 Ų85.892%0.91748%0.482SS*.SBendtrans-176.9105.2176.3-108.9170-66.7-103.12.2109.3
83G62.1Low67.4Low30 Ų3086.1 Ų86.131%0.30949%0.485SS..SBendtrans114.214172.700000116.6W86 R100G83-W86 WeakPolarHBondContact O-CZ3 3.31Å; G83-R100 PolarHBondContact O-NH1 3.43Å
84C75.8Confident69.4Low21 Ų2187.6 Ų87.614%0.14248%0.479CS..SBendtrans-90.7-18.4166.1-89.60000113.5R79 F99 R100 L166R79-C84 PolarHBondContact O-SG 2.96Å; C84-F99 WeakPolarHBondContact O-CA 3.33Å; C84-R100 PolarHBondContact O-N 3.42Å; C84-L166 HydrophobicContact CB-CD2 3.81Å
85M86.8Confident71.7Confident80 Ų8088.5 Ų88.539%0.39447%0.472SS..EExtended strand (participates in β ladder)trans-148.6134.1175.7-174.1-175.571.900110.3R97 V98 F99 L166M85-R97 HydrophobicContact CG-CG 3.77Å; M85-R97 VanDerWaalsContact SD-CD 3.56Å; M85-R97 HydrophobicContact SD-CG 4.16Å; M85-V98 VanDerWaalsContact CA-O 3.24Å; M85-V98 WeakPolarHBondContact CA-O 3.37Å; M85-F99 HydrophobicContact CB-CD1 4.46Å; M85-F99 HydrophobicContact CG-CD1 4.1Å; M85-F99 HydrophobicContact CG-CE1 3.99Å; M85-F99 HydrophobicContact SD-CD1 4.21Å; M85-F99 HydrophobicContact SD-CE1 3.55Å; M85-F99 VanDerWaalsContact SD-CE1 3.55Å; M85-F99 HydrophobicContact SD-CZ 4.04Å; M85-L166 HydrophobicContact CB-CD1 4.12Å; M85-L166 HydrophobicContact CG-CD1 4.49Å; M85-L166 HydrophobicContact SD-CD1 3.83Å
86W90.2Very high73.9Confident77 Ų7786.2 Ų86.229%0.29246%0.459SS..EExtended strand (participates in β ladder)trans-150.8152.9173.359.198.3000111G83 V98 R100 E105G83-W86 WeakPolarHBondContact O-CZ3 3.31Å; W86-V98 HydrophobicContact CD2-CB 4.08Å; W86-V98 HydrophobicContact CH2-CB 4.25Å; W86-V98 HydrophobicContact CH2-CG1 3.76Å; W86-V98 HydrophobicContact CZ2-CB 3.74Å; W86-V98 HydrophobicContact CZ2-CG1 3.45Å; W86-V98 VanDerWaalsContact CZ2-CG1 3.45Å; W86-V98 HydrophobicContact CZ2-CG2 4.35Å; W86-V98 HydrophobicContact CZ3-CG1 4.49Å; W86-V98 PolarHBondContact N-O 2.98Å; W86-V98 VanDerWaalsContact N-O 3.16Å; W86-V98 PolarHBondContact O-N 3Å; W86-R100 HydrophobicContact CH2-CB 3.95Å; W86-R100 HydrophobicContact CZ3-CB 3.79Å; W86-E105 WeakPolarHBondContact CH2-OE1 3.5Å
87D91.3Very high76.1Confident101 Ų10187.1 Ų87.154%0.5446%0.458SS..EExtended strand (participates in β ladder)trans-96.3140.6178.3-68.3-28.6000110.2W96 R97D87-W96 CarbonylContact C-O 3.59Å; D87-W96 WeakPolarHBondContact CA-O 3.49Å; D87-R97 WeakPolarHBondContact OD1-CB 3.47Å; D87-R97 WeakPolarHBondContact OD1-CG 3.43Å; D87-R97 IonicContact OD1-CZ 3.64Å; D87-R97 IonicContact OD1-NE 3.38Å; D87-R97 PolarHBondContact OD1-NE 2.79Å; D87-R97 IonicContact OD1-NH2 2.93Å; D87-R97 PolarHBondContact OD1-NH2 2.95Å; D87-R97 IonicContact OD2-CZ 3.14Å; D87-R97 IonicContact OD2-NE 2.74Å; D87-R97 IonicContact OD2-NH2 3.79Å; D87-R97 PolarHBondContact OD2-NH2 3.25Å
88V92.1Very high78.2Confident45 Ų4584.7 Ų84.727%0.27344%0.438SS..EExtended strand (participates in β ladder)trans-129.3122.1-179.2-178.20000108G90 W96 V98V88-G90 PolarHBondContact O-N 3.3Å; V88-W96 HydrophobicContact CB-CB 4.29Å; V88-W96 PolarHBondContact N-O 3.48Å; V88-W96 WeakPolarHBondContact O-CB 3.41Å; V88-W96 PolarHBondContact O-N 3.13Å; V88-V98 HydrophobicContact CG2-CG2 3.93Å
89A90.1Very high80.3Confident83 Ų8377 Ų7769%0.68640%0.401SS*.EExtended strand (participates in β ladder)trans-73125.9170.300000109.4
90G86.4Confident82Confident17 Ų1775.8 Ų75.818%0.17540%0.397CS..  trans-80.6147.8169.300000110.7V88 D92 G93 R94V88-G90 PolarHBondContact O-N 3.3Å; G90-D92 PolarHBondContact O-N 3.22Å; G90-G93 PolarHBondContact O-N 3.01Å; G90-R94 WeakPolarHBondContact CA-O 3.4Å; G90-R94 PolarHBondContact N-O 3.36Å
91E79.4Confident83.1Confident212 Ų21272.9 Ų72.999%0.99138%0.382SS*.THydrogen-bonded Turntrans-64.3-19.7178.8-61.8-178.7152.800112.7
92D85.9Confident84.1Confident103 Ų10372.7 Ų72.755%0.55138%0.379SS*.THydrogen-bonded Turntrans-92.412.117964.7-20.7000113.8G90 R94G90-D92 PolarHBondContact O-N 3.22Å; D92-R94 VanDerWaalsContact C-N 3.25Å; D92-R94 PolarHBondContact O-N 2.87Å; D92-R94 WeakPolarHBondContact OD1-CB 3.43Å; D92-R94 WeakPolarHBondContact OD1-CG 3.41Å; D92-R94 PolarHBondContact OD1-N 3.1Å; D92-R94 WeakPolarHBondContact OD2-CD 3.42Å; D92-R94 WeakPolarHBondContact OD2-CG 3.32Å; D92-R94 IonicContact OD2-CZ 3.81Å; D92-R94 IonicContact OD2-NE 2.89Å; D92-R94 PolarHBondContact OD2-NE 3.22Å
93G84.8Confident85Confident51 Ų5167.5 Ų67.553%0.52638%0.377SS..SBendtrans79.24-176.900000114.1G90G90-G93 PolarHBondContact O-N 3.01Å
94R90.5Very high85.7Confident88 Ų8875.5 Ų75.533%0.33240%0.398SS..  trans-76142.3172.4-67.1179.8-166.2-134.76.6111.2G90 D92 D109 T111 Y151G90-R94 WeakPolarHBondContact CA-O 3.4Å; G90-R94 PolarHBondContact N-O 3.36Å; D92-R94 VanDerWaalsContact C-N 3.25Å; D92-R94 PolarHBondContact O-N 2.87Å; D92-R94 WeakPolarHBondContact OD1-CB 3.43Å; D92-R94 WeakPolarHBondContact OD1-CG 3.41Å; D92-R94 PolarHBondContact OD1-N 3.1Å; D92-R94 WeakPolarHBondContact OD2-CD 3.42Å; D92-R94 WeakPolarHBondContact OD2-CG 3.32Å; D92-R94 IonicContact OD2-CZ 3.81Å; D92-R94 IonicContact OD2-NE 2.89Å; D92-R94 PolarHBondContact OD2-NE 3.22Å; R94-D109 WeakPolarHBondContact CD-OD2 3.49Å; R94-D109 IonicContact CZ-OD2 3.97Å; R94-D109 IonicContact NE-OD2 2.74Å; R94-D109 IonicContact NH1-OD2 3.8Å; R94-D109 PolarHBondContact NH1-OD2 3.44Å; R94-T111 WeakPolarHBondContact CA-OG1 3.41Å; R94-Y151 PolarHBondContact NH1-OH 2.86Å; R94-Y151 VanDerWaalsContact NH1-OH 3.14Å
95H93.6Very high86.3Confident116 Ų11680 Ų8054%0.53742%0.417SS..EExtended strand (participates in β ladder)trans-99.3120.2172.1-59.586000108.5M110 T111H95-M110 HydrophobicContact CB-CB 4.13Å; H95-M110 WeakPolarHBondContact O-CA 3.45Å; H95-M110 WeakPolarHBondContact O-CB 3.34Å; H95-M110 PolarHBondContact O-N 3.38Å; H95-T111 PolarHBondContact N-OG1 2.97Å
96W94.8Very high86.4Confident43 Ų4378.2 Ų78.216%0.16341%0.408CS..EExtended strand (participates in β ladder)trans-106139.9177.7-62.890000110D87 V88 R107 V108 D109 H155D87-W96 CarbonylContact C-O 3.59Å; D87-W96 WeakPolarHBondContact CA-O 3.49Å; V88-W96 HydrophobicContact CB-CB 4.29Å; V88-W96 PolarHBondContact N-O 3.48Å; V88-W96 WeakPolarHBondContact O-CB 3.41Å; V88-W96 PolarHBondContact O-N 3.13Å; W96-R107 HydrophobicContact CE3-CB 4.22Å; W96-R107 HydrophobicContact CE3-CG 4.43Å; W96-V108 CarbonylContact C-O 3.55Å; W96-V108 VanDerWaalsContact CA-O 3.3Å; W96-V108 WeakPolarHBondContact CA-O 3.17Å; W96-D109 HydrophobicContact CE3-CB 3.99Å; W96-D109 HydrophobicContact CH2-CB 3.92Å; W96-D109 HydrophobicContact CZ3-CB 3.63Å; W96-H155 AromaticContact CZ3-CE1 3.86Å
97R94.3Very high86.6Confident42 Ų4280.2 Ų80.216%0.15842%0.415CS..EExtended strand (participates in β ladder)trans-113.8126.6167.5-179164.4-74.4-175.51.2109.1M85 D87 F99 V108 M110M85-R97 HydrophobicContact CG-CG 3.77Å; M85-R97 VanDerWaalsContact SD-CD 3.56Å; M85-R97 HydrophobicContact SD-CG 4.16Å; D87-R97 WeakPolarHBondContact OD1-CB 3.47Å; D87-R97 WeakPolarHBondContact OD1-CG 3.43Å; D87-R97 IonicContact OD1-CZ 3.64Å; D87-R97 IonicContact OD1-NE 3.38Å; D87-R97 PolarHBondContact OD1-NE 2.79Å; D87-R97 IonicContact OD1-NH2 2.93Å; D87-R97 PolarHBondContact OD1-NH2 2.95Å; D87-R97 IonicContact OD2-CZ 3.14Å; D87-R97 IonicContact OD2-NE 2.74Å; D87-R97 IonicContact OD2-NH2 3.79Å; D87-R97 PolarHBondContact OD2-NH2 3.25Å; R97-F99 HydrophobicContact CB-CE2 4.26Å; R97-F99 VanDerWaalsContact CD-CZ 3.49Å; R97-F99 HydrophobicContact CG-CD2 4.16Å; R97-F99 HydrophobicContact CG-CE2 3.61Å; R97-F99 HydrophobicContact CG-CZ 3.84Å; R97-V108 HydrophobicContact CB-CB 4.48Å; R97-V108 PolarHBondContact N-O 2.77Å; R97-V108 PolarHBondContact O-N 3.16Å; R97-M110 HydrophobicContact CB-CG 3.48Å; R97-M110 VanDerWaalsContact CB-CG 3.48Å; R97-M110 HydrophobicContact CB-SD 3.47Å; R97-M110 WeakPolarHBondContact CB-SD 3.2Å; R97-M110 HydrophobicContact CG-SD 4.29Å
98V92.3Very high86.8Confident6 Ų675.4 Ų75.44%0.03639%0.389CS..EExtended strand (participates in β ladder)trans-100.4125.5176.6-168.80000108.1M85 W86 V88 E105 Q106 R107M85-V98 VanDerWaalsContact CA-O 3.24Å; M85-V98 WeakPolarHBondContact CA-O 3.37Å; W86-V98 HydrophobicContact CD2-CB 4.08Å; W86-V98 HydrophobicContact CH2-CB 4.25Å; W86-V98 HydrophobicContact CH2-CG1 3.76Å; W86-V98 HydrophobicContact CZ2-CB 3.74Å; W86-V98 HydrophobicContact CZ2-CG1 3.45Å; W86-V98 VanDerWaalsContact CZ2-CG1 3.45Å; W86-V98 HydrophobicContact CZ2-CG2 4.35Å; W86-V98 HydrophobicContact CZ3-CG1 4.49Å; W86-V98 PolarHBondContact N-O 2.98Å; W86-V98 VanDerWaalsContact N-O 3.16Å; W86-V98 PolarHBondContact O-N 3Å; V88-V98 HydrophobicContact CG2-CG2 3.93Å; V98-E105 HydrophobicContact CG1-CB 4.15Å; V98-Q106 WeakPolarHBondContact CA-O 3.43Å; V98-R107 HydrophobicContact CG2-CG 3.76Å
99F90.7Very high86.9Confident2 Ų273.3 Ų73.31%0.00938%0.376CS..EExtended strand (participates in β ladder)trans-104.5125.8169.5-64.7-91.8000108.6C84 M85 R97 I101 Q106 V108 Y159 L166C84-F99 WeakPolarHBondContact O-CA 3.33Å; M85-F99 HydrophobicContact CB-CD1 4.46Å; M85-F99 HydrophobicContact CG-CD1 4.1Å; M85-F99 HydrophobicContact CG-CE1 3.99Å; M85-F99 HydrophobicContact SD-CD1 4.21Å; M85-F99 HydrophobicContact SD-CE1 3.55Å; M85-F99 VanDerWaalsContact SD-CE1 3.55Å; M85-F99 HydrophobicContact SD-CZ 4.04Å; R97-F99 HydrophobicContact CB-CE2 4.26Å; R97-F99 VanDerWaalsContact CD-CZ 3.49Å; R97-F99 HydrophobicContact CG-CD2 4.16Å; R97-F99 HydrophobicContact CG-CE2 3.61Å; R97-F99 HydrophobicContact CG-CZ 3.84Å; F99-I101 HydrophobicContact CB-CD1 4.36Å; F99-I101 HydrophobicContact CB-CG1 4.35Å; F99-Q106 PolarHBondContact N-O 3.49Å; F99-Q106 PolarHBondContact O-N 3.48Å; F99-V108 HydrophobicContact CD2-CG2 3.76Å; F99-V108 HydrophobicContact CE2-CB 4.17Å; F99-V108 HydrophobicContact CE2-CG2 3.68Å; F99-Y159 HydrophobicContact CE2-CD2 4.28Å; F99-Y159 AromaticContact CZ-CD2 3.93Å; F99-Y159 HydrophobicContact CZ-CD2 3.93Å; F99-Y159 HydrophobicContact CZ-CE2 4.33Å; F99-L166 HydrophobicContact CD1-CD1 3.88Å; F99-L166 HydrophobicContact CE1-CD1 3.78Å
100R85.6Confident87.2Confident98 Ų9869.7 Ų69.737%0.3735%0.346SS..EExtended strand (participates in β ladder)trans-98.2108173.5-178.7179.6-68.3148.2-6.4109.3G83 C84 W86 E105G83-R100 PolarHBondContact O-NH1 3.43Å; C84-R100 PolarHBondContact O-N 3.42Å; W86-R100 HydrophobicContact CH2-CB 3.95Å; W86-R100 HydrophobicContact CZ3-CB 3.79Å; R100-E105 IonicContact CZ-OE1 3.22Å; R100-E105 IonicContact NE-OE1 3.64Å; R100-E105 PolarHBondContact NE-OE1 2.82Å; R100-E105 VanDerWaalsContact NE-OE1 3.14Å; R100-E105 IonicContact NH2-OE1 3.01Å; R100-E105 PolarHBondContact NH2-OE1 3.33Å
101I75.9Confident87.6Confident27 Ų2772 Ų7214%0.13836%0.356CS..EExtended strand (participates in β ladder)trans-112.593.9-175.1-66.3175000106.8F99 R104 V161 E165F99-I101 HydrophobicContact CB-CD1 4.36Å; F99-I101 HydrophobicContact CB-CG1 4.35Å; I101-R104 PolarHBondContact N-O 3.21Å; I101-R104 PolarHBondContact O-N 3.12Å; I101-V161 HydrophobicContact CD1-CG1 4.49Å; I101-E165 WeakPolarHBondContact CB-OE2 2.93Å; I101-E165 WeakPolarHBondContact CG1-OE2 3.16Å; I101-E165 VanDerWaalsContact CG2-CD 3.42Å; I101-E165 WeakPolarHBondContact CG2-OE1 3.37Å; I101-E165 WeakPolarHBondContact CG2-OE2 3.1Å
102G71.9Confident88.3Confident41 Ų4163.8 Ų63.842%0.42332%0.321SS..THydrogen-bonded Turntrans56.7-124-172.700000111.8R104G102-R104 VanDerWaalsContact C-N 3.33Å
103P70.4Confident88.8Confident135 Ų13558.9 Ų58.988%0.87729%0.294SS*.THydrogen-bonded Turntrans-83.2-4.5175.934.6-34.6000113.9
104R77.7Confident89.3Confident197 Ų19761.3 Ų61.374%0.74329%0.292SS*.EExtended strand (participates in β ladder)trans-100.9135.4-175.6-55.8-178.199.1177.76.4109.9I101 G102I101-R104 PolarHBondContact N-O 3.21Å; I101-R104 PolarHBondContact O-N 3.12Å; G102-R104 VanDerWaalsContact C-N 3.33Å
105E88.3Confident89.5Confident115 Ų11561.4 Ų61.454%0.53730%0.304SS..EExtended strand (participates in β ladder)trans-105.2127.7170-63.9-168.316000109.4W86 V98 R100W86-E105 WeakPolarHBondContact CH2-OE1 3.5Å; V98-E105 HydrophobicContact CG1-CB 4.15Å; R100-E105 IonicContact CZ-OE1 3.22Å; R100-E105 IonicContact NE-OE1 3.64Å; R100-E105 PolarHBondContact NE-OE1 2.82Å; R100-E105 VanDerWaalsContact NE-OE1 3.14Å; R100-E105 IonicContact NH2-OE1 3.01Å; R100-E105 PolarHBondContact NH2-OE1 3.33Å
106Q89.1Confident89.6Confident43 Ų4358.1 Ų58.120%0.20129%0.287CS..EExtended strand (participates in β ladder)trans-115.2119.9178.9-176.2166.969.200109.8V98 F99 R158V98-Q106 WeakPolarHBondContact CA-O 3.43Å; F99-Q106 PolarHBondContact N-O 3.49Å; F99-Q106 PolarHBondContact O-N 3.48Å; Q106-R158 VanDerWaalsContact CD-CB 3.45Å; Q106-R158 VanDerWaalsContact CD-CG 3.5Å; Q106-R158 HydrophobicContact CG-CB 3.95Å; Q106-R158 HydrophobicContact CG-CG 4.02Å; Q106-R158 VanDerWaalsContact NE2-CG 3.27Å; Q106-R158 PolarHBondContact OE1-O 2.7Å
107R92.9Very high89.4Confident120 Ų12058.4 Ų58.445%0.45329%0.29SS..EExtended strand (participates in β ladder)trans-91.6132.9174.4-104.1179.2152.4-170.9-8.3111.7W96 V98 R158W96-R107 HydrophobicContact CE3-CB 4.22Å; W96-R107 HydrophobicContact CE3-CG 4.43Å; V98-R107 HydrophobicContact CG2-CG 3.76Å; R107-R158 PolarHBondContact O-NH1 3.41Å; R107-R158 VanDerWaalsContact O-NH1 3.11Å
108V95.3Very high89.4Confident0 Ų063.1 Ų63.10%031%0.311CS..EExtended strand (participates in β ladder)trans-121.1125.4178.1178.70000109W96 R97 F99 M110 I113 H155 R158W96-V108 CarbonylContact C-O 3.55Å; W96-V108 VanDerWaalsContact CA-O 3.3Å; W96-V108 WeakPolarHBondContact CA-O 3.17Å; R97-V108 HydrophobicContact CB-CB 4.48Å; R97-V108 PolarHBondContact N-O 2.77Å; R97-V108 PolarHBondContact O-N 3.16Å; F99-V108 HydrophobicContact CD2-CG2 3.76Å; F99-V108 HydrophobicContact CE2-CB 4.17Å; F99-V108 HydrophobicContact CE2-CG2 3.68Å; V108-M110 HydrophobicContact CB-SD 4.46Å; V108-M110 HydrophobicContact CG1-SD 3.89Å; V108-M110 PolarHBondContact O-N 3.44Å; V108-I113 HydrophobicContact CG1-CD1 3.46Å; V108-I113 VanDerWaalsContact CG1-CD1 3.46Å; V108-I113 HydrophobicContact CG1-CG1 4.39Å; V108-H155 HydrophobicContact CG1-CB 4.49Å; V108-R158 HydrophobicContact CG2-CB 3.64Å
109D95.9Very high89.4Confident0 Ų062.8 Ų62.80%031%0.309CS..EExtended strand (participates in β ladder)trans-77.1103.5170.7-171.5-18.3000108.2R94 W96 T111 V112 I113 Y151 H155R94-D109 WeakPolarHBondContact CD-OD2 3.49Å; R94-D109 IonicContact CZ-OD2 3.97Å; R94-D109 IonicContact NE-OD2 2.74Å; R94-D109 IonicContact NH1-OD2 3.8Å; R94-D109 PolarHBondContact NH1-OD2 3.44Å; W96-D109 HydrophobicContact CE3-CB 3.99Å; W96-D109 HydrophobicContact CH2-CB 3.92Å; W96-D109 HydrophobicContact CZ3-CB 3.63Å; D109-T111 VanDerWaalsContact C-N 3.25Å; D109-T111 PolarHBondContact O-N 3.2Å; D109-T111 WeakPolarHBondContact OD1-CB 3.46Å; D109-T111 PolarHBondContact OD1-N 3.14Å; D109-T111 PolarHBondContact OD1-OG1 3.03Å; D109-V112 HydrophobicContact CB-CG2 4.01Å; D109-V112 WeakPolarHBondContact O-CG2 3.46Å; D109-I113 WeakPolarHBondContact O-CG1 3.42Å; D109-Y151 PolarHBondContact OD2-OH 3.22Å; D109-H155 PolarHBondContact N-ND1 2.83Å
110M95.5Very high89.6Confident8 Ų863.5 Ų63.54%0.03931%0.313CS..Hα-helixtrans-68.6-28.3179.4-63.2-55.8-59.600111.7H95 R97 V108 V112 I113 E114 K117 Y159H95-M110 HydrophobicContact CB-CB 4.13Å; H95-M110 WeakPolarHBondContact O-CA 3.45Å; H95-M110 WeakPolarHBondContact O-CB 3.34Å; H95-M110 PolarHBondContact O-N 3.38Å; R97-M110 HydrophobicContact CB-CG 3.48Å; R97-M110 VanDerWaalsContact CB-CG 3.48Å; R97-M110 HydrophobicContact CB-SD 3.47Å; R97-M110 WeakPolarHBondContact CB-SD 3.2Å; R97-M110 HydrophobicContact CG-SD 4.29Å; V108-M110 HydrophobicContact CB-SD 4.46Å; V108-M110 HydrophobicContact CG1-SD 3.89Å; V108-M110 PolarHBondContact O-N 3.44Å; M110-V112 VanDerWaalsContact C-N 3.31Å; M110-V112 PolarHBondContact O-N 3.46Å; M110-I113 HydrophobicContact CE-CD1 4.05Å; M110-I113 HydrophobicContact CE-CG1 4.3Å; M110-I113 PolarHBondContact O-N 3.37Å; M110-I113 HydrophobicContact SD-CD1 3.81Å; M110-I113 HydrophobicContact SD-CG1 4.27Å; M110-E114 WeakPolarHBondContact O-CB 3.41Å; M110-E114 PolarHBondContact O-N 3.27Å; M110-K117 HydrophobicContact CE-CD 3.78Å; M110-K117 HydrophobicContact CE-CG 4.33Å; M110-Y159 HydrophobicContact CE-CD2 4.24Å; M110-Y159 HydrophobicContact CE-CE2 4.06Å; M110-Y159 HydrophobicContact SD-CD2 4.24Å
111T94.3Very high89.9Confident64 Ų6460.6 Ų60.639%0.39331%0.308SS..Hα-helixtrans-59.2-43.6-178.1-31.20000111.5R94 H95 D109R94-T111 WeakPolarHBondContact CA-OG1 3.41Å; H95-T111 PolarHBondContact N-OG1 2.97Å; D109-T111 VanDerWaalsContact C-N 3.25Å; D109-T111 PolarHBondContact O-N 3.2Å; D109-T111 WeakPolarHBondContact OD1-CB 3.46Å; D109-T111 PolarHBondContact OD1-N 3.14Å; D109-T111 PolarHBondContact OD1-OG1 3.03Å
112V95.5Very high90.5Very high41 Ų4162.8 Ų62.825%0.24832%0.317CS..Hα-helixtrans-82.8-25.1-176.4-55.90000113.2D109 M110 Y151 V152 H155D109-V112 HydrophobicContact CB-CG2 4.01Å; D109-V112 WeakPolarHBondContact O-CG2 3.46Å; M110-V112 VanDerWaalsContact C-N 3.31Å; M110-V112 PolarHBondContact O-N 3.46Å; V112-Y151 HydrophobicContact CB-CE1 4.49Å; V112-Y151 HydrophobicContact CG1-CD1 4.4Å; V112-Y151 HydrophobicContact CG1-CE1 3.94Å; V112-Y151 HydrophobicContact CG2-CD1 4.22Å; V112-Y151 HydrophobicContact CG2-CE1 3.93Å; V112-V152 HydrophobicContact CB-CG2 4.36Å; V112-H155 HydrophobicContact CG2-CB 4.25Å
113I96.1Very high91.2Very high0 Ų061 Ų610%030%0.299CS..Hα-helixtrans-96.9-9.2-178.669.7167.7000113.8V108 D109 M110 P115 Y116 K117 H155 L156 Y159V108-I113 HydrophobicContact CG1-CD1 3.46Å; V108-I113 VanDerWaalsContact CG1-CD1 3.46Å; V108-I113 HydrophobicContact CG1-CG1 4.39Å; D109-I113 WeakPolarHBondContact O-CG1 3.42Å; M110-I113 HydrophobicContact CE-CD1 4.05Å; M110-I113 HydrophobicContact CE-CG1 4.3Å; M110-I113 PolarHBondContact O-N 3.37Å; M110-I113 HydrophobicContact SD-CD1 3.81Å; M110-I113 HydrophobicContact SD-CG1 4.27Å; I113-P115 VanDerWaalsContact C-N 3.29Å; I113-P115 VanDerWaalsContact O-N 3.16Å; I113-Y116 CarbonylContact O-C 3.58Å; I113-Y116 WeakPolarHBondContact O-CA 3.44Å; I113-Y116 PolarHBondContact O-N 2.96Å; I113-K117 PolarHBondContact O-N 2.96Å; I113-K117 VanDerWaalsContact O-N 3.16Å; I113-H155 HydrophobicContact CG2-CB 3.73Å; I113-L156 HydrophobicContact CB-CD1 4.37Å; I113-L156 HydrophobicContact CG2-CB 4.24Å; I113-Y159 VanDerWaalsContact CD1-CB 3.44Å; I113-Y159 HydrophobicContact CD1-CD1 4.15Å; I113-Y159 HydrophobicContact CD1-CD2 3.75Å; I113-Y159 HydrophobicContact CD1-CG 3.5Å; I113-Y159 VanDerWaalsContact CD1-CG 3.5Å
114E94.2Very high91.9Very high101 Ų10154.8 Ų54.847%0.47226%0.26SS..G310 helixtrans-46.7-45.1-178-166.262.9-14900113.4M110 Y116 K117M110-E114 WeakPolarHBondContact O-CB 3.41Å; M110-E114 PolarHBondContact O-N 3.27Å; E114-Y116 PolarHBondContact O-N 3.33Å; E114-K117 HydrophobicContact CG-CD 4.48Å; E114-K117 IonicContact OE1-NZ 3.46Å; E114-K117 PolarHBondContact OE1-NZ 3.44Å; E114-K117 WeakPolarHBondContact OE2-CD 3.36Å; E114-K117 IonicContact OE2-NZ 2.87Å; E114-K117 PolarHBondContact OE2-NZ 3.39Å
115P94.9Very high92.2Very high90 Ų9052 Ų5258%0.58425%0.25SC*.G310 helixtrans-65.2-21178.8-20.434.3000114.2I113I113-P115 VanDerWaalsContact C-N 3.29Å; I113-P115 VanDerWaalsContact O-N 3.16Å
116Y95.3Very high91.7Very high47 Ų4749 Ų4918%0.18424%0.236CC..G310 helixtrans-110-0-169.7-49.2-64.4000113.2I113 E114 K118 V119 Y140 P142 I146 V152I113-Y116 CarbonylContact O-C 3.58Å; I113-Y116 WeakPolarHBondContact O-CA 3.44Å; I113-Y116 PolarHBondContact O-N 2.96Å; E114-Y116 PolarHBondContact O-N 3.33Å; Y116-K118 PolarHBondContact O-N 2.81Å; Y116-K118 VanDerWaalsContact O-N 3.1Å; Y116-V119 VanDerWaalsContact O-CB 3.22Å; Y116-V119 WeakPolarHBondContact O-CB 3.37Å; Y116-V119 VanDerWaalsContact O-CG1 3.24Å; Y116-V119 WeakPolarHBondContact O-CG1 3.43Å; Y116-V119 PolarHBondContact O-N 2.86Å; Y116-Y140 VanDerWaalsContact CD1-O 3.31Å; Y116-Y140 WeakPolarHBondContact CD1-O 3.33Å; Y116-P142 HydrophobicContact CD1-CB 4.37Å; Y116-P142 HydrophobicContact CD1-CG 3.88Å; Y116-P142 HydrophobicContact CD2-CG 3.83Å; Y116-P142 HydrophobicContact CE1-CB 3.98Å; Y116-P142 HydrophobicContact CE1-CG 3.98Å; Y116-P142 HydrophobicContact CE2-CB 4.22Å; Y116-P142 HydrophobicContact CE2-CG 3.94Å; Y116-P142 HydrophobicContact CG-CG 3.8Å; Y116-I146 HydrophobicContact CE2-CD1 4.41Å; Y116-V152 HydrophobicContact CD2-CG1 3.84Å; Y116-V152 HydrophobicContact CE2-CG1 3.67Å
117K92.2Very high91Very high49 Ų4949.7 Ų49.721%0.21325%0.254CS..G310 helixtrans-56.9-29.4-179.5-76.216271.3-175.90113.5M110 I113 E114 V119 L120 Y159M110-K117 HydrophobicContact CE-CD 3.78Å; M110-K117 HydrophobicContact CE-CG 4.33Å; I113-K117 PolarHBondContact O-N 2.96Å; I113-K117 VanDerWaalsContact O-N 3.16Å; E114-K117 HydrophobicContact CG-CD 4.48Å; E114-K117 IonicContact OE1-NZ 3.46Å; E114-K117 PolarHBondContact OE1-NZ 3.44Å; E114-K117 WeakPolarHBondContact OE2-CD 3.36Å; E114-K117 IonicContact OE2-NZ 2.87Å; E114-K117 PolarHBondContact OE2-NZ 3.39Å; K117-V119 PolarHBondContact O-N 3.36Å; K117-V119 VanDerWaalsContact O-N 3.12Å; K117-L120 PolarHBondContact O-N 2.96Å; K117-Y159 HydrophobicContact CB-CE1 4.44Å; K117-Y159 HydrophobicContact CG-CE1 4.24Å
118K92.4Very high89.8Confident141 Ų14151.2 Ų51.261%0.61327%0.272SS*.G310 helixtrans-64.6-10.8176.1-62.9-175.7-179.3-179.50113.7Y116 L120 Y140Y116-K118 PolarHBondContact O-N 2.81Å; Y116-K118 VanDerWaalsContact O-N 3.1Å; K118-L120 PolarHBondContact O-N 2.8Å; K118-Y140 HydrophobicContact CB-CD2 3.64Å; K118-Y140 HydrophobicContact CB-CE2 3.82Å; K118-Y140 HydrophobicContact CB-CG 4.02Å; K118-Y140 WeakPolarHBondContact O-CD2 3.42Å
119V94.1Very high88.4Confident0 Ų053 Ų530%029%0.29CS..G310 helixtrans-56.8-29.2174.177.60000111.7Y116 K117 F136 A137 L141 L156 M160Y116-V119 VanDerWaalsContact O-CB 3.22Å; Y116-V119 WeakPolarHBondContact O-CB 3.37Å; Y116-V119 VanDerWaalsContact O-CG1 3.24Å; Y116-V119 WeakPolarHBondContact O-CG1 3.43Å; Y116-V119 PolarHBondContact O-N 2.86Å; K117-V119 PolarHBondContact O-N 3.36Å; K117-V119 VanDerWaalsContact O-N 3.12Å; V119-F136 HydrophobicContact CG2-CD2 3.92Å; V119-F136 HydrophobicContact CG2-CE2 3.52Å; V119-F136 HydrophobicContact CG2-CZ 3.96Å; V119-F136 CarbonylContact O-C 3.54Å; V119-F136 VanDerWaalsContact O-CA 3.23Å; V119-F136 WeakPolarHBondContact O-CA 3.44Å; V119-A137 PolarHBondContact O-N 3.19Å; V119-L141 HydrophobicContact CG2-CD2 3.89Å; V119-L141 HydrophobicContact CG2-CG 4.05Å; V119-L156 HydrophobicContact CG1-CD1 3.84Å; V119-L156 HydrophobicContact CG1-CD2 4.42Å; V119-L156 HydrophobicContact CG1-CG 4.35Å; V119-M160 HydrophobicContact CG1-CG 4.23Å; V119-M160 HydrophobicContact CG1-SD 3.98Å
120L93.5Very high87.2Confident16 Ų1657.7 Ų57.78%0.08432%0.315CS..EExtended strand (participates in β ladder)trans-122.5131.3-179.9-16274.8000110.2K117 K118 I134 L135 M160 T163K117-L120 PolarHBondContact O-N 2.96Å; K118-L120 PolarHBondContact O-N 2.8Å; L120-I134 HydrophobicContact CD1-CG2 3.55Å; L120-I134 HydrophobicContact CG-CG2 4.01Å; L120-L135 CarbonylContact C-O 3.57Å; L120-L135 VanDerWaalsContact CA-O 3.31Å; L120-L135 WeakPolarHBondContact CA-O 3.19Å; L120-M160 HydrophobicContact CD2-CG 4.47Å; L120-T163 HydrophobicContact CD2-CG2 3.66Å
121S91.5Very high86.5Confident37 Ų3758.2 Ų58.226%0.25932%0.318SS..EExtended strand (participates in β ladder)trans-143151.9174.5600000112L135S121-L135 PolarHBondContact N-O 2.79Å; S121-L135 PolarHBondContact O-N 3.12Å; S121-L135 WeakPolarHBondContact OG-CB 3.35Å
122H89.6Confident86.2Confident73 Ų7355.3 Ų55.334%0.33830%0.3SS..EExtended strand (participates in β ladder)trans-90.8124174.2-175.6-101.7000109.8G124 Y125H122-G124 VanDerWaalsContact CE1-CA 3.43Å; H122-G124 WeakPolarHBondContact CE1-CA 3.28Å; H122-G124 PolarHBondContact CE1-N 2.77Å; H122-G124 PolarHBondContact CE1-O 2.73Å; H122-G124 PolarHBondContact ND1-N 2.84Å; H122-G124 PolarHBondContact NE2-O 3.1Å; H122-Y125 AromaticContact CE1-CE2 3.67Å; H122-Y125 AromaticContact NE2-CE2 3.97Å; H122-Y125 AromaticContact NE2-CZ 3.95Å
123G86.1Confident86Confident4 Ų453.5 Ų53.54%0.04129%0.289CS..EExtended strand (participates in β ladder)trans-97.611.8-17700000114.5V133 L135G123-V133 PolarHBondContact N-O 2.84Å; G123-L135 VanDerWaalsContact CA-CD1 3.46Å
124G85.8Confident85.8Confident5 Ų553.5 Ų53.55%0.05229%0.289CS..EExtended strand (participates in β ladder)trans93.8-163.4-174.600000112.6H122 V133H122-G124 VanDerWaalsContact CE1-CA 3.43Å; H122-G124 WeakPolarHBondContact CE1-CA 3.28Å; H122-G124 PolarHBondContact CE1-N 2.77Å; H122-G124 PolarHBondContact CE1-O 2.73Å; H122-G124 PolarHBondContact ND1-N 2.84Å; H122-G124 PolarHBondContact NE2-O 3.1Å; G124-V133 PolarHBondContact O-N 2.83Å
125Y83.8Confident85.8Confident137 Ų13748.7 Ų48.754%0.53727%0.267SS..EExtended strand (participates in β ladder)trans-114.1143.7179.2-65-91.7000110.2H122 G129 N131 A132H122-Y125 AromaticContact CE1-CE2 3.67Å; H122-Y125 AromaticContact NE2-CE2 3.97Å; H122-Y125 AromaticContact NE2-CZ 3.95Å; Y125-G129 WeakPolarHBondContact CD1-O 3.27Å; Y125-N131 CarbonylContact C-O 3.56Å; Y125-N131 WeakPolarHBondContact CA-O 3.24Å; Y125-A132 HydrophobicContact CD1-CB 4.16Å; Y125-A132 HydrophobicContact CE1-CB 3.93Å
126H77.4Confident85.8Confident54 Ų5445.9 Ų45.925%0.2525%0.245CC..EExtended strand (participates in β ladder)trans-115.7144.7-178.5177.967.1000112.5N131 V133 L173 L250 I251H126-N131 PolarHBondContact N-O 2.77Å; H126-N131 PolarHBondContact O-ND2 3.17Å; H126-V133 HydrophobicContact CB-CG2 3.64Å; H126-L173 HydrophobicContact CB-CD1 4.2Å; H126-L250 PolarHBondContact CE1-O 3.32Å; H126-L250 PolarHBondContact ND1-O 3.47Å; H126-L250 PolarHBondContact NE2-O 2.81Å; H126-L250 VanDerWaalsContact NE2-O 3.12Å; H126-I251 HydrophobicContact CB-CG2 4.19Å
127G74.1Confident85.8Confident56 Ų5643.9 Ų43.958%0.57724%0.238SC*.THydrogen-bonded Turntrans74.3-133.1-176.400000111.4G129G127-G129 PolarHBondContact O-N 3.29Å
128D67.6Low85.8Confident153 Ų15341.7 Ų41.782%0.81823%0.229SC*.THydrogen-bonded Turntrans-70.318.7-179.8-49.8-34000114L130D128-L130 VanDerWaalsContact C-N 3.27Å; D128-L130 PolarHBondContact O-N 3.48Å
129G67.3Low85.8Confident38 Ų3835.9 Ų35.939%0.39221%0.206SC..THydrogen-bonded Turntrans80.3-1.8-176.200000115.1Y125 G127Y125-G129 WeakPolarHBondContact CD1-O 3.27Å; G127-G129 PolarHBondContact O-N 3.29Å
130L69.6Low85.8Confident98 Ų9839 Ų3951%0.51322%0.218SC..THydrogen-bonded Turntrans-87.5-16.7-174.7-60.8176000114.3D128D128-L130 VanDerWaalsContact C-N 3.27Å; D128-L130 PolarHBondContact O-N 3.48Å
131N81.6Confident85.9Confident19 Ų1938.6 Ų38.610%0.10222%0.216CC..EExtended strand (participates in β ladder)trans-106108.9-177.5-57.2-78.5000110.7Y125 H126 N171 R208Y125-N131 CarbonylContact C-O 3.56Å; Y125-N131 WeakPolarHBondContact CA-O 3.24Å; H126-N131 PolarHBondContact N-O 2.77Å; H126-N131 PolarHBondContact O-ND2 3.17Å; N131-N171 WeakPolarHBondContact CA-O 3.29Å; N131-N171 VanDerWaalsContact OD1-CB 3.28Å; N131-N171 WeakPolarHBondContact OD1-CB 3.22Å; N131-R208 PolarHBondContact ND2-NH1 3.16Å
132A88.6Confident86Confident3 Ų336.8 Ų36.83%0.02520%0.204CC..EExtended strand (participates in β ladder)trans-67136.1173.300000110.3Y125 N171 Y172 L173Y125-A132 HydrophobicContact CD1-CB 4.16Å; Y125-A132 HydrophobicContact CE1-CB 3.93Å; A132-N171 PolarHBondContact N-O 2.82Å; A132-N171 VanDerWaalsContact N-O 3.1Å; A132-Y172 CarbonylContact O-C 3.47Å; A132-Y172 WeakPolarHBondContact O-CA 3.19Å; A132-Y172 WeakPolarHBondContact O-CB 3.35Å; A132-L173 PolarHBondContact O-N 2.93Å
133V91.1Very high86.2Confident3 Ų340.1 Ų40.12%0.01821%0.213CC..EExtended strand (participates in β ladder)trans-98.8118.2172.5-179.20000108G123 G124 H126 L135 L173 V175 I251G123-V133 PolarHBondContact N-O 2.84Å; G124-V133 PolarHBondContact O-N 2.83Å; H126-V133 HydrophobicContact CB-CG2 3.64Å; V133-L135 HydrophobicContact CG1-CD1 4.23Å; V133-L173 HydrophobicContact CG2-CD1 4.49Å; V133-V175 HydrophobicContact CG1-CG2 4.16Å; V133-I251 HydrophobicContact CG1-CD1 3.74Å; V133-I251 HydrophobicContact CG2-CG2 3.98Å
134I92.4Very high86.6Confident0 Ų043.3 Ų43.30%024%0.235CC..EExtended strand (participates in β ladder)trans-116.3127.3180-52.4-176.9000107.7L120 L164 L167 V168 Y172 L173 L174 V175L120-I134 HydrophobicContact CD1-CG2 3.55Å; L120-I134 HydrophobicContact CG-CG2 4.01Å; I134-L164 HydrophobicContact CB-CD2 4.39Å; I134-L164 HydrophobicContact CD1-CD2 3.4Å; I134-L164 HydrophobicContact CG1-CD2 4.45Å; I134-L164 HydrophobicContact CG2-CD2 3.83Å; I134-L167 HydrophobicContact CD1-CB 3.97Å; I134-L167 HydrophobicContact CD1-CD1 4.1Å; I134-L167 HydrophobicContact CG1-CD1 4.42Å; I134-V168 HydrophobicContact CD1-CG2 3.92Å; I134-Y172 HydrophobicContact CD1-CD2 3.76Å; I134-Y172 HydrophobicContact CD1-CE2 4.44Å; I134-Y172 HydrophobicContact CD1-CG 4.22Å; I134-Y172 HydrophobicContact CG1-CD2 4.27Å; I134-L173 PolarHBondContact N-O 3.1Å; I134-L174 HydrophobicContact CB-CD1 4.13Å; I134-L174 HydrophobicContact CG2-CD1 4.04Å; I134-L174 CarbonylContact O-C 3.58Å; I134-L174 WeakPolarHBondContact O-CA 3.32Å; I134-V175 PolarHBondContact O-N 2.88Å
135L93.9Very high86.9Confident0 Ų047.9 Ų47.90%027%0.266CS..EExtended strand (participates in β ladder)trans-103.4133.1179.3-69.3103.3000110.4L120 S121 G123 V133 V175 L177 V256L120-L135 CarbonylContact C-O 3.57Å; L120-L135 VanDerWaalsContact CA-O 3.31Å; L120-L135 WeakPolarHBondContact CA-O 3.19Å; S121-L135 PolarHBondContact N-O 2.79Å; S121-L135 PolarHBondContact O-N 3.12Å; S121-L135 WeakPolarHBondContact OG-CB 3.35Å; G123-L135 VanDerWaalsContact CA-CD1 3.46Å; V133-L135 HydrophobicContact CG1-CD1 4.23Å; L135-V175 CarbonylContact C-O 3.6Å; L135-V175 WeakPolarHBondContact CA-O 3.3Å; L135-V175 HydrophobicContact CD2-CB 4.45Å; L135-V175 HydrophobicContact CD2-CG1 4.44Å; L135-V175 HydrophobicContact CG-CB 4.27Å; L135-L177 HydrophobicContact CD2-CD1 3.81Å; L135-L177 HydrophobicContact CD2-CG 4.29Å; L135-V256 HydrophobicContact CD1-CG1 3.71Å; L135-V256 HydrophobicContact CD1-CG2 4.33Å; L135-V256 HydrophobicContact CD2-CG1 3.22Å; L135-V256 HydrophobicContact CG-CG1 4.06Å
136F95Very high87.4Confident31 Ų3143 Ų4314%0.13625%0.249CC..EExtended strand (participates in β ladder)trans-112.6111.8168.9179.4-89000109.3V119 L141 M160 L174 V175 H176 L177V119-F136 HydrophobicContact CG2-CD2 3.92Å; V119-F136 HydrophobicContact CG2-CE2 3.52Å; V119-F136 HydrophobicContact CG2-CZ 3.96Å; V119-F136 CarbonylContact O-C 3.54Å; V119-F136 VanDerWaalsContact O-CA 3.23Å; V119-F136 WeakPolarHBondContact O-CA 3.44Å; F136-L141 HydrophobicContact CE1-CD1 4.2Å; F136-L141 HydrophobicContact CE2-CD2 4.44Å; F136-L141 HydrophobicContact CZ-CD1 3.86Å; F136-L141 HydrophobicContact CZ-CD2 3.98Å; F136-L141 HydrophobicContact CZ-CG 4.09Å; F136-M160 HydrophobicContact CD2-SD 3.83Å; F136-M160 HydrophobicContact CE2-CE 4.29Å; F136-M160 HydrophobicContact CE2-SD 3.44Å; F136-M160 WeakPolarHBondContact CE2-SD 3.47Å; F136-L174 HydrophobicContact CB-CD1 4.24Å; F136-V175 PolarHBondContact N-O 3.24Å; F136-H176 AromaticContact CD1-CD2 3.12Å; F136-H176 WeakPolarHBondContact CD1-CD2 3.4Å; F136-H176 AromaticContact CD1-NE2 3.63Å; F136-H176 AromaticContact CE1-CD2 3.41Å; F136-H176 VanDerWaalsContact CE1-CD2 3.41Å; F136-H176 WeakPolarHBondContact CE1-CD2 3.33Å; F136-H176 AromaticContact CE1-NE2 3.47Å; F136-H176 WeakPolarHBondContact CE1-NE2 3.46Å; F136-H176 CarbonylContact O-C 3.56Å; F136-H176 WeakPolarHBondContact O-CA 3.48Å; F136-L177 PolarHBondContact O-N 2.98Å
137A94.5Very high88.2Confident4 Ų445.6 Ų45.63%0.03327%0.27CS..EExtended strand (participates in β ladder)trans-100.697.9-179.800000110.4V119 C139 Y140 P259V119-A137 PolarHBondContact O-N 3.19Å; A137-C139 PolarHBondContact O-N 3.2Å; A137-Y140 HydrophobicContact CB-CD2 3.6Å; A137-Y140 HydrophobicContact CB-CE2 3.93Å; A137-Y140 PolarHBondContact O-N 2.7Å; A137-Y140 VanDerWaalsContact O-N 3.12Å; A137-P259 HydrophobicContact CB-CG 3.66Å
138S92.4Very high89.2Confident3 Ų349 Ų492%0.02128%0.275CS..G310 helixtrans-66.9-19-173.951.60000114.4Y140 L141 L177 S178 T181S138-Y140 PolarHBondContact O-N 3.11Å; S138-L141 VanDerWaalsContact O-CB 3.3Å; S138-L141 WeakPolarHBondContact O-CB 3.33Å; S138-L141 PolarHBondContact O-N 2.7Å; S138-L177 PolarHBondContact N-O 3.37Å; S138-L177 VanDerWaalsContact N-O 3.11Å; S138-L177 PolarHBondContact OG-O 2.83Å; S138-S178 VanDerWaalsContact OG-CA 3.32Å; S138-S178 WeakPolarHBondContact OG-CA 3.49Å; S138-T181 VanDerWaalsContact C-OG1 3.25Å; S138-T181 WeakPolarHBondContact CB-OG1 3.24Å; S138-T181 PolarHBondContact OG-OG1 3.34Å
139C92.1Very high90.5Very high19 Ų1943.1 Ų43.113%0.12824%0.242CC..G310 helixtrans-65.9-18.7173.661.40000113.8A137 G179 T181 Q185A137-C139 PolarHBondContact O-N 3.2Å; C139-G179 WeakPolarHBondContact CB-O 3.31Å; C139-T181 PolarHBondContact N-OG1 3.16Å; C139-Q185 PolarHBondContact O-NE2 2.9Å
140Y94.3Very high91.7Very high67 Ų6746.4 Ų46.426%0.26325%0.254SS..G310 helixtrans-92.85.5174-58.8-48.8000113.5Y116 K118 A137 S138 P259Y116-Y140 VanDerWaalsContact CD1-O 3.31Å; Y116-Y140 WeakPolarHBondContact CD1-O 3.33Å; K118-Y140 HydrophobicContact CB-CD2 3.64Å; K118-Y140 HydrophobicContact CB-CE2 3.82Å; K118-Y140 HydrophobicContact CB-CG 4.02Å; K118-Y140 WeakPolarHBondContact O-CD2 3.42Å; A137-Y140 HydrophobicContact CB-CD2 3.6Å; A137-Y140 HydrophobicContact CB-CE2 3.93Å; A137-Y140 PolarHBondContact O-N 2.7Å; A137-Y140 VanDerWaalsContact O-N 3.12Å; S138-Y140 PolarHBondContact O-N 3.11Å; Y140-P259 HydrophobicContact CE2-CB 4.13Å; Y140-P259 HydrophobicContact CE2-CG 3.69Å
141L94.4Very high92.9Very high6 Ų645.1 Ų45.13%0.03124%0.243CC..SBendtrans-68.4147.9175.6-78.3169.3000111.8V119 F136 S138 M153 L156 Q185 P187V119-L141 HydrophobicContact CG2-CD2 3.89Å; V119-L141 HydrophobicContact CG2-CG 4.05Å; F136-L141 HydrophobicContact CE1-CD1 4.2Å; F136-L141 HydrophobicContact CE2-CD2 4.44Å; F136-L141 HydrophobicContact CZ-CD1 3.86Å; F136-L141 HydrophobicContact CZ-CD2 3.98Å; F136-L141 HydrophobicContact CZ-CG 4.09Å; S138-L141 VanDerWaalsContact O-CB 3.3Å; S138-L141 WeakPolarHBondContact O-CB 3.33Å; S138-L141 PolarHBondContact O-N 2.7Å; L141-M153 HydrophobicContact CD2-CE 4.38Å; L141-L156 HydrophobicContact CD2-CD2 3.94Å; L141-Q185 HydrophobicContact CB-CB 4.1Å; L141-Q185 PolarHBondContact O-NE2 2.81Å; L141-P187 HydrophobicContact CD1-CG 4.28Å
142P95Very high93.6Very high0 Ų044.7 Ų44.70%024%0.241CC..PPolyproline II helixtrans-57.6138.9171.3-18.928.9000111.6Y116 I146 Y149 V152 M153 L156Y116-P142 HydrophobicContact CD1-CB 4.37Å; Y116-P142 HydrophobicContact CD1-CG 3.88Å; Y116-P142 HydrophobicContact CD2-CG 3.83Å; Y116-P142 HydrophobicContact CE1-CB 3.98Å; Y116-P142 HydrophobicContact CE1-CG 3.98Å; Y116-P142 HydrophobicContact CE2-CB 4.22Å; Y116-P142 HydrophobicContact CE2-CG 3.94Å; Y116-P142 HydrophobicContact CG-CG 3.8Å; P142-I146 HydrophobicContact CB-CD1 3.65Å; P142-Y149 HydrophobicContact CB-CD2 4.19Å; P142-Y149 HydrophobicContact CB-CE2 4.04Å; P142-V152 HydrophobicContact CB-CG1 4.32Å; P142-V152 HydrophobicContact CG-CG1 3.81Å; P142-M153 HydrophobicContact CB-SD 4.14Å; P142-M153 HydrophobicContact CG-SD 3.69Å; P142-L156 HydrophobicContact CG-CD2 3.96Å
143R94Very high93.9Very high143 Ų14344.6 Ų44.654%0.5424%0.24SC..PPolyproline II helixtrans-74.1143.3169.5-68.5179.8177.3-171.3-0.1109.4S145 I146 Y149 A184 Q185R143-S145 PolarHBondContact O-N 3.01Å; R143-I146 WeakPolarHBondContact O-CG1 3.23Å; R143-I146 WeakPolarHBondContact O-CG2 3.47Å; R143-I146 PolarHBondContact O-N 3.45Å; R143-Y149 WeakPolarHBondContact O-CD2 3.44Å; R143-A184 CarbonylContact C-O 3.51Å; R143-A184 WeakPolarHBondContact CA-O 3.31Å; R143-Q185 HydrophobicContact CB-CG 4.47Å; R143-Q185 HydrophobicContact CG-CG 3.6Å
144S93.1Very high94.1Very high70 Ų7048.4 Ų48.449%0.4926%0.258SS..THydrogen-bonded Turntrans-60.7-15.7178.958.90000114.6A184S144-A184 WeakPolarHBondContact CB-O 3.32Å; S144-A184 PolarHBondContact N-O 3.06Å; S144-A184 PolarHBondContact OG-O 3.28Å
145S93.1Very high94.2Very high101 Ų10148.8 Ų48.871%0.70626%0.26SS*.THydrogen-bonded Turntrans-81.5-7.9179.662.20000114.7R143R143-S145 PolarHBondContact O-N 3.01Å
146I94.6Very high94.3Very high36 Ų3648.8 Ų48.819%0.18526%0.26CS..SBendtrans-72.8149.9-178.870.8171.7000111.2Y116 P142 R143 Y149 V152Y116-I146 HydrophobicContact CE2-CD1 4.41Å; P142-I146 HydrophobicContact CB-CD1 3.65Å; R143-I146 WeakPolarHBondContact O-CG1 3.23Å; R143-I146 WeakPolarHBondContact O-CG2 3.47Å; R143-I146 PolarHBondContact O-N 3.45Å; I146-Y149 HydrophobicContact CD1-CD2 4.37Å; I146-Y149 HydrophobicContact CG1-CD2 4.01Å; I146-Y149 PolarHBondContact O-N 3.05Å; I146-V152 HydrophobicContact CD1-CB 4.13Å; I146-V152 HydrophobicContact CD1-CG1 4.1Å; I146-V152 HydrophobicContact CD1-CG2 3.99Å
147P94.4Very high94.3Very high107 Ų10748.6 Ų48.670%0.69526%0.259SS*.THydrogen-bonded Turntrans-60.9146171.827.2-35.4000110.6Y149P147-Y149 PolarHBondContact O-N 3.33Å; P147-Y149 VanDerWaalsContact O-N 3.16Å
148N93.8Very high94.2Very high127 Ų12751.4 Ų51.468%0.67927%0.269SS*.THydrogen-bonded Turntrans54.331.9179.1-57.1-35.3000114T150 Y151 V152N148-T150 VanDerWaalsContact C-N 3.26Å; N148-T150 PolarHBondContact O-N 2.98Å; N148-T150 VanDerWaalsContact O-N 3.14Å; N148-Y151 WeakPolarHBondContact O-CA 3.12Å; N148-Y151 WeakPolarHBondContact O-CB 3.41Å; N148-Y151 PolarHBondContact O-N 3.18Å; N148-V152 PolarHBondContact O-N 3.2Å
149Y94.4Very high94.3Very high31 Ų3152.5 Ų52.512%0.12227%0.272CS..Hα-helixtrans-46.8-46.5-178.7175.4-103.7000113.3P142 R143 I146 P147 Y151 V152 M153P142-Y149 HydrophobicContact CB-CD2 4.19Å; P142-Y149 HydrophobicContact CB-CE2 4.04Å; R143-Y149 WeakPolarHBondContact O-CD2 3.44Å; I146-Y149 HydrophobicContact CD1-CD2 4.37Å; I146-Y149 HydrophobicContact CG1-CD2 4.01Å; I146-Y149 PolarHBondContact O-N 3.05Å; P147-Y149 PolarHBondContact O-N 3.33Å; P147-Y149 VanDerWaalsContact O-N 3.16Å; Y149-Y151 VanDerWaalsContact C-N 3.32Å; Y149-Y151 PolarHBondContact O-N 2.83Å; Y149-V152 PolarHBondContact O-N 3.36Å; Y149-M153 HydrophobicContact CD1-CG 4.08Å; Y149-M153 HydrophobicContact CD2-CG 3.84Å; Y149-M153 HydrophobicContact CE1-CG 3.69Å; Y149-M153 HydrophobicContact CE2-CG 3.44Å; Y149-M153 VanDerWaalsContact CE2-CG 3.44Å; Y149-M153 HydrophobicContact CE2-SD 3.72Å; Y149-M153 HydrophobicContact CG-CG 4.16Å; Y149-M153 WeakPolarHBondContact O-CB 3.28Å; Y149-M153 VanDerWaalsContact O-CG 3.27Å; Y149-M153 WeakPolarHBondContact O-CG 3.26Å; Y149-M153 PolarHBondContact O-N 2.85Å
150T93.8Very high94.3Very high107 Ų10752.3 Ų52.366%0.65627%0.27SS*.Hα-helixtrans-57.9-43.4178.4-53.30000112.3N148 E154N148-T150 VanDerWaalsContact C-N 3.26Å; N148-T150 PolarHBondContact O-N 2.98Å; N148-T150 VanDerWaalsContact O-N 3.14Å; T150-E154 WeakPolarHBondContact O-CB 3.33Å; T150-E154 PolarHBondContact O-N 3.12Å
151Y95.3Very high94.1Very high70 Ų7049.6 Ų49.628%0.27526%0.26SS..Hα-helixtrans-65.8-45.7178.6-178.9-100000111.5R94 D109 V112 N148 Y149 E154 H155R94-Y151 PolarHBondContact NH1-OH 2.86Å; R94-Y151 VanDerWaalsContact NH1-OH 3.14Å; D109-Y151 PolarHBondContact OD2-OH 3.22Å; V112-Y151 HydrophobicContact CB-CE1 4.49Å; V112-Y151 HydrophobicContact CG1-CD1 4.4Å; V112-Y151 HydrophobicContact CG1-CE1 3.94Å; V112-Y151 HydrophobicContact CG2-CD1 4.22Å; V112-Y151 HydrophobicContact CG2-CE1 3.93Å; N148-Y151 WeakPolarHBondContact O-CA 3.12Å; N148-Y151 WeakPolarHBondContact O-CB 3.41Å; N148-Y151 PolarHBondContact O-N 3.18Å; Y149-Y151 VanDerWaalsContact C-N 3.32Å; Y149-Y151 PolarHBondContact O-N 2.83Å; Y151-E154 PolarHBondContact O-N 2.78Å; Y151-H155 AromaticContact CD1-CD2 3.88Å; Y151-H155 AromaticContact CD2-CD2 3.81Å; Y151-H155 AromaticContact CD2-NE2 3.89Å; Y151-H155 AromaticContact CE1-CD2 3.54Å; Y151-H155 AromaticContact CE1-NE2 3.88Å; Y151-H155 AromaticContact CE2-CD2 3.46Å; Y151-H155 VanDerWaalsContact CE2-CD2 3.46Å; Y151-H155 WeakPolarHBondContact CE2-CD2 3.48Å; Y151-H155 AromaticContact CE2-NE2 3.14Å; Y151-H155 WeakPolarHBondContact CE2-NE2 3.33Å; Y151-H155 AromaticContact CZ-CD2 3.31Å; Y151-H155 AromaticContact CZ-NE2 3.12Å; Y151-H155 PolarHBondContact O-CD2 2.82Å; Y151-H155 VanDerWaalsContact O-CD2 3.32Å; Y151-H155 PolarHBondContact O-N 3.2Å; Y151-H155 PolarHBondContact OH-NE2 2.87Å
152V96.1Very high93.9Very high11 Ų1149.4 Ų49.47%0.06726%0.259CS..Hα-helixtrans-60.9-47.8177.1177.80000110.6V112 Y116 P142 I146 N148 Y149 E154 H155 L156V112-V152 HydrophobicContact CB-CG2 4.36Å; Y116-V152 HydrophobicContact CD2-CG1 3.84Å; Y116-V152 HydrophobicContact CE2-CG1 3.67Å; P142-V152 HydrophobicContact CB-CG1 4.32Å; P142-V152 HydrophobicContact CG-CG1 3.81Å; I146-V152 HydrophobicContact CD1-CB 4.13Å; I146-V152 HydrophobicContact CD1-CG1 4.1Å; I146-V152 HydrophobicContact CD1-CG2 3.99Å; N148-V152 PolarHBondContact O-N 3.2Å; Y149-V152 PolarHBondContact O-N 3.36Å; V152-E154 VanDerWaalsContact C-N 3.34Å; V152-E154 PolarHBondContact O-N 3.21Å; V152-H155 PolarHBondContact O-N 3.03Å; V152-L156 VanDerWaalsContact O-CB 3.27Å; V152-L156 WeakPolarHBondContact O-CB 3.49Å; V152-L156 PolarHBondContact O-N 2.99Å
153M95.1Very high93.6Very high0 Ų050.6 Ų50.60%027%0.267CS..Hα-helixtrans-64.8-36.7179.5-72.3-60.8-62.300112.4L141 P142 Y149 L156 F157 P187 W191L141-M153 HydrophobicContact CD2-CE 4.38Å; P142-M153 HydrophobicContact CB-SD 4.14Å; P142-M153 HydrophobicContact CG-SD 3.69Å; Y149-M153 HydrophobicContact CD1-CG 4.08Å; Y149-M153 HydrophobicContact CD2-CG 3.84Å; Y149-M153 HydrophobicContact CE1-CG 3.69Å; Y149-M153 HydrophobicContact CE2-CG 3.44Å; Y149-M153 VanDerWaalsContact CE2-CG 3.44Å; Y149-M153 HydrophobicContact CE2-SD 3.72Å; Y149-M153 HydrophobicContact CG-CG 4.16Å; Y149-M153 WeakPolarHBondContact O-CB 3.28Å; Y149-M153 VanDerWaalsContact O-CG 3.27Å; Y149-M153 WeakPolarHBondContact O-CG 3.26Å; Y149-M153 PolarHBondContact O-N 2.85Å; M153-L156 HydrophobicContact SD-CD2 4.47Å; M153-F157 WeakPolarHBondContact O-CB 3.37Å; M153-F157 PolarHBondContact O-N 3.24Å; M153-P187 HydrophobicContact CE-CB 3.97Å; M153-P187 HydrophobicContact CE-CG 3.62Å; M153-W191 HydrophobicContact CB-CZ2 4.41Å; M153-W191 HydrophobicContact CE-CD2 4.13Å; M153-W191 HydrophobicContact CE-CE3 4.35Å; M153-W191 HydrophobicContact CE-CH2 3.8Å; M153-W191 HydrophobicContact CE-CZ2 3.49Å; M153-W191 VanDerWaalsContact CE-CZ2 3.49Å; M153-W191 HydrophobicContact CE-CZ3 4.21Å; M153-W191 WeakPolarHBondContact O-CZ2 3.33Å
154E94.3Very high93.3Very high84 Ų8444.5 Ų44.539%0.39325%0.245SC..Hα-helixtrans-63.1-51.6173.9-174.8177.8-17900110.9T150 Y151 V152 L156 F157 R158T150-E154 WeakPolarHBondContact O-CB 3.33Å; T150-E154 PolarHBondContact O-N 3.12Å; Y151-E154 PolarHBondContact O-N 2.78Å; V152-E154 VanDerWaalsContact C-N 3.34Å; V152-E154 PolarHBondContact O-N 3.21Å; E154-L156 VanDerWaalsContact C-N 3.29Å; E154-L156 PolarHBondContact O-N 3.31Å; E154-F157 WeakPolarHBondContact O-CB 3.28Å; E154-F157 PolarHBondContact O-N 2.8Å; E154-R158 VanDerWaalsContact O-CG 3.29Å; E154-R158 WeakPolarHBondContact O-CG 3.49Å; E154-R158 PolarHBondContact O-N 3.12Å; E154-R158 IonicContact OE1-CZ 3.44Å; E154-R158 IonicContact OE1-NE 3.59Å; E154-R158 IonicContact OE1-NH2 2.64Å; E154-R158 PolarHBondContact OE1-NH2 3.25Å
155H95.4Very high92.9Very high7 Ų742.4 Ų42.43%0.03223%0.227CC..Hα-helixtrans-63.4-35177.6-80.2-69.8000112.9W96 V108 D109 V112 I113 Y151 V152 R158 Y159W96-H155 AromaticContact CZ3-CE1 3.86Å; V108-H155 HydrophobicContact CG1-CB 4.49Å; D109-H155 PolarHBondContact N-ND1 2.83Å; V112-H155 HydrophobicContact CG2-CB 4.25Å; I113-H155 HydrophobicContact CG2-CB 3.73Å; Y151-H155 AromaticContact CD1-CD2 3.88Å; Y151-H155 AromaticContact CD2-CD2 3.81Å; Y151-H155 AromaticContact CD2-NE2 3.89Å; Y151-H155 AromaticContact CE1-CD2 3.54Å; Y151-H155 AromaticContact CE1-NE2 3.88Å; Y151-H155 AromaticContact CE2-CD2 3.46Å; Y151-H155 VanDerWaalsContact CE2-CD2 3.46Å; Y151-H155 WeakPolarHBondContact CE2-CD2 3.48Å; Y151-H155 AromaticContact CE2-NE2 3.14Å; Y151-H155 WeakPolarHBondContact CE2-NE2 3.33Å; Y151-H155 AromaticContact CZ-CD2 3.31Å; Y151-H155 AromaticContact CZ-NE2 3.12Å; Y151-H155 PolarHBondContact O-CD2 2.82Å; Y151-H155 VanDerWaalsContact O-CD2 3.32Å; Y151-H155 PolarHBondContact O-N 3.2Å; Y151-H155 PolarHBondContact OH-NE2 2.87Å; V152-H155 PolarHBondContact O-N 3.03Å; H155-R158 PolarHBondContact O-N 2.89Å; H155-Y159 WeakPolarHBondContact O-CB 3.26Å; H155-Y159 PolarHBondContact O-N 3.23Å
156L95.7Very high92.4Very high0 Ų039.7 Ų39.70%021%0.205CC..Hα-helixtrans-66.2-41.7174.7-170.862.4000111.4I113 V119 L141 P142 V152 M153 E154 Y159 M160I113-L156 HydrophobicContact CB-CD1 4.37Å; I113-L156 HydrophobicContact CG2-CB 4.24Å; V119-L156 HydrophobicContact CG1-CD1 3.84Å; V119-L156 HydrophobicContact CG1-CD2 4.42Å; V119-L156 HydrophobicContact CG1-CG 4.35Å; L141-L156 HydrophobicContact CD2-CD2 3.94Å; P142-L156 HydrophobicContact CG-CD2 3.96Å; V152-L156 VanDerWaalsContact O-CB 3.27Å; V152-L156 WeakPolarHBondContact O-CB 3.49Å; V152-L156 PolarHBondContact O-N 2.99Å; M153-L156 HydrophobicContact SD-CD2 4.47Å; E154-L156 VanDerWaalsContact C-N 3.29Å; E154-L156 PolarHBondContact O-N 3.31Å; L156-Y159 HydrophobicContact CD1-CD1 4.43Å; L156-Y159 WeakPolarHBondContact O-CB 3.39Å; L156-Y159 PolarHBondContact O-N 3.29Å; L156-M160 HydrophobicContact CG-CE 4.29Å; L156-M160 VanDerWaalsContact O-CG 3.3Å; L156-M160 WeakPolarHBondContact O-CG 3.36Å; L156-M160 PolarHBondContact O-N 3.04Å
157F93.9Very high91.7Very high28 Ų2840.3 Ų40.312%0.12321%0.208CC..Hα-helixtrans-59.7-48.1173.9-179.5-116.2000111.6M153 E154 Y159 M160 V161 W191 C195 T198M153-F157 WeakPolarHBondContact O-CB 3.37Å; M153-F157 PolarHBondContact O-N 3.24Å; E154-F157 WeakPolarHBondContact O-CB 3.28Å; E154-F157 PolarHBondContact O-N 2.8Å; F157-Y159 VanDerWaalsContact C-N 3.31Å; F157-Y159 PolarHBondContact O-N 3.33Å; F157-M160 HydrophobicContact CD2-CE 4.41Å; F157-M160 PolarHBondContact O-N 3.26Å; F157-M160 VanDerWaalsContact O-N 3.16Å; F157-V161 HydrophobicContact CD1-CG2 4.33Å; F157-V161 HydrophobicContact CD2-CG2 4.05Å; F157-V161 HydrophobicContact CE1-CG2 3.85Å; F157-V161 HydrophobicContact CE2-CG2 3.54Å; F157-V161 HydrophobicContact CG-CG2 4.41Å; F157-V161 HydrophobicContact CZ-CG2 3.42Å; F157-V161 VanDerWaalsContact CZ-CG2 3.42Å; F157-V161 WeakPolarHBondContact O-CG2 3.19Å; F157-V161 PolarHBondContact O-N 3.3Å; F157-W191 HydrophobicContact CB-CH2 4.31Å; F157-W191 HydrophobicContact CB-CZ2 3.66Å; F157-W191 HydrophobicContact CD2-CH2 4.23Å; F157-W191 HydrophobicContact CD2-CZ2 4.32Å; F157-W191 HydrophobicContact CG-CZ2 4.27Å; F157-C195 HydrophobicContact CD2-CB 3.9Å; F157-C195 WeakPolarHBondContact CD2-SG 3.37Å; F157-C195 HydrophobicContact CE2-CB 3.41Å; F157-C195 VanDerWaalsContact CE2-CB 3.41Å; F157-C195 WeakPolarHBondContact CE2-SG 3.49Å; F157-C195 HydrophobicContact CZ-CB 3.83Å; F157-C195 WeakPolarHBondContact CZ-O 3.23Å; F157-T198 HydrophobicContact CE1-CG2 3.78Å
158R92.9Very high90.5Very high63 Ų6335.4 Ų35.424%0.23818%0.176CC..Hα-helixtrans-58.4-43.4177.2-64.3-175-175.4179.62.6111.7Q106 R107 V108 E154 H155 V161 G162Q106-R158 VanDerWaalsContact CD-CB 3.45Å; Q106-R158 VanDerWaalsContact CD-CG 3.5Å; Q106-R158 HydrophobicContact CG-CB 3.95Å; Q106-R158 HydrophobicContact CG-CG 4.02Å; Q106-R158 VanDerWaalsContact NE2-CG 3.27Å; Q106-R158 PolarHBondContact OE1-O 2.7Å; R107-R158 PolarHBondContact O-NH1 3.41Å; R107-R158 VanDerWaalsContact O-NH1 3.11Å; V108-R158 HydrophobicContact CG2-CB 3.64Å; E154-R158 VanDerWaalsContact O-CG 3.29Å; E154-R158 WeakPolarHBondContact O-CG 3.49Å; E154-R158 PolarHBondContact O-N 3.12Å; E154-R158 IonicContact OE1-CZ 3.44Å; E154-R158 IonicContact OE1-NE 3.59Å; E154-R158 IonicContact OE1-NH2 2.64Å; E154-R158 PolarHBondContact OE1-NH2 3.25Å; H155-R158 PolarHBondContact O-N 2.89Å; R158-V161 PolarHBondContact O-N 2.97Å; R158-G162 PolarHBondContact O-N 3.48Å
159Y93.8Very high89.1Confident25 Ų2531.8 Ų31.810%0.09816%0.164CC..Hα-helixtrans-60-45.8174.7175.2-106.1000112.4F99 M110 I113 K117 H155 L156 F157 T163F99-Y159 HydrophobicContact CE2-CD2 4.28Å; F99-Y159 AromaticContact CZ-CD2 3.93Å; F99-Y159 HydrophobicContact CZ-CD2 3.93Å; F99-Y159 HydrophobicContact CZ-CE2 4.33Å; M110-Y159 HydrophobicContact CE-CD2 4.24Å; M110-Y159 HydrophobicContact CE-CE2 4.06Å; M110-Y159 HydrophobicContact SD-CD2 4.24Å; I113-Y159 VanDerWaalsContact CD1-CB 3.44Å; I113-Y159 HydrophobicContact CD1-CD1 4.15Å; I113-Y159 HydrophobicContact CD1-CD2 3.75Å; I113-Y159 HydrophobicContact CD1-CG 3.5Å; I113-Y159 VanDerWaalsContact CD1-CG 3.5Å; K117-Y159 HydrophobicContact CB-CE1 4.44Å; K117-Y159 HydrophobicContact CG-CE1 4.24Å; H155-Y159 WeakPolarHBondContact O-CB 3.26Å; H155-Y159 PolarHBondContact O-N 3.23Å; L156-Y159 HydrophobicContact CD1-CD1 4.43Å; L156-Y159 WeakPolarHBondContact O-CB 3.39Å; L156-Y159 PolarHBondContact O-N 3.29Å; F157-Y159 VanDerWaalsContact C-N 3.31Å; F157-Y159 PolarHBondContact O-N 3.33Å; Y159-T163 VanDerWaalsContact O-CB 3.31Å; Y159-T163 WeakPolarHBondContact O-CB 3.32Å; Y159-T163 PolarHBondContact O-N 3.48Å; Y159-T163 PolarHBondContact O-OG1 3.12Å
160M92.5Very high88Confident15 Ų1534.1 Ų34.17%0.07418%0.176CC..Hα-helixtrans-64.3-46.9179.2-71.1-174.9-64.100111.6V119 L120 F136 L156 F157 T163 L164 W191V119-M160 HydrophobicContact CG1-CG 4.23Å; V119-M160 HydrophobicContact CG1-SD 3.98Å; L120-M160 HydrophobicContact CD2-CG 4.47Å; F136-M160 HydrophobicContact CD2-SD 3.83Å; F136-M160 HydrophobicContact CE2-CE 4.29Å; F136-M160 HydrophobicContact CE2-SD 3.44Å; F136-M160 WeakPolarHBondContact CE2-SD 3.47Å; L156-M160 HydrophobicContact CG-CE 4.29Å; L156-M160 VanDerWaalsContact O-CG 3.3Å; L156-M160 WeakPolarHBondContact O-CG 3.36Å; L156-M160 PolarHBondContact O-N 3.04Å; F157-M160 HydrophobicContact CD2-CE 4.41Å; F157-M160 PolarHBondContact O-N 3.26Å; F157-M160 VanDerWaalsContact O-N 3.16Å; M160-T163 PolarHBondContact O-N 2.93Å; M160-L164 WeakPolarHBondContact O-CB 3.37Å; M160-L164 WeakPolarHBondContact O-CG 3.16Å; M160-L164 PolarHBondContact O-N 2.99Å; M160-W191 HydrophobicContact CE-CH2 4.03Å
161V90.3Very high87.6Confident11 Ų1132.4 Ų32.47%0.06716%0.163CC..Hα-helixtrans-60.6-51176.7174.80000110.5I101 F157 R158 T163 L164 E165 L199 L203I101-V161 HydrophobicContact CD1-CG1 4.49Å; F157-V161 HydrophobicContact CD1-CG2 4.33Å; F157-V161 HydrophobicContact CD2-CG2 4.05Å; F157-V161 HydrophobicContact CE1-CG2 3.85Å; F157-V161 HydrophobicContact CE2-CG2 3.54Å; F157-V161 HydrophobicContact CG-CG2 4.41Å; F157-V161 HydrophobicContact CZ-CG2 3.42Å; F157-V161 VanDerWaalsContact CZ-CG2 3.42Å; F157-V161 WeakPolarHBondContact O-CG2 3.19Å; F157-V161 PolarHBondContact O-N 3.3Å; R158-V161 PolarHBondContact O-N 2.97Å; V161-T163 VanDerWaalsContact C-N 3.27Å; V161-T163 PolarHBondContact O-N 3.21Å; V161-L164 PolarHBondContact O-N 2.83Å; V161-E165 HydrophobicContact CG1-CG 4.45Å; V161-E165 WeakPolarHBondContact O-CG 3.33Å; V161-E165 PolarHBondContact O-N 2.72Å; V161-L199 HydrophobicContact CG2-CD1 3.86Å; V161-L203 HydrophobicContact CG1-CD1 4.09Å
162G89.6Confident87.3Confident1 Ų129.2 Ų29.21%0.0115%0.15CC..Hα-helixtrans-58.3-38.8178.600000113R158 E165 L166R158-G162 PolarHBondContact O-N 3.48Å; G162-E165 PolarHBondContact O-N 3.36Å; G162-L166 WeakPolarHBondContact O-CG 3.44Å; G162-L166 PolarHBondContact O-N 3.02Å
163T89.3Confident87.1Confident25 Ų2529.5 Ų29.515%0.15315%0.151CC..Hα-helixtrans-70.4-44.1176.2-54.70000111.7L120 Y159 M160 V161 E165 L166 L167L120-T163 HydrophobicContact CD2-CG2 3.66Å; Y159-T163 VanDerWaalsContact O-CB 3.31Å; Y159-T163 WeakPolarHBondContact O-CB 3.32Å; Y159-T163 PolarHBondContact O-N 3.48Å; Y159-T163 PolarHBondContact O-OG1 3.12Å; M160-T163 PolarHBondContact O-N 2.93Å; V161-T163 VanDerWaalsContact C-N 3.27Å; V161-T163 PolarHBondContact O-N 3.21Å; T163-E165 VanDerWaalsContact C-N 3.26Å; T163-E165 PolarHBondContact O-N 2.88Å; T163-L166 PolarHBondContact O-N 3Å; T163-L167 HydrophobicContact CG2-CD1 3.8Å; T163-L167 HydrophobicContact CG2-CG 4.3Å; T163-L167 VanDerWaalsContact O-CG 3.28Å; T163-L167 WeakPolarHBondContact O-CG 3.44Å; T163-L167 PolarHBondContact O-N 3.43Å
164L87.9Confident87.1Confident15 Ų1531 Ų318%0.07916%0.159CC..Hα-helixtrans-57.5-41.8174.5-73174.1000110.8I134 M160 V161 L166 L167 V168 Y172 L203I134-L164 HydrophobicContact CB-CD2 4.39Å; I134-L164 HydrophobicContact CD1-CD2 3.4Å; I134-L164 HydrophobicContact CG1-CD2 4.45Å; I134-L164 HydrophobicContact CG2-CD2 3.83Å; M160-L164 WeakPolarHBondContact O-CB 3.37Å; M160-L164 WeakPolarHBondContact O-CG 3.16Å; M160-L164 PolarHBondContact O-N 2.99Å; V161-L164 PolarHBondContact O-N 2.83Å; L164-L166 VanDerWaalsContact C-N 3.32Å; L164-L166 PolarHBondContact O-N 3.26Å; L164-L167 PolarHBondContact O-N 2.88Å; L164-V168 WeakPolarHBondContact O-CB 3.31Å; L164-V168 WeakPolarHBondContact O-CG2 3.43Å; L164-V168 PolarHBondContact O-N 3.3Å; L164-Y172 HydrophobicContact CD2-CE2 4.13Å; L164-L203 HydrophobicContact CB-CD1 4.13Å; L164-L203 HydrophobicContact CB-CD2 4.07Å
165E85.3Confident87.1Confident26 Ų2627.1 Ų27.112%0.12114%0.141CC..Hα-helixtrans-67.2-30.8179.5-71.7-161.6-164.400114.8I101 V161 G162 T163 R202 L203I101-E165 WeakPolarHBondContact CB-OE2 2.93Å; I101-E165 WeakPolarHBondContact CG1-OE2 3.16Å; I101-E165 VanDerWaalsContact CG2-CD 3.42Å; I101-E165 WeakPolarHBondContact CG2-OE1 3.37Å; I101-E165 WeakPolarHBondContact CG2-OE2 3.1Å; V161-E165 HydrophobicContact CG1-CG 4.45Å; V161-E165 WeakPolarHBondContact O-CG 3.33Å; V161-E165 PolarHBondContact O-N 2.72Å; G162-E165 PolarHBondContact O-N 3.36Å; T163-E165 VanDerWaalsContact C-N 3.26Å; T163-E165 PolarHBondContact O-N 2.88Å; E165-R202 IonicContact OE2-NH2 3.53Å; E165-L203 HydrophobicContact CG-CD1 3.69Å; E165-L203 HydrophobicContact CG-CD2 4.02Å; E165-L203 HydrophobicContact CG-CG 4.04Å
166L82.8Confident87Confident44 Ų4428.8 Ų28.823%0.2315%0.149CC..Hα-helixtrans-74.4-33.6173.6-66.4170.5000111.6L80 C84 M85 F99 G162 T163 L164L80-L166 HydrophobicContact CD2-CB 4.42Å; L80-L166 HydrophobicContact CD2-CD2 4.2Å; L80-L166 VanDerWaalsContact CD2-O 3.26Å; L80-L166 WeakPolarHBondContact CD2-O 3.42Å; C84-L166 HydrophobicContact CB-CD2 3.81Å; M85-L166 HydrophobicContact CB-CD1 4.12Å; M85-L166 HydrophobicContact CG-CD1 4.49Å; M85-L166 HydrophobicContact SD-CD1 3.83Å; F99-L166 HydrophobicContact CD1-CD1 3.88Å; F99-L166 HydrophobicContact CE1-CD1 3.78Å; G162-L166 WeakPolarHBondContact O-CG 3.44Å; G162-L166 PolarHBondContact O-N 3.02Å; T163-L166 PolarHBondContact O-N 3Å; L164-L166 VanDerWaalsContact C-N 3.32Å; L164-L166 PolarHBondContact O-N 3.26Å
167L78.6Confident87Confident50 Ų5028.8 Ų28.826%0.26215%0.149SC..Hα-helixtrans-84.7-30.3-177.6-65.2176000112.9I134 T163 L164 A169I134-L167 HydrophobicContact CD1-CB 3.97Å; I134-L167 HydrophobicContact CD1-CD1 4.1Å; I134-L167 HydrophobicContact CG1-CD1 4.42Å; T163-L167 HydrophobicContact CG2-CD1 3.8Å; T163-L167 HydrophobicContact CG2-CG 4.3Å; T163-L167 VanDerWaalsContact O-CG 3.28Å; T163-L167 WeakPolarHBondContact O-CG 3.44Å; T163-L167 PolarHBondContact O-N 3.43Å; L164-L167 PolarHBondContact O-N 2.88Å; L167-A169 PolarHBondContact O-N 3.33Å
168V68.9Low86.8Confident3 Ų327.8 Ų27.82%0.01815%0.146CC..  trans-92.682.4-173.5-179.10000109.7I134 L164 Y172 L203 N206I134-V168 HydrophobicContact CD1-CG2 3.92Å; L164-V168 WeakPolarHBondContact O-CB 3.31Å; L164-V168 WeakPolarHBondContact O-CG2 3.43Å; L164-V168 PolarHBondContact O-N 3.3Å; V168-Y172 HydrophobicContact CB-CD1 4.03Å; V168-Y172 HydrophobicContact CB-CE1 4.37Å; V168-Y172 HydrophobicContact CG1-CD1 3.42Å; V168-Y172 VanDerWaalsContact CG1-CD1 3.42Å; V168-Y172 HydrophobicContact CG1-CE1 3.76Å; V168-Y172 HydrophobicContact CG1-CG 4.34Å; V168-Y172 HydrophobicContact CG2-CD1 3.28Å; V168-Y172 HydrophobicContact CG2-CD2 4.03Å; V168-Y172 HydrophobicContact CG2-CE1 3.65Å; V168-Y172 HydrophobicContact CG2-CE2 4.33Å; V168-Y172 HydrophobicContact CG2-CG 3.49Å; V168-Y172 VanDerWaalsContact CG2-CG 3.49Å; V168-L203 HydrophobicContact CB-CD2 3.93Å; V168-L203 HydrophobicContact CG1-CD2 4.2Å; V168-L203 HydrophobicContact CG2-CD2 4.1Å; V168-N206 HydrophobicContact CG1-CB 3.64Å
169A64.3Low86.5Confident52 Ų5224.8 Ų24.843%0.4313%0.134SC..SBendtrans-73.1-44.2167.600000111.2A76 L167A76-A169 HydrophobicContact CB-CB 4.44Å; L167-A169 PolarHBondContact O-N 3.33Å
170E71.9Confident85.8Confident80 Ų8025.8 Ų25.837%0.37415%0.152SC..SBendtrans-131-83.1-175-65.9-174178.100113.2N206E170-N206 WeakPolarHBondContact O-CB 3.46Å; E170-N206 PolarHBondContact O-ND2 2.91Å
171N85.6Confident85.5Confident70 Ų7026 Ų2637%0.37415%0.154SC..EExtended strand (participates in β ladder)trans-125.9146.5-177.7-67.7-73000110.5N131 A132 N206N131-N171 WeakPolarHBondContact CA-O 3.29Å; N131-N171 VanDerWaalsContact OD1-CB 3.28Å; N131-N171 WeakPolarHBondContact OD1-CB 3.22Å; A132-N171 PolarHBondContact N-O 2.82Å; A132-N171 VanDerWaalsContact N-O 3.1Å; N171-N206 WeakPolarHBondContact CA-O 3.27Å
172Y89.9Confident85.2Confident4 Ų428 Ų282%0.01617%0.168CC..EExtended strand (participates in β ladder)trans-144.2153.1178.373.5-73.4000113.5A132 I134 L164 V168 L174 L203 N206 L207 R208A132-Y172 CarbonylContact O-C 3.47Å; A132-Y172 WeakPolarHBondContact O-CA 3.19Å; A132-Y172 WeakPolarHBondContact O-CB 3.35Å; I134-Y172 HydrophobicContact CD1-CD2 3.76Å; I134-Y172 HydrophobicContact CD1-CE2 4.44Å; I134-Y172 HydrophobicContact CD1-CG 4.22Å; I134-Y172 HydrophobicContact CG1-CD2 4.27Å; L164-Y172 HydrophobicContact CD2-CE2 4.13Å; V168-Y172 HydrophobicContact CB-CD1 4.03Å; V168-Y172 HydrophobicContact CB-CE1 4.37Å; V168-Y172 HydrophobicContact CG1-CD1 3.42Å; V168-Y172 VanDerWaalsContact CG1-CD1 3.42Å; V168-Y172 HydrophobicContact CG1-CE1 3.76Å; V168-Y172 HydrophobicContact CG1-CG 4.34Å; V168-Y172 HydrophobicContact CG2-CD1 3.28Å; V168-Y172 HydrophobicContact CG2-CD2 4.03Å; V168-Y172 HydrophobicContact CG2-CE1 3.65Å; V168-Y172 HydrophobicContact CG2-CE2 4.33Å; V168-Y172 HydrophobicContact CG2-CG 3.49Å; V168-Y172 VanDerWaalsContact CG2-CG 3.49Å; Y172-L174 HydrophobicContact CD2-CB 4.36Å; Y172-L174 HydrophobicContact CE2-CB 4.09Å; Y172-L203 VanDerWaalsContact CE1-O 3.28Å; Y172-L203 WeakPolarHBondContact CE1-O 3.02Å; Y172-L203 PolarHBondContact OH-O 3.49Å; Y172-N206 HydrophobicContact CD1-CB 4.24Å; Y172-N206 WeakPolarHBondContact CD1-O 3.36Å; Y172-N206 HydrophobicContact CE1-CB 4.16Å; Y172-N206 PolarHBondContact N-O 3.37Å; Y172-L207 HydrophobicContact CD2-CD1 3.97Å; Y172-L207 HydrophobicContact CE1-CB 3.88Å; Y172-L207 HydrophobicContact CE1-CD1 4.33Å; Y172-L207 HydrophobicContact CE2-CB 4.48Å; Y172-L207 HydrophobicContact CE2-CD1 3.49Å; Y172-L207 VanDerWaalsContact CE2-CD1 3.49Å; Y172-R208 PolarHBondContact O-N 3.32Å
173L91.4Very high85Confident17 Ų1735.3 Ų35.39%0.08920%0.196CC..EExtended strand (participates in β ladder)trans-104.2125171-67.8167.4000108H126 A132 V133 I134 R208 A209 I251H126-L173 HydrophobicContact CB-CD1 4.2Å; A132-L173 PolarHBondContact O-N 2.93Å; V133-L173 HydrophobicContact CG2-CD1 4.49Å; I134-L173 PolarHBondContact N-O 3.1Å; L173-R208 HydrophobicContact CD2-CB 4.01Å; L173-R208 HydrophobicContact CD2-CG 4.17Å; L173-A209 HydrophobicContact CD2-CB 3.69Å; L173-I251 HydrophobicContact CD1-CG2 4.09Å
174L93.8Very high84.9Confident32 Ų3235.9 Ų35.917%0.16820%0.203CC..EExtended strand (participates in β ladder)trans-101.9114.1174.7-174.858.9000109I134 F136 Y172 L207 A209 L210 V211I134-L174 HydrophobicContact CB-CD1 4.13Å; I134-L174 HydrophobicContact CG2-CD1 4.04Å; I134-L174 CarbonylContact O-C 3.58Å; I134-L174 WeakPolarHBondContact O-CA 3.32Å; F136-L174 HydrophobicContact CB-CD1 4.24Å; Y172-L174 HydrophobicContact CD2-CB 4.36Å; Y172-L174 HydrophobicContact CE2-CB 4.09Å; L174-L207 HydrophobicContact CB-CD1 3.6Å; L174-A209 PolarHBondContact N-O 2.83Å; L174-L210 HydrophobicContact CB-CD1 4.05Å; L174-L210 HydrophobicContact CD2-CD1 3.93Å; L174-L210 HydrophobicContact CG-CD1 3.85Å; L174-L210 CarbonylContact O-C 3.55Å; L174-L210 WeakPolarHBondContact O-CA 3.41Å; L174-L210 WeakPolarHBondContact O-CD1 3.47Å; L174-V211 PolarHBondContact O-N 2.88Å
175V94.7Very high85Confident1 Ų135.9 Ų35.91%0.00620%0.203CC..EExtended strand (participates in β ladder)trans-99.8108.2178-177.20000108.8V133 I134 L135 F136 L177 V211 V213 L247 I251V133-V175 HydrophobicContact CG1-CG2 4.16Å; I134-V175 PolarHBondContact O-N 2.88Å; L135-V175 CarbonylContact C-O 3.6Å; L135-V175 WeakPolarHBondContact CA-O 3.3Å; L135-V175 HydrophobicContact CD2-CB 4.45Å; L135-V175 HydrophobicContact CD2-CG1 4.44Å; L135-V175 HydrophobicContact CG-CB 4.27Å; F136-V175 PolarHBondContact N-O 3.24Å; V175-L177 HydrophobicContact CG1-CD2 3.86Å; V175-L177 HydrophobicContact CG1-CG 4.36Å; V175-V211 CarbonylContact C-O 3.57Å; V175-V211 WeakPolarHBondContact CA-O 3.33Å; V175-V211 HydrophobicContact CG2-CB 4.46Å; V175-V213 HydrophobicContact CG1-CG2 4.03Å; V175-L247 HydrophobicContact CG1-CD1 3.81Å; V175-L247 HydrophobicContact CG1-CD2 3.97Å; V175-L247 HydrophobicContact CG2-CD1 4.11Å; V175-I251 HydrophobicContact CG2-CD1 4.06Å
176H94.6Very high85.1Confident42 Ų4235.9 Ų35.919%0.19420%0.204CC..EExtended strand (participates in β ladder)trans-89.3104.6174.1178.7-80.3000110.2F136 S178 L210 V211 V212 V213F136-H176 AromaticContact CD1-CD2 3.12Å; F136-H176 WeakPolarHBondContact CD1-CD2 3.4Å; F136-H176 AromaticContact CD1-NE2 3.63Å; F136-H176 AromaticContact CE1-CD2 3.41Å; F136-H176 VanDerWaalsContact CE1-CD2 3.41Å; F136-H176 WeakPolarHBondContact CE1-CD2 3.33Å; F136-H176 AromaticContact CE1-NE2 3.47Å; F136-H176 WeakPolarHBondContact CE1-NE2 3.46Å; F136-H176 CarbonylContact O-C 3.56Å; F136-H176 WeakPolarHBondContact O-CA 3.48Å; H176-S178 PolarHBondContact CE1-OG 2.75Å; H176-S178 VanDerWaalsContact CE1-OG 3.28Å; H176-S178 PolarHBondContact ND1-OG 2.73Å; H176-S178 PolarHBondContact O-N 3.23Å; H176-L210 HydrophobicContact CB-CD1 4.11Å; H176-V211 PolarHBondContact N-O 3.09Å; H176-V212 HydrophobicContact CB-CG1 4.36Å; H176-V212 HydrophobicContact CB-CG2 4.31Å; H176-V212 CarbonylContact O-C 3.49Å; H176-V212 WeakPolarHBondContact O-CA 3.44Å; H176-V213 PolarHBondContact O-N 3.2Å
177L94.3Very high85.3Confident0 Ų034.3 Ų34.30%020%0.197CC..EExtended strand (participates in β ladder)trans-83.6110.7173.1-57.2177.7000109.1L135 F136 S138 V175 V213 L244 L247 I258 P259 V262L135-L177 HydrophobicContact CD2-CD1 3.81Å; L135-L177 HydrophobicContact CD2-CG 4.29Å; F136-L177 PolarHBondContact O-N 2.98Å; S138-L177 PolarHBondContact N-O 3.37Å; S138-L177 VanDerWaalsContact N-O 3.11Å; S138-L177 PolarHBondContact OG-O 2.83Å; V175-L177 HydrophobicContact CG1-CD2 3.86Å; V175-L177 HydrophobicContact CG1-CG 4.36Å; L177-V213 HydrophobicContact CD2-CB 4.06Å; L177-V213 HydrophobicContact CD2-CG2 4.09Å; L177-L244 HydrophobicContact CD2-CD2 4.45Å; L177-L247 HydrophobicContact CD2-CD2 4.35Å; L177-I258 HydrophobicContact CD1-CG2 4.25Å; L177-P259 HydrophobicContact CD1-CG 4.45Å; L177-V262 HydrophobicContact CB-CG1 4.4Å; L177-V262 HydrophobicContact CB-CG2 4.01Å; L177-V262 HydrophobicContact CD2-CG1 4.41Å
178S90.5Very high85.8Confident8 Ų834.9 Ų34.96%0.05620%0.203CC..  trans-87.9-15.3-177.1-43.30000113.4S138 H176 T181 V212 V213 H214S138-S178 VanDerWaalsContact OG-CA 3.32Å; S138-S178 WeakPolarHBondContact OG-CA 3.49Å; H176-S178 PolarHBondContact CE1-OG 2.75Å; H176-S178 VanDerWaalsContact CE1-OG 3.28Å; H176-S178 PolarHBondContact ND1-OG 2.73Å; H176-S178 PolarHBondContact O-N 3.23Å; S178-T181 VanDerWaalsContact O-CB 3.27Å; S178-T181 WeakPolarHBondContact O-CB 3.39Å; S178-T181 PolarHBondContact O-N 2.89Å; S178-T181 PolarHBondContact O-OG1 2.89Å; S178-V212 WeakPolarHBondContact OG-CG1 3.41Å; S178-V213 WeakPolarHBondContact CB-O 3.4Å; S178-V213 PolarHBondContact N-O 3.33Å; S178-V213 PolarHBondContact OG-O 2.93Å; S178-H214 WeakPolarHBondContact CB-O 3.47Å
179G86.1Confident86.6Confident0 Ų037.1 Ų37.10%022%0.215CC..THydrogen-bonded Turntrans-61.6135.7-170.800000114.1C139 T181 V262 L265C139-G179 WeakPolarHBondContact CB-O 3.31Å; G179-T181 VanDerWaalsContact C-N 3.26Å; G179-T181 PolarHBondContact O-N 3.48Å; G179-V262 WeakPolarHBondContact O-CG2 3.21Å; G179-L265 VanDerWaalsContact CA-CD2 3.46Å
180G79.8Confident87.7Confident46 Ų4638.7 Ų38.747%0.47422%0.223SC..THydrogen-bonded Turntrans73.99-179.500000115.4S182G180-S182 PolarHBondContact O-N 3.26Å
181T84.9Confident88.5Confident20 Ų2037.1 Ų37.112%0.12321%0.213CC..  trans-82.2118-178.5-57.10000111.5S138 C139 S178 G179 Q185 V186 Y218S138-T181 VanDerWaalsContact C-OG1 3.25Å; S138-T181 WeakPolarHBondContact CB-OG1 3.24Å; S138-T181 PolarHBondContact OG-OG1 3.34Å; C139-T181 PolarHBondContact N-OG1 3.16Å; S178-T181 VanDerWaalsContact O-CB 3.27Å; S178-T181 WeakPolarHBondContact O-CB 3.39Å; S178-T181 PolarHBondContact O-N 2.89Å; S178-T181 PolarHBondContact O-OG1 2.89Å; G179-T181 VanDerWaalsContact C-N 3.26Å; G179-T181 PolarHBondContact O-N 3.48Å; T181-Q185 HydrophobicContact CG2-CB 4.11Å; T181-V186 HydrophobicContact CG2-CG2 4.21Å; T181-Y218 PolarHBondContact O-OH 2.84Å
182S85.8Confident88.6Confident51 Ų5135.8 Ų35.836%0.35721%0.206SC..  trans-73.2149.9173.4179.70000111.2G180 A184 Q185G180-S182 PolarHBondContact O-N 3.26Å; S182-A184 PolarHBondContact O-N 3.16Å; S182-A184 VanDerWaalsContact O-N 3.12Å; S182-A184 PolarHBondContact OG-N 3.49Å; S182-Q185 WeakPolarHBondContact O-CB 3.08Å; S182-Q185 PolarHBondContact O-N 2.88Å
183R85.2Confident88.4Confident156 Ų15639.8 Ų39.859%0.58922%0.221SC*.G310 helixtrans-54.1-32.6172.5-175.161176.6125.1-6.5112.6Q185 V186R183-Q185 PolarHBondContact O-N 3.4Å; R183-V186 PolarHBondContact O-N 3.22Å
184A87.5Confident88.2Confident37 Ų3744.2 Ų44.231%0.30624%0.241SC..G310 helixtrans-67.4-17.2176.900000113.6R143 S144 S182R143-A184 CarbonylContact C-O 3.51Å; R143-A184 WeakPolarHBondContact CA-O 3.31Å; S144-A184 WeakPolarHBondContact CB-O 3.32Å; S144-A184 PolarHBondContact N-O 3.06Å; S144-A184 PolarHBondContact OG-O 3.28Å; S182-A184 PolarHBondContact O-N 3.16Å; S182-A184 VanDerWaalsContact O-N 3.12Å; S182-A184 PolarHBondContact OG-N 3.49Å
185Q89.4Confident87.9Confident15 Ų1543.3 Ų43.37%0.0724%0.238CC..G310 helixtrans-94.6-14.1177.8-63.9174.7-80.200112.6C139 L141 R143 T181 S182 R183 P187C139-Q185 PolarHBondContact O-NE2 2.9Å; L141-Q185 HydrophobicContact CB-CB 4.1Å; L141-Q185 PolarHBondContact O-NE2 2.81Å; R143-Q185 HydrophobicContact CB-CG 4.47Å; R143-Q185 HydrophobicContact CG-CG 3.6Å; T181-Q185 HydrophobicContact CG2-CB 4.11Å; S182-Q185 WeakPolarHBondContact O-CB 3.08Å; S182-Q185 PolarHBondContact O-N 2.88Å; R183-Q185 PolarHBondContact O-N 3.4Å; Q185-P187 VanDerWaalsContact O-CD 3.29Å; Q185-P187 WeakPolarHBondContact O-CD 3.17Å
186V87.5Confident87.5Confident25 Ų2544.9 Ų44.915%0.15224%0.243CC..SBendtrans-72.2118.6180-1790000108.9T181 R183 Y218T181-V186 HydrophobicContact CG2-CG2 4.21Å; R183-V186 PolarHBondContact O-N 3.22Å; V186-Y218 HydrophobicContact CG2-CE2 4.05Å
187P87.4Confident87.1Confident11 Ų1150.8 Ų50.87%0.07126%0.264CS..PPolyproline II helixtrans-62.5152.8-179.1-22.334.5000112L141 M153 Q185 W191 I192L141-P187 HydrophobicContact CD1-CG 4.28Å; M153-P187 HydrophobicContact CE-CB 3.97Å; M153-P187 HydrophobicContact CE-CG 3.62Å; Q185-P187 VanDerWaalsContact O-CD 3.29Å; Q185-P187 WeakPolarHBondContact O-CD 3.17Å; P187-W191 HydrophobicContact CB-CB 4.48Å; P187-W191 HydrophobicContact CB-CD2 4.04Å; P187-W191 HydrophobicContact CB-CE3 3.53Å; P187-W191 HydrophobicContact CB-CG 4.46Å; P187-W191 HydrophobicContact CB-CZ3 4.07Å; P187-W191 HydrophobicContact CG-CE3 4.01Å; P187-W191 HydrophobicContact CG-CZ3 4.01Å; P187-I192 HydrophobicContact CB-CD1 4.29Å; P187-I192 HydrophobicContact CB-CG1 4.16Å
188P88.3Confident86.7Confident62 Ų6254.1 Ų54.140%0.40329%0.285SS..PPolyproline II helixtrans-66153.9177.227-32.8000111.8S190 W191 I192P188-S190 PolarHBondContact O-N 3.17Å; P188-W191 HydrophobicContact CG-CB 3.85Å; P188-W191 WeakPolarHBondContact O-CB 3.4Å; P188-W191 PolarHBondContact O-N 3.29Å; P188-I192 PolarHBondContact O-N 3.25Å; P188-I192 VanDerWaalsContact O-N 3.16Å
189L85.8Confident86.5Confident51 Ų5155 Ų5527%0.26729%0.288SS..Hα-helixtrans-54.1-39.9-179.4-175.867.3000113W191 I192 R193 F222 L225 L226L189-W191 VanDerWaalsContact C-N 3.31Å; L189-W191 PolarHBondContact O-N 3.24Å; L189-I192 PolarHBondContact O-N 2.82Å; L189-R193 WeakPolarHBondContact O-CB 3.39Å; L189-R193 PolarHBondContact O-N 3.12Å; L189-F222 HydrophobicContact CB-CE2 3.94Å; L189-F222 HydrophobicContact CB-CZ 4.21Å; L189-F222 HydrophobicContact CD1-CD2 4.4Å; L189-F222 HydrophobicContact CD1-CE1 4.43Å; L189-F222 HydrophobicContact CD1-CE2 3.47Å; L189-F222 VanDerWaalsContact CD1-CE2 3.47Å; L189-F222 HydrophobicContact CD1-CZ 3.46Å; L189-F222 VanDerWaalsContact CD1-CZ 3.46Å; L189-F222 HydrophobicContact CG-CE2 4.28Å; L189-F222 HydrophobicContact CG-CZ 4.45Å; L189-L225 HydrophobicContact CD2-CD2 4.34Å; L189-L226 HydrophobicContact CD1-CD1 4.25Å; L189-L226 HydrophobicContact CD1-CD2 3.3Å; L189-L226 HydrophobicContact CD1-CG 3.6Å; L189-L226 HydrophobicContact CG-CD2 4.46Å
190S86.9Confident86.4Confident84 Ų8458.4 Ų58.459%0.58731%0.307SS*.Hα-helixtrans-60.8-40.3177.751.60000112.2P188 Q194P188-S190 PolarHBondContact O-N 3.17Å; S190-Q194 WeakPolarHBondContact O-CB 3.47Å; S190-Q194 PolarHBondContact O-N 2.82Å
191W88.8Confident86.6Confident47 Ų4759.1 Ų59.118%0.17830%0.295CS..Hα-helixtrans-68.2-43.1177.7-173.795.1000111M153 F157 M160 P187 P188 L189 R193 Q194 C195M153-W191 HydrophobicContact CB-CZ2 4.41Å; M153-W191 HydrophobicContact CE-CD2 4.13Å; M153-W191 HydrophobicContact CE-CE3 4.35Å; M153-W191 HydrophobicContact CE-CH2 3.8Å; M153-W191 HydrophobicContact CE-CZ2 3.49Å; M153-W191 VanDerWaalsContact CE-CZ2 3.49Å; M153-W191 HydrophobicContact CE-CZ3 4.21Å; M153-W191 WeakPolarHBondContact O-CZ2 3.33Å; F157-W191 HydrophobicContact CB-CH2 4.31Å; F157-W191 HydrophobicContact CB-CZ2 3.66Å; F157-W191 HydrophobicContact CD2-CH2 4.23Å; F157-W191 HydrophobicContact CD2-CZ2 4.32Å; F157-W191 HydrophobicContact CG-CZ2 4.27Å; M160-W191 HydrophobicContact CE-CH2 4.03Å; P187-W191 HydrophobicContact CB-CB 4.48Å; P187-W191 HydrophobicContact CB-CD2 4.04Å; P187-W191 HydrophobicContact CB-CE3 3.53Å; P187-W191 HydrophobicContact CB-CG 4.46Å; P187-W191 HydrophobicContact CB-CZ3 4.07Å; P187-W191 HydrophobicContact CG-CE3 4.01Å; P187-W191 HydrophobicContact CG-CZ3 4.01Å; P188-W191 HydrophobicContact CG-CB 3.85Å; P188-W191 WeakPolarHBondContact O-CB 3.4Å; P188-W191 PolarHBondContact O-N 3.29Å; L189-W191 VanDerWaalsContact C-N 3.31Å; L189-W191 PolarHBondContact O-N 3.24Å; W191-R193 PolarHBondContact O-N 3.16Å; W191-Q194 WeakPolarHBondContact O-CB 3.27Å; W191-Q194 PolarHBondContact O-N 2.96Å; W191-C195 VanDerWaalsContact CE2-SG 3.52Å; W191-C195 HydrophobicContact CE3-CB 4.49Å; W191-C195 WeakPolarHBondContact CH2-SG 3.47Å; W191-C195 VanDerWaalsContact CZ2-SG 3.55Å; W191-C195 HydrophobicContact CZ3-CB 4.37Å; W191-C195 WeakPolarHBondContact CZ3-SG 3.45Å; W191-C195 WeakPolarHBondContact O-CB 3.06Å; W191-C195 PolarHBondContact O-N 3.43Å; W191-C195 PolarHBondContact O-SG 2.83Å
192I88Confident86.5Confident43 Ų4363.3 Ų63.322%0.22131%0.309CS..Hα-helixtrans-65-41.8178.8-65.9175.2000111.2P187 P188 L189 Q194 C195 Y196 F222 L226P187-I192 HydrophobicContact CB-CD1 4.29Å; P187-I192 HydrophobicContact CB-CG1 4.16Å; P188-I192 PolarHBondContact O-N 3.25Å; P188-I192 VanDerWaalsContact O-N 3.16Å; L189-I192 PolarHBondContact O-N 2.82Å; I192-Q194 VanDerWaalsContact C-N 3.34Å; I192-Q194 PolarHBondContact O-N 2.92Å; I192-C195 WeakPolarHBondContact O-CB 3.49Å; I192-C195 PolarHBondContact O-N 3.33Å; I192-Y196 PolarHBondContact O-N 3.25Å; I192-F222 HydrophobicContact CD1-CE1 3.39Å; I192-F222 HydrophobicContact CD1-CZ 3.53Å; I192-L226 HydrophobicContact CG2-CD1 3.65Å; I192-L226 HydrophobicContact CG2-CD2 4.49Å
193R85.4Confident86.6Confident87 Ų8760.9 Ų60.933%0.32829%0.292SS..Hα-helixtrans-60.3-44.9172.3-171.7-174.5-65.5154.5-0.9111.3L189 W191 C195 Y196 R197L189-R193 WeakPolarHBondContact O-CB 3.39Å; L189-R193 PolarHBondContact O-N 3.12Å; W191-R193 PolarHBondContact O-N 3.16Å; R193-C195 VanDerWaalsContact C-N 3.3Å; R193-C195 PolarHBondContact O-N 3.33Å; R193-Y196 PolarHBondContact O-N 3.5Å; R193-R197 WeakPolarHBondContact O-CG 3.31Å; R193-R197 PolarHBondContact O-N 3.17Å; R193-R197 VanDerWaalsContact O-N 3.09Å
194Q87.1Confident86.8Confident110 Ų11055.4 Ų55.451%0.51427%0.271SS..Hα-helixtrans-62.7-39.4177.8-175.96117.900111.6S190 W191 I192 R197 T198S190-Q194 WeakPolarHBondContact O-CB 3.47Å; S190-Q194 PolarHBondContact O-N 2.82Å; W191-Q194 WeakPolarHBondContact O-CB 3.27Å; W191-Q194 PolarHBondContact O-N 2.96Å; I192-Q194 VanDerWaalsContact C-N 3.34Å; I192-Q194 PolarHBondContact O-N 2.92Å; Q194-R197 PolarHBondContact O-N 3.19Å; Q194-T198 PolarHBondContact NE2-OG1 3.1Å; Q194-T198 VanDerWaalsContact O-CB 3.31Å; Q194-T198 WeakPolarHBondContact O-CB 3.37Å; Q194-T198 PolarHBondContact O-N 2.95Å; Q194-T198 PolarHBondContact O-OG1 3.42Å
195C87.9Confident86.7Confident14 Ų1458.9 Ų58.910%0.09528%0.279CS..Hα-helixtrans-60.7-50.6176.1-70.70000111F157 W191 I192 R193 R197 T198 L199F157-C195 HydrophobicContact CD2-CB 3.9Å; F157-C195 WeakPolarHBondContact CD2-SG 3.37Å; F157-C195 HydrophobicContact CE2-CB 3.41Å; F157-C195 VanDerWaalsContact CE2-CB 3.41Å; F157-C195 WeakPolarHBondContact CE2-SG 3.49Å; F157-C195 HydrophobicContact CZ-CB 3.83Å; F157-C195 WeakPolarHBondContact CZ-O 3.23Å; W191-C195 VanDerWaalsContact CE2-SG 3.52Å; W191-C195 HydrophobicContact CE3-CB 4.49Å; W191-C195 WeakPolarHBondContact CH2-SG 3.47Å; W191-C195 VanDerWaalsContact CZ2-SG 3.55Å; W191-C195 HydrophobicContact CZ3-CB 4.37Å; W191-C195 WeakPolarHBondContact CZ3-SG 3.45Å; W191-C195 WeakPolarHBondContact O-CB 3.06Å; W191-C195 PolarHBondContact O-N 3.43Å; W191-C195 PolarHBondContact O-SG 2.83Å; I192-C195 WeakPolarHBondContact O-CB 3.49Å; I192-C195 PolarHBondContact O-N 3.33Å; R193-C195 VanDerWaalsContact C-N 3.3Å; R193-C195 PolarHBondContact O-N 3.33Å; C195-R197 VanDerWaalsContact C-N 3.3Å; C195-R197 PolarHBondContact O-N 3.21Å; C195-T198 PolarHBondContact O-N 3.34Å; C195-L199 VanDerWaalsContact O-CB 3.3Å; C195-L199 WeakPolarHBondContact O-CB 3.38Å; C195-L199 PolarHBondContact O-N 3Å
196Y86.6Confident86.6Confident33 Ų3359.8 Ų59.813%0.12928%0.284CS..Hα-helixtrans-59.3-39.1178.6-178.5-101000112.8I192 R193 R204 I230 S231 F234I192-Y196 PolarHBondContact O-N 3.25Å; R193-Y196 PolarHBondContact O-N 3.5Å; Y196-R204 PolarHBondContact OH-NH1 3.29Å; Y196-I230 HydrophobicContact CD2-CG1 4.46Å; Y196-I230 HydrophobicContact CE2-CG2 4.1Å; Y196-S231 PolarHBondContact OH-N 2.8Å; Y196-S231 PolarHBondContact OH-OG 3.04Å; Y196-F234 HydrophobicContact CE2-CD2 4.19Å; Y196-F234 HydrophobicContact CE2-CG 4.18Å
197R86Confident86.8Confident167 Ų16758.7 Ų58.763%0.6328%0.278SS*.Hα-helixtrans-72-33.9177.8-67.4-177.986.1172.28.7113.4R193 Q194 C195R193-R197 WeakPolarHBondContact O-CG 3.31Å; R193-R197 PolarHBondContact O-N 3.17Å; R193-R197 VanDerWaalsContact O-N 3.09Å; Q194-R197 PolarHBondContact O-N 3.19Å; C195-R197 VanDerWaalsContact C-N 3.3Å; C195-R197 PolarHBondContact O-N 3.21Å
198T86Confident86.9Confident70 Ų7065 Ų6543%0.42930%0.3SS..Hα-helixtrans-83.2-24.1-178.5-50.40000111.6F157 Q194 C195 D200F157-T198 HydrophobicContact CE1-CG2 3.78Å; Q194-T198 PolarHBondContact NE2-OG1 3.1Å; Q194-T198 VanDerWaalsContact O-CB 3.31Å; Q194-T198 WeakPolarHBondContact O-CB 3.37Å; Q194-T198 PolarHBondContact O-N 2.95Å; Q194-T198 PolarHBondContact O-OG1 3.42Å; C195-T198 PolarHBondContact O-N 3.34Å; T198-D200 PolarHBondContact O-N 3.19Å
199L86.1Confident87.1Confident25 Ų2562.3 Ų62.313%0.13128%0.283CS..SBendtrans-64.8126.4178.9-168.369.1000111V161 C195 L203 R204V161-L199 HydrophobicContact CG2-CD1 3.86Å; C195-L199 VanDerWaalsContact O-CB 3.3Å; C195-L199 WeakPolarHBondContact O-CB 3.38Å; C195-L199 PolarHBondContact O-N 3Å; L199-L203 HydrophobicContact CD1-CB 4.1Å; L199-L203 HydrophobicContact CD1-CD1 3.45Å; L199-L203 VanDerWaalsContact CD1-CD1 3.45Å; L199-L203 HydrophobicContact CD1-CG 4.45Å; L199-L203 HydrophobicContact CD2-CB 4.48Å; L199-L203 HydrophobicContact CG-CB 4.08Å; L199-L203 HydrophobicContact CG-CD1 4.26Å; L199-R204 HydrophobicContact CB-CG 4.44Å; L199-R204 HydrophobicContact CD2-CG 3.65Å; L199-R204 HydrophobicContact CG-CG 4.08Å; L199-R204 PolarHBondContact O-NE 3.38Å; L199-R204 VanDerWaalsContact O-NE 3.11Å
200D84.7Confident87.5Confident73 Ų7361.1 Ų61.139%0.3928%0.277SS..  trans-56.1142.9-178.4-161.5-57.5000111.4T198 R202 L203 R204T198-D200 PolarHBondContact O-N 3.19Å; D200-R202 PolarHBondContact O-N 3.32Å; D200-R202 PolarHBondContact OD1-N 3.03Å; D200-L203 PolarHBondContact O-N 2.75Å; D200-L203 VanDerWaalsContact O-N 3.17Å; D200-R204 PolarHBondContact O-N 2.9Å
201R82.8Confident87.8Confident61 Ų6157.5 Ų57.523%0.2325%0.252CS..Hα-helixtrans-53.1-37.2174.6-171.7-178.6-170.3-161.55.4111E62 L65 R204 K205E62-R201 PolarHBondContact O-NH2 2.78Å; L65-R201 PolarHBondContact O-NH1 3.28Å; R201-R204 PolarHBondContact O-N 3.01Å; R201-K205 HydrophobicContact CG-CD 4.19Å; R201-K205 HydrophobicContact CG-CG 4.45Å; R201-K205 VanDerWaalsContact NE-CE 3.33Å; R201-K205 WeakPolarHBondContact O-CB 3.33Å; R201-K205 WeakPolarHBondContact O-CG 3.1Å; R201-K205 PolarHBondContact O-N 3.35Å
202R84.2Confident88.1Confident107 Ų10755.7 Ų55.740%0.40425%0.246SC..Hα-helixtrans-58.7-51.3177.9-172.4179.873.3179.72111.3E165 D200 R204 K205 N206E165-R202 IonicContact OE2-NH2 3.53Å; D200-R202 PolarHBondContact O-N 3.32Å; D200-R202 PolarHBondContact OD1-N 3.03Å; R202-R204 VanDerWaalsContact C-N 3.29Å; R202-R204 PolarHBondContact O-N 3.48Å; R202-K205 PolarHBondContact O-N 3.45Å; R202-N206 VanDerWaalsContact O-CB 3.27Å; R202-N206 WeakPolarHBondContact O-CB 3.27Å; R202-N206 VanDerWaalsContact O-CG 3.22Å; R202-N206 PolarHBondContact O-N 2.83Å; R202-N206 PolarHBondContact O-OD1 3.44Å
203L86.9Confident88.4Confident0 Ų053.7 Ų53.70%024%0.235CC..Hα-helixtrans-62.4-35.8179.5-68179.7000112.5V161 L164 E165 V168 Y172 L199 D200 L207V161-L203 HydrophobicContact CG1-CD1 4.09Å; L164-L203 HydrophobicContact CB-CD1 4.13Å; L164-L203 HydrophobicContact CB-CD2 4.07Å; E165-L203 HydrophobicContact CG-CD1 3.69Å; E165-L203 HydrophobicContact CG-CD2 4.02Å; E165-L203 HydrophobicContact CG-CG 4.04Å; V168-L203 HydrophobicContact CB-CD2 3.93Å; V168-L203 HydrophobicContact CG1-CD2 4.2Å; V168-L203 HydrophobicContact CG2-CD2 4.1Å; Y172-L203 VanDerWaalsContact CE1-O 3.28Å; Y172-L203 WeakPolarHBondContact CE1-O 3.02Å; Y172-L203 PolarHBondContact OH-O 3.49Å; L199-L203 HydrophobicContact CD1-CB 4.1Å; L199-L203 HydrophobicContact CD1-CD1 3.45Å; L199-L203 VanDerWaalsContact CD1-CD1 3.45Å; L199-L203 HydrophobicContact CD1-CG 4.45Å; L199-L203 HydrophobicContact CD2-CB 4.48Å; L199-L203 HydrophobicContact CG-CB 4.08Å; L199-L203 HydrophobicContact CG-CD1 4.26Å; D200-L203 PolarHBondContact O-N 2.75Å; D200-L203 VanDerWaalsContact O-N 3.17Å; L203-L207 PolarHBondContact O-N 2.74Å
204R88.5Confident88.7Confident42 Ų4250 Ų5016%0.15822%0.222CC..Hα-helixtrans-70.5-36.7176.7-68.7-174.4-77.1141.9-1.3112.6E62 Y196 L199 D200 R201 R202 K237E62-R204 IonicContact OE1-CZ 3.36Å; E62-R204 IonicContact OE1-NH1 2.77Å; E62-R204 PolarHBondContact OE1-NH1 2.85Å; Y196-R204 PolarHBondContact OH-NH1 3.29Å; L199-R204 HydrophobicContact CB-CG 4.44Å; L199-R204 HydrophobicContact CD2-CG 3.65Å; L199-R204 HydrophobicContact CG-CG 4.08Å; L199-R204 PolarHBondContact O-NE 3.38Å; L199-R204 VanDerWaalsContact O-NE 3.11Å; D200-R204 PolarHBondContact O-N 2.9Å; R201-R204 PolarHBondContact O-N 3.01Å; R202-R204 VanDerWaalsContact C-N 3.29Å; R202-R204 PolarHBondContact O-N 3.48Å; R204-K237 PolarHBondContact O-NZ 3.16Å
205K86.8Confident88.7Confident109 Ų10945.2 Ų45.247%0.47420%0.201SC..Hα-helixtrans-72.3-46.8178-76.4-176.1175.3-175.80111.9R201 R202 L207 K237R201-K205 HydrophobicContact CG-CD 4.19Å; R201-K205 HydrophobicContact CG-CG 4.45Å; R201-K205 VanDerWaalsContact NE-CE 3.33Å; R201-K205 WeakPolarHBondContact O-CB 3.33Å; R201-K205 WeakPolarHBondContact O-CG 3.1Å; R201-K205 PolarHBondContact O-N 3.35Å; R202-K205 PolarHBondContact O-N 3.45Å; K205-L207 PolarHBondContact O-N 3.49Å; K205-K237 PolarHBondContact O-NZ 3.04Å
206N87.8Confident88.6Confident34 Ų3446.7 Ų46.718%0.18221%0.21CC..Hα-helixtrans-71.5-14-176.5-70.413.7000113.8V168 E170 N171 Y172 R202 R208V168-N206 HydrophobicContact CG1-CB 3.64Å; E170-N206 WeakPolarHBondContact O-CB 3.46Å; E170-N206 PolarHBondContact O-ND2 2.91Å; N171-N206 WeakPolarHBondContact CA-O 3.27Å; Y172-N206 HydrophobicContact CD1-CB 4.24Å; Y172-N206 WeakPolarHBondContact CD1-O 3.36Å; Y172-N206 HydrophobicContact CE1-CB 4.16Å; Y172-N206 PolarHBondContact N-O 3.37Å; R202-N206 VanDerWaalsContact O-CB 3.27Å; R202-N206 WeakPolarHBondContact O-CB 3.27Å; R202-N206 VanDerWaalsContact O-CG 3.22Å; R202-N206 PolarHBondContact O-N 2.83Å; R202-N206 PolarHBondContact O-OD1 3.44Å; N206-R208 PolarHBondContact O-N 2.85Å
207L90.8Very high88.5Confident3 Ų354.8 Ų54.82%0.01624%0.24CC..EExtended strand (participates in β ladder)trans-65.7117.3171.3-179.168.9000109.6Y172 L174 L203 K205 A209 L210 F234 K237Y172-L207 HydrophobicContact CD2-CD1 3.97Å; Y172-L207 HydrophobicContact CE1-CB 3.88Å; Y172-L207 HydrophobicContact CE1-CD1 4.33Å; Y172-L207 HydrophobicContact CE2-CB 4.48Å; Y172-L207 HydrophobicContact CE2-CD1 3.49Å; Y172-L207 VanDerWaalsContact CE2-CD1 3.49Å; L174-L207 HydrophobicContact CB-CD1 3.6Å; L203-L207 PolarHBondContact O-N 2.74Å; K205-L207 PolarHBondContact O-N 3.49Å; L207-A209 WeakPolarHBondContact CD1-O 3.3Å; L207-L210 HydrophobicContact CD2-CB 4.25Å; L207-F234 HydrophobicContact CD2-CD2 4.16Å; L207-F234 HydrophobicContact CD2-CE2 3.37Å; L207-F234 HydrophobicContact CD2-CZ 3.75Å; L207-K237 HydrophobicContact CB-CD 4.46Å; L207-K237 HydrophobicContact CD2-CD 4.36Å; L207-K237 HydrophobicContact CG-CD 4.4Å; L207-K237 VanDerWaalsContact O-CD 3.23Å; L207-K237 WeakPolarHBondContact O-CD 3.37Å; L207-K237 WeakPolarHBondContact O-CE 3.47Å; L207-K237 PolarHBondContact O-NZ 3.24Å
208R90.2Very high88.3Confident142 Ų14249.5 Ų49.554%0.53622%0.22SC..EExtended strand (participates in β ladder)trans-80.2-47.7176.3-177.5176.4174.4-171.9-3.4111.5N131 Y172 L173 N206N131-R208 PolarHBondContact ND2-NH1 3.16Å; Y172-R208 PolarHBondContact O-N 3.32Å; L173-R208 HydrophobicContact CD2-CB 4.01Å; L173-R208 HydrophobicContact CD2-CG 4.17Å; N206-R208 PolarHBondContact O-N 2.85Å
209A91.6Very high88.2Confident6 Ų647.5 Ų47.55%0.0521%0.208CC..EExtended strand (participates in β ladder)trans-150.9145.817600000111L173 L174 L207 V211 K237L173-A209 HydrophobicContact CD2-CB 3.69Å; L174-A209 PolarHBondContact N-O 2.83Å; L207-A209 WeakPolarHBondContact CD1-O 3.3Å; A209-V211 HydrophobicContact CB-CG2 4.28Å; A209-K237 CarbonylContact C-O 3.51Å; A209-K237 WeakPolarHBondContact CA-O 3.47Å
210L93.5Very high88.3Confident27 Ų2750.1 Ų50.114%0.14122%0.219CC..EExtended strand (participates in β ladder)trans-103.8104.1165.517256.5000107.9L174 H176 L207 V212 F234 K237 I238 R239L174-L210 HydrophobicContact CB-CD1 4.05Å; L174-L210 HydrophobicContact CD2-CD1 3.93Å; L174-L210 HydrophobicContact CG-CD1 3.85Å; L174-L210 CarbonylContact O-C 3.55Å; L174-L210 WeakPolarHBondContact O-CA 3.41Å; L174-L210 WeakPolarHBondContact O-CD1 3.47Å; H176-L210 HydrophobicContact CB-CD1 4.11Å; L207-L210 HydrophobicContact CD2-CB 4.25Å; L210-V212 HydrophobicContact CG-CG2 4.13Å; L210-F234 HydrophobicContact CD2-CE1 4.33Å; L210-F234 HydrophobicContact CD2-CZ 4.39Å; L210-K237 PolarHBondContact N-O 2.73Å; L210-I238 HydrophobicContact CB-CG1 4.32Å; L210-I238 HydrophobicContact CD2-CD1 4.37Å; L210-I238 HydrophobicContact CD2-CG1 4.18Å; L210-I238 HydrophobicContact CG-CG2 4.47Å; L210-I238 CarbonylContact O-C 3.51Å; L210-I238 WeakPolarHBondContact O-CA 3.3Å; L210-R239 PolarHBondContact O-N 2.8Å
211V94.4Very high88.4Confident8 Ų848.9 Ų48.95%0.04822%0.219CC..EExtended strand (participates in β ladder)trans-96.5113.4-177.9-179.30000108.8L174 V175 H176 A209 V213 R239 L241 L247L174-V211 PolarHBondContact O-N 2.88Å; V175-V211 CarbonylContact C-O 3.57Å; V175-V211 WeakPolarHBondContact CA-O 3.33Å; V175-V211 HydrophobicContact CG2-CB 4.46Å; H176-V211 PolarHBondContact N-O 3.09Å; A209-V211 HydrophobicContact CB-CG2 4.28Å; V211-V213 HydrophobicContact CG1-CG2 4.13Å; V211-R239 CarbonylContact C-O 3.51Å; V211-R239 WeakPolarHBondContact CA-O 3.43Å; V211-L241 HydrophobicContact CG1-CD1 3.32Å; V211-L241 HydrophobicContact CG1-CG 3.68Å; V211-L247 HydrophobicContact CG1-CD1 4.06Å
212V94.4Very high88.5Confident9 Ų948 Ų486%0.05522%0.217CC..EExtended strand (participates in β ladder)trans-103108.9-178.2-169.20000109H176 S178 L210 A215 V219 I238 R239 F240 L241H176-V212 HydrophobicContact CB-CG1 4.36Å; H176-V212 HydrophobicContact CB-CG2 4.31Å; H176-V212 CarbonylContact O-C 3.49Å; H176-V212 WeakPolarHBondContact O-CA 3.44Å; S178-V212 WeakPolarHBondContact OG-CG1 3.41Å; L210-V212 HydrophobicContact CG-CG2 4.13Å; V212-A215 HydrophobicContact CB-CB 4.42Å; V212-A215 HydrophobicContact CG1-CB 3.66Å; V212-V219 HydrophobicContact CG1-CG1 4.5Å; V212-I238 HydrophobicContact CG2-CG2 4.02Å; V212-R239 PolarHBondContact N-O 2.91Å; V212-F240 HydrophobicContact CB-CD1 3.75Å; V212-F240 HydrophobicContact CB-CE1 3.98Å; V212-F240 HydrophobicContact CG1-CD1 4.17Å; V212-F240 HydrophobicContact CG1-CE1 4.18Å; V212-F240 HydrophobicContact CG2-CD1 4.34Å; V212-F240 HydrophobicContact CG2-CE1 4.18Å; V212-F240 WeakPolarHBondContact O-CA 3.48Å; V212-L241 PolarHBondContact O-N 3.14Å
213V94.5Very high88.5Confident0 Ų044.5 Ų44.50%021%0.206CC..EExtended strand (participates in β ladder)trans-95.9137.2-177.2-166.80000110.2V175 H176 L177 S178 V211 A215 L241 L244 L247V175-V213 HydrophobicContact CG1-CG2 4.03Å; H176-V213 PolarHBondContact O-N 3.2Å; L177-V213 HydrophobicContact CD2-CB 4.06Å; L177-V213 HydrophobicContact CD2-CG2 4.09Å; S178-V213 WeakPolarHBondContact CB-O 3.4Å; S178-V213 PolarHBondContact N-O 3.33Å; S178-V213 PolarHBondContact OG-O 2.93Å; V211-V213 HydrophobicContact CG1-CG2 4.13Å; V213-A215 VanDerWaalsContact C-N 3.25Å; V213-A215 PolarHBondContact O-N 3.37Å; V213-L241 WeakPolarHBondContact CA-O 3.44Å; V213-L241 HydrophobicContact CG1-CB 4.45Å; V213-L241 HydrophobicContact CG2-CB 4.37Å; V213-L241 HydrophobicContact CG2-CD1 4.3Å; V213-L244 HydrophobicContact CG1-CD2 4.16Å; V213-L247 HydrophobicContact CG2-CB 4.47Å; V213-L247 HydrophobicContact CG2-CD1 4.17Å; V213-L247 HydrophobicContact CG2-CD2 4.21Å
214H90.8Very high88.5Confident10 Ų1046.4 Ų46.45%0.04622%0.222CC..THydrogen-bonded Turntrans52.940.2-175.4-56.7-59.2000113.4S178 T216 L241 D242 L265 D266S178-H214 WeakPolarHBondContact CB-O 3.47Å; H214-T216 PolarHBondContact O-N 3.41Å; H214-T216 VanDerWaalsContact O-N 3.14Å; H214-L241 PolarHBondContact N-O 2.91Å; H214-D242 PolarHBondContact CE1-O 3.1Å; H214-D242 PolarHBondContact ND1-O 3.18Å; H214-L265 HydrophobicContact CB-CD2 3.82Å; H214-D266 IonicContact CE1-OD1 3.23Å; H214-D266 PolarHBondContact CE1-OD1 3.48Å; H214-D266 WeakPolarHBondContact NE2-CB 3.46Å; H214-D266 IonicContact NE2-OD1 3.42Å; H214-D266 PolarHBondContact NE2-OD1 2.64Å
215A87.1Confident88.4Confident9 Ų949.5 Ų49.57%0.07424%0.24CC..  trans-61.8118.5176.700000110.3V212 V213 V219 K220 F240V212-A215 HydrophobicContact CB-CB 4.42Å; V212-A215 HydrophobicContact CG1-CB 3.66Å; V213-A215 VanDerWaalsContact C-N 3.25Å; V213-A215 PolarHBondContact O-N 3.37Å; A215-V219 HydrophobicContact CB-CG1 4.31Å; A215-K220 HydrophobicContact CB-CG 4.02Å; A215-K220 WeakPolarHBondContact O-CE 3.27Å; A215-F240 HydrophobicContact CB-CD1 3.45Å; A215-F240 VanDerWaalsContact CB-CD1 3.45Å; A215-F240 HydrophobicContact CB-CE1 3.76Å
216T86Confident88.2Confident45 Ų4544.5 Ų44.528%0.27622%0.219SC..  trans-65.9158.7172.4600000110.8H214 Y218 V219 K220H214-T216 PolarHBondContact O-N 3.41Å; H214-T216 VanDerWaalsContact O-N 3.14Å; T216-Y218 VanDerWaalsContact CB-CE1 3.45Å; T216-Y218 HydrophobicContact CG2-CD1 4.42Å; T216-Y218 HydrophobicContact CG2-CE1 3.72Å; T216-Y218 PolarHBondContact O-N 3.09Å; T216-Y218 WeakPolarHBondContact OG1-CD1 3.44Å; T216-Y218 WeakPolarHBondContact OG1-CE1 3.3Å; T216-Y218 WeakPolarHBondContact OG1-CE2 3.39Å; T216-V219 WeakPolarHBondContact O-CB 3.47Å; T216-V219 PolarHBondContact O-N 3.1Å; T216-V219 WeakPolarHBondContact OG1-CG2 3.28Å; T216-V219 PolarHBondContact OG1-N 3.15Å; T216-K220 PolarHBondContact O-N 3.35Å
217W85.2Confident88Confident203 Ų20350.1 Ų50.177%0.76924%0.238SC*.Hα-helixtrans-54.3-38.3178.376.1-95.6000112.1V219 K220 A221W217-V219 PolarHBondContact O-N 3.47Å; W217-K220 PolarHBondContact O-N 2.99Å; W217-A221 HydrophobicContact CE3-CB 4.42Å; W217-A221 WeakPolarHBondContact O-CB 3.47Å; W217-A221 PolarHBondContact O-N 2.76Å
218Y82.4Confident87.6Confident56 Ų5654.3 Ų54.322%0.2227%0.265CS..Hα-helixtrans-71.1-30.3179.669.3-102000112T181 V186 T216 F222T181-Y218 PolarHBondContact O-OH 2.84Å; V186-Y218 HydrophobicContact CG2-CE2 4.05Å; T216-Y218 VanDerWaalsContact CB-CE1 3.45Å; T216-Y218 HydrophobicContact CG2-CD1 4.42Å; T216-Y218 HydrophobicContact CG2-CE1 3.72Å; T216-Y218 PolarHBondContact O-N 3.09Å; T216-Y218 WeakPolarHBondContact OG1-CD1 3.44Å; T216-Y218 WeakPolarHBondContact OG1-CE1 3.3Å; T216-Y218 WeakPolarHBondContact OG1-CE2 3.39Å; Y218-F222 WeakPolarHBondContact O-CB 3.43Å; Y218-F222 PolarHBondContact O-N 3.47Å
219V84.2Confident87.1Confident29 Ų2951.1 Ų51.118%0.17626%0.255CS..Hα-helixtrans-68.6-43.5172.6170.50000110V212 A215 T216 W217 F222 L223V212-V219 HydrophobicContact CG1-CG1 4.5Å; A215-V219 HydrophobicContact CB-CG1 4.31Å; T216-V219 WeakPolarHBondContact O-CB 3.47Å; T216-V219 PolarHBondContact O-N 3.1Å; T216-V219 WeakPolarHBondContact OG1-CG2 3.28Å; T216-V219 PolarHBondContact OG1-N 3.15Å; W217-V219 PolarHBondContact O-N 3.47Å; V219-F222 PolarHBondContact O-N 2.88Å; V219-L223 WeakPolarHBondContact O-CB 3.39Å; V219-L223 PolarHBondContact O-N 3.3Å
220K87.7Confident86.6Confident79 Ų7951.9 Ų51.934%0.34326%0.258SS..Hα-helixtrans-59.8-47.9175.4-64.6-178.4-179178.60110.7A215 T216 W217 L223 A224 F240 D242A215-K220 HydrophobicContact CB-CG 4.02Å; A215-K220 WeakPolarHBondContact O-CE 3.27Å; T216-K220 PolarHBondContact O-N 3.35Å; W217-K220 PolarHBondContact O-N 2.99Å; K220-L223 PolarHBondContact O-N 3.22Å; K220-A224 PolarHBondContact O-N 3.2Å; K220-F240 HydrophobicContact CG-CD1 4.16Å; K220-F240 HydrophobicContact CG-CE1 3.9Å; K220-F240 HydrophobicContact CG-CZ 4.14Å; K220-D242 IonicContact NZ-OD1 3.64Å; K220-D242 PolarHBondContact NZ-OD1 3.2Å
221A87.3Confident86.2Confident48 Ų4852 Ų5240%0.39726%0.261SS..Hα-helixtrans-64-42.4176.400000112.8W217 L223 A224 L225W217-A221 HydrophobicContact CE3-CB 4.42Å; W217-A221 WeakPolarHBondContact O-CB 3.47Å; W217-A221 PolarHBondContact O-N 2.76Å; A221-L223 VanDerWaalsContact C-N 3.34Å; A221-L223 PolarHBondContact O-N 3.4Å; A221-A224 WeakPolarHBondContact O-CB 3.39Å; A221-A224 PolarHBondContact O-N 2.92Å; A221-L225 PolarHBondContact O-N 3.13Å
222F84.4Confident85.8Confident43 Ų4355.4 Ų55.419%0.18929%0.286CS..Hα-helixtrans-62.6-41.2177177.7-96.6000112L189 I192 Y218 V219 A224 L225 L226L189-F222 HydrophobicContact CB-CE2 3.94Å; L189-F222 HydrophobicContact CB-CZ 4.21Å; L189-F222 HydrophobicContact CD1-CD2 4.4Å; L189-F222 HydrophobicContact CD1-CE1 4.43Å; L189-F222 HydrophobicContact CD1-CE2 3.47Å; L189-F222 VanDerWaalsContact CD1-CE2 3.47Å; L189-F222 HydrophobicContact CD1-CZ 3.46Å; L189-F222 VanDerWaalsContact CD1-CZ 3.46Å; L189-F222 HydrophobicContact CG-CE2 4.28Å; L189-F222 HydrophobicContact CG-CZ 4.45Å; I192-F222 HydrophobicContact CD1-CE1 3.39Å; I192-F222 HydrophobicContact CD1-CZ 3.53Å; Y218-F222 WeakPolarHBondContact O-CB 3.43Å; Y218-F222 PolarHBondContact O-N 3.47Å; V219-F222 PolarHBondContact O-N 2.88Å; F222-A224 VanDerWaalsContact C-N 3.34Å; F222-L225 PolarHBondContact O-N 2.81Å; F222-L226 HydrophobicContact CD1-CD1 3.87Å; F222-L226 HydrophobicContact CE1-CD1 3.28Å; F222-L226 HydrophobicContact CE1-CG 4.16Å; F222-L226 HydrophobicContact CZ-CD1 3.83Å; F222-L226 HydrophobicContact CZ-CG 4.36Å; F222-L226 PolarHBondContact O-N 3.22Å; F222-L226 VanDerWaalsContact O-N 3.1Å
223L84.9Confident85.5Confident33 Ų3361.4 Ų61.417%0.17331%0.311CS..Hα-helixtrans-67.8-35.6174.9-168.674.8000111.8V219 K220 A221 L225 L226 R227 I238 F240V219-L223 WeakPolarHBondContact O-CB 3.39Å; V219-L223 PolarHBondContact O-N 3.3Å; K220-L223 PolarHBondContact O-N 3.22Å; A221-L223 VanDerWaalsContact C-N 3.34Å; A221-L223 PolarHBondContact O-N 3.4Å; L223-L225 VanDerWaalsContact C-N 3.31Å; L223-L225 PolarHBondContact O-N 3.28Å; L223-L226 WeakPolarHBondContact O-CB 3.14Å; L223-L226 PolarHBondContact O-N 2.85Å; L223-L226 VanDerWaalsContact O-N 3.09Å; L223-R227 PolarHBondContact O-N 2.88Å; L223-R227 VanDerWaalsContact O-N 3.15Å; L223-I238 HydrophobicContact CD1-CD1 3.89Å; L223-I238 HydrophobicContact CD2-CB 4.36Å; L223-I238 HydrophobicContact CD2-CD1 3.64Å; L223-I238 HydrophobicContact CD2-CG2 3.7Å; L223-I238 HydrophobicContact CG-CD1 4.19Å; L223-F240 HydrophobicContact CD2-CE1 4.37Å; L223-F240 HydrophobicContact CD2-CE2 4.18Å; L223-F240 HydrophobicContact CD2-CZ 3.49Å; L223-F240 VanDerWaalsContact CD2-CZ 3.49Å
224A86.8Confident85.2Confident40 Ų4062.6 Ų62.633%0.33132%0.316SS..Hα-helixtrans-60.2-41.6172.500000111.7K220 A221 F222 L226 R227K220-A224 PolarHBondContact O-N 3.2Å; A221-A224 WeakPolarHBondContact O-CB 3.39Å; A221-A224 PolarHBondContact O-N 2.92Å; F222-A224 VanDerWaalsContact C-N 3.34Å; A224-L226 PolarHBondContact O-N 2.84Å; A224-R227 VanDerWaalsContact O-CB 3.3Å; A224-R227 WeakPolarHBondContact O-CB 3.42Å; A224-R227 WeakPolarHBondContact O-CG 3.42Å; A224-R227 PolarHBondContact O-N 3.36Å
225L85.8Confident85Confident106 Ų10663.8 Ų63.856%0.55532%0.324SS*.Hα-helixtrans-66.3-25.3174.2-174.864.4000113.1L189 A221 F222 L223 P228L189-L225 HydrophobicContact CD2-CD2 4.34Å; A221-L225 PolarHBondContact O-N 3.13Å; F222-L225 PolarHBondContact O-N 2.81Å; L223-L225 VanDerWaalsContact C-N 3.31Å; L223-L225 PolarHBondContact O-N 3.28Å; L225-P228 WeakPolarHBondContact O-CD 3.5Å
226L82.3Confident85.2Confident5 Ų571.2 Ų71.23%0.02635%0.35CS..Hα-helixtrans-81.3-16.8176.3-84.4173.7000114.1L189 I192 F222 L223 A224 P228 F229 I230L189-L226 HydrophobicContact CD1-CD1 4.25Å; L189-L226 HydrophobicContact CD1-CD2 3.3Å; L189-L226 HydrophobicContact CD1-CG 3.6Å; L189-L226 HydrophobicContact CG-CD2 4.46Å; I192-L226 HydrophobicContact CG2-CD1 3.65Å; I192-L226 HydrophobicContact CG2-CD2 4.49Å; F222-L226 HydrophobicContact CD1-CD1 3.87Å; F222-L226 HydrophobicContact CE1-CD1 3.28Å; F222-L226 HydrophobicContact CE1-CG 4.16Å; F222-L226 HydrophobicContact CZ-CD1 3.83Å; F222-L226 HydrophobicContact CZ-CG 4.36Å; F222-L226 PolarHBondContact O-N 3.22Å; F222-L226 VanDerWaalsContact O-N 3.1Å; L223-L226 WeakPolarHBondContact O-CB 3.14Å; L223-L226 PolarHBondContact O-N 2.85Å; L223-L226 VanDerWaalsContact O-N 3.09Å; A224-L226 PolarHBondContact O-N 2.84Å; L226-P228 VanDerWaalsContact C-CD 3.46Å; L226-F229 HydrophobicContact CD2-CD2 4.44Å; L226-F229 PolarHBondContact O-N 3.39Å; L226-I230 HydrophobicContact CB-CD1 3.91Å; L226-I230 PolarHBondContact O-N 3.11Å
227R84.4Confident85.4Confident151 Ų15171.1 Ų71.157%0.5735%0.346SS*.G310 helixtrans-47.5-46.2-179.4-74.4178.6175.2163.5-2.4114.7L223 A224 F229 I230 T235L223-R227 PolarHBondContact O-N 2.88Å; L223-R227 VanDerWaalsContact O-N 3.15Å; A224-R227 VanDerWaalsContact O-CB 3.3Å; A224-R227 WeakPolarHBondContact O-CB 3.42Å; A224-R227 WeakPolarHBondContact O-CG 3.42Å; A224-R227 PolarHBondContact O-N 3.36Å; R227-F229 PolarHBondContact O-N 3.49Å; R227-F229 VanDerWaalsContact O-N 3.13Å; R227-I230 PolarHBondContact O-N 3.4Å; R227-T235 HydrophobicContact CG-CG2 4.21Å
228P82.5Confident85.8Confident92 Ų9262.4 Ų62.460%0.59732%0.315SS*.G310 helixtrans-65.9-15.1179.524.7-35.1000114.2L225 L226L225-P228 WeakPolarHBondContact O-CD 3.5Å; L226-P228 VanDerWaalsContact C-CD 3.46Å
229F78.6Confident86.3Confident75 Ų7566.6 Ų66.633%0.32933%0.33SS..G310 helixtrans-101.7-5-179.2-55.2-74.7000113.3L226 R227L226-F229 HydrophobicContact CD2-CD2 4.44Å; L226-F229 PolarHBondContact O-N 3.39Å; R227-F229 PolarHBondContact O-N 3.49Å; R227-F229 VanDerWaalsContact O-N 3.13Å
230I82.5Confident86.7Confident21 Ų2168.6 Ų68.611%0.10834%0.337CS..SBendtrans-119.4140-175.3-64.5178.4000107.9Y196 L226 R227 S232 F234Y196-I230 HydrophobicContact CD2-CG1 4.46Å; Y196-I230 HydrophobicContact CE2-CG2 4.1Å; L226-I230 HydrophobicContact CB-CD1 3.91Å; L226-I230 PolarHBondContact O-N 3.11Å; R227-I230 PolarHBondContact O-N 3.4Å; I230-S232 PolarHBondContact O-N 3.25Å; I230-F234 HydrophobicContact CG2-CB 3.7Å; I230-F234 HydrophobicContact CG2-CD1 3.34Å; I230-F234 HydrophobicContact CG2-CE1 4.24Å; I230-F234 HydrophobicContact CG2-CG 3.81Å
231S84.8Confident87Confident29 Ų2965.7 Ų65.720%0.20333%0.325CS..  trans-62.2142.4-17969.40000111.1Y196 K233 F234 T235Y196-S231 PolarHBondContact OH-N 2.8Å; Y196-S231 PolarHBondContact OH-OG 3.04Å; S231-K233 PolarHBondContact O-N 3.41Å; S231-K233 VanDerWaalsContact O-N 3.14Å; S231-F234 WeakPolarHBondContact O-CA 3.5Å; S231-F234 PolarHBondContact O-N 3.14Å; S231-F234 WeakPolarHBondContact OG-CB 2.86Å; S231-F234 PolarHBondContact OG-N 2.88Å; S231-T235 PolarHBondContact O-N 2.87Å; S231-T235 PolarHBondContact O-OG1 3.14Å
232S85.8Confident87.1Confident81 Ų8167.5 Ų67.557%0.56633%0.328SS*.Hα-helixtrans-53.8-35.9176.5179.70000111.8I230 F234 T235 R236I230-S232 PolarHBondContact O-N 3.25Å; S232-F234 PolarHBondContact O-N 3.47Å; S232-T235 PolarHBondContact O-N 2.75Å; S232-R236 WeakPolarHBondContact O-CG 3.13Å; S232-R236 PolarHBondContact O-N 2.87Å; S232-R236 VanDerWaalsContact O-N 3.16Å; S232-R236 PolarHBondContact O-NH1 3.23Å; S232-R236 PolarHBondContact OG-NH1 3.04Å
233K87.4Confident87.4Confident134 Ų13466.3 Ų66.358%0.58332%0.324SS*.Hα-helixtrans-60.3-42.6172.8-69.5170.6-175.2161.70112.5S231S231-K233 PolarHBondContact O-N 3.41Å; S231-K233 VanDerWaalsContact O-N 3.14Å
234F87.7Confident87.7Confident25 Ų2565.5 Ų65.511%0.1132%0.32CS..Hα-helixtrans-72.6-41.8178.2-173.6-80.4000111.6Y196 L207 L210 I230 S231 S232 R236 K237 I238Y196-F234 HydrophobicContact CE2-CD2 4.19Å; Y196-F234 HydrophobicContact CE2-CG 4.18Å; L207-F234 HydrophobicContact CD2-CD2 4.16Å; L207-F234 HydrophobicContact CD2-CE2 3.37Å; L207-F234 HydrophobicContact CD2-CZ 3.75Å; L210-F234 HydrophobicContact CD2-CE1 4.33Å; L210-F234 HydrophobicContact CD2-CZ 4.39Å; I230-F234 HydrophobicContact CG2-CB 3.7Å; I230-F234 HydrophobicContact CG2-CD1 3.34Å; I230-F234 HydrophobicContact CG2-CE1 4.24Å; I230-F234 HydrophobicContact CG2-CG 3.81Å; S231-F234 WeakPolarHBondContact O-CA 3.5Å; S231-F234 PolarHBondContact O-N 3.14Å; S231-F234 WeakPolarHBondContact OG-CB 2.86Å; S231-F234 PolarHBondContact OG-N 2.88Å; S232-F234 PolarHBondContact O-N 3.47Å; F234-R236 PolarHBondContact O-N 2.87Å; F234-K237 WeakPolarHBondContact O-CA 3.34Å; F234-K237 VanDerWaalsContact O-CB 3.26Å; F234-K237 WeakPolarHBondContact O-CB 3.32Å; F234-K237 PolarHBondContact O-N 2.95Å; F234-I238 HydrophobicContact CD1-CD1 4.12Å; F234-I238 HydrophobicContact CD1-CG1 4.42Å; F234-I238 HydrophobicContact CE1-CD1 4Å; F234-I238 HydrophobicContact CE1-CG1 4.32Å
235T87.4Confident87.9Confident36 Ų3665.4 Ų65.422%0.22132%0.324CS..Hα-helixtrans-56.9-37.5177-610000111.9R227 S231 S232 K237 I238R227-T235 HydrophobicContact CG-CG2 4.21Å; S231-T235 PolarHBondContact O-N 2.87Å; S231-T235 PolarHBondContact O-OG1 3.14Å; S232-T235 PolarHBondContact O-N 2.75Å; T235-K237 PolarHBondContact O-N 3.47Å; T235-I238 WeakPolarHBondContact O-CB 3.4Å; T235-I238 PolarHBondContact O-N 2.93Å; T235-I238 VanDerWaalsContact O-N 3.12Å
236R90.4Very high88.2Confident164 Ų16463.7 Ų63.762%0.61931%0.312SS*.THydrogen-bonded Turntrans-64.8-18.6174-73.7-169-64.8-85.69.3114.8S232 F234 I238S232-R236 WeakPolarHBondContact O-CG 3.13Å; S232-R236 PolarHBondContact O-N 2.87Å; S232-R236 VanDerWaalsContact O-N 3.16Å; S232-R236 PolarHBondContact O-NH1 3.23Å; S232-R236 PolarHBondContact OG-NH1 3.04Å; F234-R236 PolarHBondContact O-N 2.87Å; R236-I238 VanDerWaalsContact C-N 3.28Å
237K92.1Very high88.6Confident43 Ų4363.5 Ų63.519%0.18731%0.311CS..THydrogen-bonded Turntrans-79.8-13.3176-61.2176.4176.4-164.80112.1R204 K205 L207 A209 L210 F234 T235R204-K237 PolarHBondContact O-NZ 3.16Å; K205-K237 PolarHBondContact O-NZ 3.04Å; L207-K237 HydrophobicContact CB-CD 4.46Å; L207-K237 HydrophobicContact CD2-CD 4.36Å; L207-K237 HydrophobicContact CG-CD 4.4Å; L207-K237 VanDerWaalsContact O-CD 3.23Å; L207-K237 WeakPolarHBondContact O-CD 3.37Å; L207-K237 WeakPolarHBondContact O-CE 3.47Å; L207-K237 PolarHBondContact O-NZ 3.24Å; A209-K237 CarbonylContact C-O 3.51Å; A209-K237 WeakPolarHBondContact CA-O 3.47Å; L210-K237 PolarHBondContact N-O 2.73Å; F234-K237 WeakPolarHBondContact O-CA 3.34Å; F234-K237 VanDerWaalsContact O-CB 3.26Å; F234-K237 WeakPolarHBondContact O-CB 3.32Å; F234-K237 PolarHBondContact O-N 2.95Å; T235-K237 PolarHBondContact O-N 3.47Å
238I92.1Very high88.9Confident21 Ų2158.6 Ų58.611%0.10830%0.304CS..EExtended strand (participates in β ladder)trans-86123.7-173.7-49179.5000109.6L210 V212 L223 F234 T235 R236 F240L210-I238 HydrophobicContact CB-CG1 4.32Å; L210-I238 HydrophobicContact CD2-CD1 4.37Å; L210-I238 HydrophobicContact CD2-CG1 4.18Å; L210-I238 HydrophobicContact CG-CG2 4.47Å; L210-I238 CarbonylContact O-C 3.51Å; L210-I238 WeakPolarHBondContact O-CA 3.3Å; V212-I238 HydrophobicContact CG2-CG2 4.02Å; L223-I238 HydrophobicContact CD1-CD1 3.89Å; L223-I238 HydrophobicContact CD2-CB 4.36Å; L223-I238 HydrophobicContact CD2-CD1 3.64Å; L223-I238 HydrophobicContact CD2-CG2 3.7Å; L223-I238 HydrophobicContact CG-CD1 4.19Å; F234-I238 HydrophobicContact CD1-CD1 4.12Å; F234-I238 HydrophobicContact CD1-CG1 4.42Å; F234-I238 HydrophobicContact CE1-CD1 4Å; F234-I238 HydrophobicContact CE1-CG1 4.32Å; T235-I238 WeakPolarHBondContact O-CB 3.4Å; T235-I238 PolarHBondContact O-N 2.93Å; T235-I238 VanDerWaalsContact O-N 3.12Å; R236-I238 VanDerWaalsContact C-N 3.28Å; I238-F240 HydrophobicContact CG2-CE2 4.34Å; I238-F240 HydrophobicContact CG2-CZ 4.26Å
239R93.2Very high89.1Confident144 Ų14462.1 Ų62.154%0.54331%0.312SS..EExtended strand (participates in β ladder)trans-124.5137.4177.3-62.4-175.1-179.2-175.6-2.2109.1L210 V211 V212L210-R239 PolarHBondContact O-N 2.8Å; V211-R239 CarbonylContact C-O 3.51Å; V211-R239 WeakPolarHBondContact CA-O 3.43Å; V212-R239 PolarHBondContact N-O 2.91Å
240F93.8Very high89.5Confident71 Ų7161.6 Ų61.631%0.31131%0.312SS..EExtended strand (participates in β ladder)trans-104.2133.8175.8-64.9-77.1000108.9V212 A215 K220 L223 I238V212-F240 HydrophobicContact CB-CD1 3.75Å; V212-F240 HydrophobicContact CB-CE1 3.98Å; V212-F240 HydrophobicContact CG1-CD1 4.17Å; V212-F240 HydrophobicContact CG1-CE1 4.18Å; V212-F240 HydrophobicContact CG2-CD1 4.34Å; V212-F240 HydrophobicContact CG2-CE1 4.18Å; V212-F240 WeakPolarHBondContact O-CA 3.48Å; A215-F240 HydrophobicContact CB-CD1 3.45Å; A215-F240 VanDerWaalsContact CB-CD1 3.45Å; A215-F240 HydrophobicContact CB-CE1 3.76Å; K220-F240 HydrophobicContact CG-CD1 4.16Å; K220-F240 HydrophobicContact CG-CE1 3.9Å; K220-F240 HydrophobicContact CG-CZ 4.14Å; L223-F240 HydrophobicContact CD2-CE1 4.37Å; L223-F240 HydrophobicContact CD2-CE2 4.18Å; L223-F240 HydrophobicContact CD2-CZ 3.49Å; L223-F240 VanDerWaalsContact CD2-CZ 3.49Å; I238-F240 HydrophobicContact CG2-CE2 4.34Å; I238-F240 HydrophobicContact CG2-CZ 4.26Å
241L93.2Very high89.7Confident18 Ų1861 Ų619%0.09431%0.309CS..EExtended strand (participates in β ladder)trans-120.3140.6172.2-56.1-178.8000109V211 V212 V213 H214 E246 L247 L250V211-L241 HydrophobicContact CG1-CD1 3.32Å; V211-L241 HydrophobicContact CG1-CG 3.68Å; V212-L241 PolarHBondContact O-N 3.14Å; V213-L241 WeakPolarHBondContact CA-O 3.44Å; V213-L241 HydrophobicContact CG1-CB 4.45Å; V213-L241 HydrophobicContact CG2-CB 4.37Å; V213-L241 HydrophobicContact CG2-CD1 4.3Å; H214-L241 PolarHBondContact N-O 2.91Å; L241-E246 WeakPolarHBondContact CA-OE2 3.49Å; L241-E246 HydrophobicContact CB-CB 4.25Å; L241-E246 WeakPolarHBondContact CB-OE2 3.35Å; L241-E246 HydrophobicContact CD1-CB 4.19Å; L241-E246 HydrophobicContact CD2-CB 4.1Å; L241-E246 WeakPolarHBondContact CD2-OE2 3.4Å; L241-E246 HydrophobicContact CG-CB 4.4Å; L241-L247 HydrophobicContact CD1-CB 4Å; L241-L247 HydrophobicContact CD1-CD1 4.09Å; L241-L250 HydrophobicContact CD1-CD1 3.79Å; L241-L250 HydrophobicContact CD2-CD1 4.19Å
242D89.3Confident89.5Confident86 Ų8663.2 Ų63.246%0.4633%0.325SS..SBendtrans-94.3-15.7-177.1-65.3-41.5000112H214 K220 E246 H270H214-D242 PolarHBondContact CE1-O 3.1Å; H214-D242 PolarHBondContact ND1-O 3.18Å; K220-D242 IonicContact NZ-OD1 3.64Å; K220-D242 PolarHBondContact NZ-OD1 3.2Å; D242-E246 PolarHBondContact N-OE2 3.34Å; D242-E246 VanDerWaalsContact N-OE2 3.16Å; D242-H270 PolarHBondContact O-CE1 2.96Å
243S91.3Very high89.3Confident17 Ų1761.6 Ų61.612%0.11931%0.31CS..  trans-136.2158.6179.572.80000115.1G245 E246 L247 D266 H270S243-G245 PolarHBondContact O-N 3.14Å; S243-G245 PolarHBondContact OG-N 3.19Å; S243-E246 WeakPolarHBondContact OG-CG 3.48Å; S243-E246 PolarHBondContact OG-N 3Å; S243-L247 PolarHBondContact O-N 2.74Å; S243-D266 WeakPolarHBondContact CA-OD1 3.44Å; S243-H270 WeakPolarHBondContact CB-CE1 3.3Å; S243-H270 WeakPolarHBondContact CB-NE2 3.31Å
244L91.5Very high88.6Confident16 Ų1662.9 Ų62.98%0.08432%0.323CS..Hα-helixtrans-67.9-24.2166.2-68.5179000112.3L177 V213 L247 A248 I258 V262 R263 D266L177-L244 HydrophobicContact CD2-CD2 4.45Å; V213-L244 HydrophobicContact CG1-CD2 4.16Å; L244-L247 HydrophobicContact CD2-CD2 4.26Å; L244-L247 WeakPolarHBondContact O-CB 3.34Å; L244-L247 PolarHBondContact O-N 2.89Å; L244-A248 PolarHBondContact O-N 3.24Å; L244-I258 HydrophobicContact CD1-CD1 4.19Å; L244-I258 HydrophobicContact CD1-CG2 4.17Å; L244-I258 HydrophobicContact CD2-CD1 4.04Å; L244-I258 HydrophobicContact CD2-CG2 4.38Å; L244-V262 HydrophobicContact CD1-CG1 4.49Å; L244-V262 HydrophobicContact CD2-CG1 4.14Å; L244-R263 HydrophobicContact CD1-CG 4.29Å; L244-D266 HydrophobicContact CD1-CB 3.83Å; L244-D266 HydrophobicContact CG-CB 3.99Å; L244-D266 PolarHBondContact N-OD1 3.11Å
245G90.8Very high87.8Confident39 Ų3968.2 Ų68.240%0.40235%0.348SS..Hα-helixtrans-64.1-43.1175.100000112.6S243 L247 A248 Q249S243-G245 PolarHBondContact O-N 3.14Å; S243-G245 PolarHBondContact OG-N 3.19Å; G245-L247 VanDerWaalsContact C-N 3.3Å; G245-L247 PolarHBondContact O-N 3.27Å; G245-A248 WeakPolarHBondContact O-CB 3.32Å; G245-A248 PolarHBondContact O-N 2.92Å; G245-Q249 PolarHBondContact O-N 3Å
246E91.1Very high87.6Confident69 Ų6967 Ų6732%0.32234%0.341SS..Hα-helixtrans-63.4-37.4172.7-73.6170.5-159.700111.8L241 D242 S243 A248 Q249L241-E246 WeakPolarHBondContact CA-OE2 3.49Å; L241-E246 HydrophobicContact CB-CB 4.25Å; L241-E246 WeakPolarHBondContact CB-OE2 3.35Å; L241-E246 HydrophobicContact CD1-CB 4.19Å; L241-E246 HydrophobicContact CD2-CB 4.1Å; L241-E246 WeakPolarHBondContact CD2-OE2 3.4Å; L241-E246 HydrophobicContact CG-CB 4.4Å; D242-E246 PolarHBondContact N-OE2 3.34Å; D242-E246 VanDerWaalsContact N-OE2 3.16Å; S243-E246 WeakPolarHBondContact OG-CG 3.48Å; S243-E246 PolarHBondContact OG-N 3Å; E246-A248 VanDerWaalsContact C-N 3.3Å; E246-A248 PolarHBondContact O-N 3.16Å; E246-Q249 PolarHBondContact O-N 3.2Å
247L91.1Very high87.3Confident1 Ų165.1 Ų65.11%0.00534%0.339CS..Hα-helixtrans-63.3-39.3175-176.469000111.1V175 L177 V211 V213 L241 S243 L244 G245 Q249 L250 I251 L253V175-L247 HydrophobicContact CG1-CD1 3.81Å; V175-L247 HydrophobicContact CG1-CD2 3.97Å; V175-L247 HydrophobicContact CG2-CD1 4.11Å; L177-L247 HydrophobicContact CD2-CD2 4.35Å; V211-L247 HydrophobicContact CG1-CD1 4.06Å; V213-L247 HydrophobicContact CG2-CB 4.47Å; V213-L247 HydrophobicContact CG2-CD1 4.17Å; V213-L247 HydrophobicContact CG2-CD2 4.21Å; L241-L247 HydrophobicContact CD1-CB 4Å; L241-L247 HydrophobicContact CD1-CD1 4.09Å; S243-L247 PolarHBondContact O-N 2.74Å; L244-L247 HydrophobicContact CD2-CD2 4.26Å; L244-L247 WeakPolarHBondContact O-CB 3.34Å; L244-L247 PolarHBondContact O-N 2.89Å; G245-L247 VanDerWaalsContact C-N 3.3Å; G245-L247 PolarHBondContact O-N 3.27Å; L247-Q249 PolarHBondContact O-N 3.01Å; L247-L250 PolarHBondContact O-N 3.32Å; L247-I251 HydrophobicContact CD1-CD1 3.86Å; L247-I251 HydrophobicContact CD1-CG1 3.88Å; L247-I251 HydrophobicContact CD2-CD1 4.26Å; L247-I251 HydrophobicContact CG-CD1 3.99Å; L247-I251 HydrophobicContact CG-CG1 3.9Å; L247-I251 WeakPolarHBondContact O-CG1 3.03Å; L247-I251 PolarHBondContact O-N 3.36Å; L247-L253 HydrophobicContact CD2-CD2 3.87Å; L247-L253 HydrophobicContact CG-CD2 4.04Å
248A89.8Confident87.2Confident49 Ų4963.4 Ų63.441%0.40533%0.332SS..Hα-helixtrans-63.5-27.6178.300000113.5L244 G245 E246 L250 L253L244-A248 PolarHBondContact O-N 3.24Å; G245-A248 WeakPolarHBondContact O-CB 3.32Å; G245-A248 PolarHBondContact O-N 2.92Å; E246-A248 VanDerWaalsContact C-N 3.3Å; E246-A248 PolarHBondContact O-N 3.16Å; A248-L250 VanDerWaalsContact C-N 3.27Å; A248-L253 HydrophobicContact CB-CD1 3.52Å; A248-L253 HydrophobicContact CB-CG 3.96Å
249Q88.2Confident87.2Confident166 Ų16662.6 Ų62.678%0.77633%0.327SS*.Hα-helixtrans-73.4-23.1174.1-63.4174.112.900112.1G245 E246 L247G245-Q249 PolarHBondContact O-N 3Å; E246-Q249 PolarHBondContact O-N 3.2Å; L247-Q249 PolarHBondContact O-N 3.01Å
250L85.3Confident87.1Confident63 Ų6360.4 Ų60.433%0.3332%0.324SS..Hα-helixtrans-96.9-31.1-178.1-65.1174.8000113.3H126 L241 L247 A248H126-L250 PolarHBondContact CE1-O 3.32Å; H126-L250 PolarHBondContact ND1-O 3.47Å; H126-L250 PolarHBondContact NE2-O 2.81Å; H126-L250 VanDerWaalsContact NE2-O 3.12Å; L241-L250 HydrophobicContact CD1-CD1 3.79Å; L241-L250 HydrophobicContact CD2-CD1 4.19Å; L247-L250 PolarHBondContact O-N 3.32Å; A248-L250 VanDerWaalsContact C-N 3.27Å
251I86.5Confident86.9Confident8 Ų859.3 Ų59.34%0.04133%0.327CS..SBendtrans-143.8150-178.858.1163.5000111.4H126 V133 L173 V175 L247 L253 V256H126-I251 HydrophobicContact CB-CG2 4.19Å; V133-I251 HydrophobicContact CG1-CD1 3.74Å; V133-I251 HydrophobicContact CG2-CG2 3.98Å; L173-I251 HydrophobicContact CD1-CG2 4.09Å; V175-I251 HydrophobicContact CG2-CD1 4.06Å; L247-I251 HydrophobicContact CD1-CD1 3.86Å; L247-I251 HydrophobicContact CD1-CG1 3.88Å; L247-I251 HydrophobicContact CD2-CD1 4.26Å; L247-I251 HydrophobicContact CG-CD1 3.99Å; L247-I251 HydrophobicContact CG-CG1 3.9Å; L247-I251 WeakPolarHBondContact O-CG1 3.03Å; L247-I251 PolarHBondContact O-N 3.36Å; I251-L253 HydrophobicContact CD1-CD2 4.17Å; I251-L253 HydrophobicContact CG1-CD2 4.06Å; I251-L253 PolarHBondContact O-N 3.17Å; I251-V256 HydrophobicContact CD1-CG2 4.26Å
252S81.6Confident86.8Confident77 Ų7758.4 Ų58.454%0.53832%0.323SS..  trans-68.3116.5173.3-55.80000110.2D254 V256S252-D254 VanDerWaalsContact C-N 3.33Å; S252-V256 WeakPolarHBondContact O-CG2 3.4Å
253L80.9Confident87Confident47 Ų4758.6 Ų58.625%0.24632%0.317CS..G310 helixtrans-80.9-10.1-178.5-62.6-174.9000114.1L247 A248 I251 Q255 V256 I258L247-L253 HydrophobicContact CD2-CD2 3.87Å; L247-L253 HydrophobicContact CG-CD2 4.04Å; A248-L253 HydrophobicContact CB-CD1 3.52Å; A248-L253 HydrophobicContact CB-CG 3.96Å; I251-L253 HydrophobicContact CD1-CD2 4.17Å; I251-L253 HydrophobicContact CG1-CD2 4.06Å; I251-L253 PolarHBondContact O-N 3.17Å; L253-Q255 PolarHBondContact O-N 3.47Å; L253-V256 HydrophobicContact CD2-CB 4.42Å; L253-V256 HydrophobicContact CD2-CG2 4.4Å; L253-V256 WeakPolarHBondContact O-CB 3.14Å; L253-V256 PolarHBondContact O-N 3.45Å; L253-I258 HydrophobicContact CD1-CD1 4.35Å; L253-I258 HydrophobicContact CD2-CD1 4.36Å
254D74.2Confident87Confident160 Ų16061.6 Ų61.686%0.85633%0.329SS*.G310 helixtrans-60.4-31.2-174.9-58.6-34.9000113.3S252S252-D254 VanDerWaalsContact C-N 3.33Å
255Q70.8Confident86.9Confident138 Ų13863.2 Ų63.265%0.64534%0.337SS*.G310 helixtrans-98.11.3-179.8-60.2-178.812.900112.5L253L253-Q255 PolarHBondContact O-N 3.47Å
256V82.3Confident86.9Confident11 Ų1162.9 Ų62.97%0.06733%0.326CS..  trans-100.3117.6-169.4178.10000110.9L135 I251 S252 L253 I258L135-V256 HydrophobicContact CD1-CG1 3.71Å; L135-V256 HydrophobicContact CD1-CG2 4.33Å; L135-V256 HydrophobicContact CD2-CG1 3.22Å; L135-V256 HydrophobicContact CG-CG1 4.06Å; I251-V256 HydrophobicContact CD1-CG2 4.26Å; S252-V256 WeakPolarHBondContact O-CG2 3.4Å; L253-V256 HydrophobicContact CD2-CB 4.42Å; L253-V256 HydrophobicContact CD2-CG2 4.4Å; L253-V256 WeakPolarHBondContact O-CB 3.14Å; L253-V256 PolarHBondContact O-N 3.45Å; V256-I258 HydrophobicContact CG1-CG1 3.81Å; V256-I258 PolarHBondContact O-N 2.93Å; V256-I258 VanDerWaalsContact O-N 3.13Å
257H84.3Confident86.9Confident123 Ų12365.2 Ų65.257%0.56933%0.332SS*.  trans-81.393.3173-170.475.9000111.7
258I90.4Very high86.8Confident8 Ų869.6 Ų69.64%0.04136%0.356CS..  trans-82.3130.1174.8-53.9175.1000109.7L177 L244 L253 V256 V262 R263L177-I258 HydrophobicContact CD1-CG2 4.25Å; L244-I258 HydrophobicContact CD1-CD1 4.19Å; L244-I258 HydrophobicContact CD1-CG2 4.17Å; L244-I258 HydrophobicContact CD2-CD1 4.04Å; L244-I258 HydrophobicContact CD2-CG2 4.38Å; L253-I258 HydrophobicContact CD1-CD1 4.35Å; L253-I258 HydrophobicContact CD2-CD1 4.36Å; V256-I258 HydrophobicContact CG1-CG1 3.81Å; V256-I258 PolarHBondContact O-N 2.93Å; V256-I258 VanDerWaalsContact O-N 3.13Å; I258-V262 HydrophobicContact CG2-CB 3.91Å; I258-V262 HydrophobicContact CG2-CG1 4.01Å; I258-R263 HydrophobicContact CB-CG 4.45Å; I258-R263 HydrophobicContact CG2-CG 3.94Å; I258-R263 PolarHBondContact O-NH1 3.45Å; I258-R263 PolarHBondContact O-NH2 3.27Å
259P92.1Very high86.6Confident3 Ų372 Ų722%0.01936%0.362CS..  trans-62143.9173.5-20.431.4000112.5A137 Y140 L177 A261 V262 R263A137-P259 HydrophobicContact CB-CG 3.66Å; Y140-P259 HydrophobicContact CE2-CB 4.13Å; Y140-P259 HydrophobicContact CE2-CG 3.69Å; L177-P259 HydrophobicContact CD1-CG 4.45Å; P259-A261 VanDerWaalsContact C-N 3.27Å; P259-A261 PolarHBondContact O-N 3.35Å; P259-V262 HydrophobicContact CB-CG2 4.04Å; P259-V262 HydrophobicContact CG-CG2 4.06Å; P259-V262 WeakPolarHBondContact O-CB 3.46Å; P259-V262 PolarHBondContact O-N 3Å; P259-R263 PolarHBondContact O-N 2.94Å
260E90.6Very high86.3Confident99 Ų9969 Ų6946%0.46335%0.347SS..Hα-helixtrans-62.5-33.9-179.4-171.355.7-154.300112.8V262 R263 Q264 R267E260-V262 PolarHBondContact O-N 3.2Å; E260-R263 PolarHBondContact O-N 3.11Å; E260-R263 VanDerWaalsContact O-N 3.13Å; E260-R263 IonicContact OE2-NH1 2.72Å; E260-Q264 WeakPolarHBondContact O-CB 3.43Å; E260-Q264 PolarHBondContact O-N 2.92Å; E260-R267 IonicContact OE1-CZ 3.75Å; E260-R267 IonicContact OE1-NH1 3.81Å; E260-R267 PolarHBondContact OE1-NH1 3.24Å; E260-R267 IonicContact OE1-NH2 2.83Å; E260-R267 PolarHBondContact OE1-NH2 2.71Å
261A90Very high85.2Confident47 Ų4768.9 Ų68.939%0.38836%0.361SS..Hα-helixtrans-59.7-30.5175.100000112.9P259 L265P259-A261 VanDerWaalsContact C-N 3.27Å; P259-A261 PolarHBondContact O-N 3.35Å; A261-L265 PolarHBondContact O-N 3.09Å
262V91.6Very high83.7Confident0 Ų073.3 Ų73.30%039%0.393CS..Hα-helixtrans-77.2-42.9176.3-177.40000110L177 G179 L244 I258 P259 E260 Q264 L265 D266L177-V262 HydrophobicContact CB-CG1 4.4Å; L177-V262 HydrophobicContact CB-CG2 4.01Å; L177-V262 HydrophobicContact CD2-CG1 4.41Å; G179-V262 WeakPolarHBondContact O-CG2 3.21Å; L244-V262 HydrophobicContact CD1-CG1 4.49Å; L244-V262 HydrophobicContact CD2-CG1 4.14Å; I258-V262 HydrophobicContact CG2-CB 3.91Å; I258-V262 HydrophobicContact CG2-CG1 4.01Å; P259-V262 HydrophobicContact CB-CG2 4.04Å; P259-V262 HydrophobicContact CG-CG2 4.06Å; P259-V262 WeakPolarHBondContact O-CB 3.46Å; P259-V262 PolarHBondContact O-N 3Å; E260-V262 PolarHBondContact O-N 3.2Å; V262-Q264 VanDerWaalsContact C-N 3.34Å; V262-Q264 PolarHBondContact O-N 3.37Å; V262-L265 PolarHBondContact O-N 2.94Å; V262-D266 PolarHBondContact O-N 3.22Å
263R91.9Very high82.1Confident89 Ų8973.3 Ų73.334%0.33641%0.405SS..Hα-helixtrans-61.7-41.4175.5-65.6-164.2-17791.95.4112.4L244 I258 P259 E260 D266 R267L244-R263 HydrophobicContact CD1-CG 4.29Å; I258-R263 HydrophobicContact CB-CG 4.45Å; I258-R263 HydrophobicContact CG2-CG 3.94Å; I258-R263 PolarHBondContact O-NH1 3.45Å; I258-R263 PolarHBondContact O-NH2 3.27Å; P259-R263 PolarHBondContact O-N 2.94Å; E260-R263 PolarHBondContact O-N 3.11Å; E260-R263 VanDerWaalsContact O-N 3.13Å; E260-R263 IonicContact OE2-NH1 2.72Å; R263-D266 PolarHBondContact O-N 3.33Å; R263-R267 WeakPolarHBondContact O-CG 3.35Å; R263-R267 PolarHBondContact O-N 2.87Å
264Q91.2Very high80.3Confident81 Ų8174.1 Ų74.138%0.37943%0.425SS..Hα-helixtrans-62.1-46.6176.2-175.964.856.200110.7E260 V262 D266 R267 D268E260-Q264 WeakPolarHBondContact O-CB 3.43Å; E260-Q264 PolarHBondContact O-N 2.92Å; V262-Q264 VanDerWaalsContact C-N 3.34Å; V262-Q264 PolarHBondContact O-N 3.37Å; Q264-D266 VanDerWaalsContact C-N 3.33Å; Q264-D266 PolarHBondContact O-N 2.81Å; Q264-R267 WeakPolarHBondContact O-CB 3.42Å; Q264-R267 PolarHBondContact O-N 2.72Å; Q264-D268 PolarHBondContact NE2-OD1 3.49Å; Q264-D268 PolarHBondContact O-N 2.74Å
265L89.9Confident78.3Confident49 Ų4976.6 Ų76.626%0.25745%0.446SS..Hα-helixtrans-60.8-42.5177.5-178.865.7000112G179 H214 A261 V262 R267 D268 L269G179-L265 VanDerWaalsContact CA-CD2 3.46Å; H214-L265 HydrophobicContact CB-CD2 3.82Å; A261-L265 PolarHBondContact O-N 3.09Å; V262-L265 PolarHBondContact O-N 2.94Å; L265-R267 VanDerWaalsContact C-N 3.32Å; L265-R267 PolarHBondContact O-N 2.94Å; L265-D268 PolarHBondContact O-N 3.15Å; L265-L269 HydrophobicContact CD1-CD1 4.06Å; L265-L269 HydrophobicContact CD1-CG 4.08Å; L265-L269 HydrophobicContact CD2-CD1 4.45Å; L265-L269 HydrophobicContact CG-CD1 3.89Å; L265-L269 HydrophobicContact CG-CG 4.31Å; L265-L269 WeakPolarHBondContact O-CB 3.29Å; L265-L269 VanDerWaalsContact O-CG 3.31Å; L265-L269 WeakPolarHBondContact O-CG 3.47Å; L265-L269 PolarHBondContact O-N 2.74Å
266D91.3Very high78.7Confident32 Ų3273.5 Ų73.517%0.17144%0.436CS..Hα-helixtrans-58.9-44.3176.2-170.968.3000111.3H214 S243 L244 V262 R263 Q264 H270H214-D266 IonicContact CE1-OD1 3.23Å; H214-D266 PolarHBondContact CE1-OD1 3.48Å; H214-D266 WeakPolarHBondContact NE2-CB 3.46Å; H214-D266 IonicContact NE2-OD1 3.42Å; H214-D266 PolarHBondContact NE2-OD1 2.64Å; S243-D266 WeakPolarHBondContact CA-OD1 3.44Å; L244-D266 HydrophobicContact CD1-CB 3.83Å; L244-D266 HydrophobicContact CG-CB 3.99Å; L244-D266 PolarHBondContact N-OD1 3.11Å; V262-D266 PolarHBondContact O-N 3.22Å; R263-D266 PolarHBondContact O-N 3.33Å; Q264-D266 VanDerWaalsContact C-N 3.33Å; Q264-D266 PolarHBondContact O-N 2.81Å; D266-H270 WeakPolarHBondContact O-CB 3.33Å; D266-H270 PolarHBondContact O-N 3.42Å; D266-H270 VanDerWaalsContact O-N 3.11Å; D266-H270 PolarHBondContact O-ND1 3.39Å; D266-H270 IonicContact OD1-CE1 2.73Å; D266-H270 IonicContact OD1-ND1 3.51Å
267R91.3Very high78.5Confident118 Ų11876.8 Ų76.845%0.44546%0.455SS..Hα-helixtrans-62.8-41.6173.1-72.3-168.3-62.1-109.5-0.1112.8E260 R263 Q264 L265 G271E260-R267 IonicContact OE1-CZ 3.75Å; E260-R267 IonicContact OE1-NH1 3.81Å; E260-R267 PolarHBondContact OE1-NH1 3.24Å; E260-R267 IonicContact OE1-NH2 2.83Å; E260-R267 PolarHBondContact OE1-NH2 2.71Å; R263-R267 WeakPolarHBondContact O-CG 3.35Å; R263-R267 PolarHBondContact O-N 2.87Å; Q264-R267 WeakPolarHBondContact O-CB 3.42Å; Q264-R267 PolarHBondContact O-N 2.72Å; L265-R267 VanDerWaalsContact C-N 3.32Å; L265-R267 PolarHBondContact O-N 2.94Å; R267-G271 WeakPolarHBondContact O-CA 3.39Å; R267-G271 PolarHBondContact O-N 3.14Å
268D88.7Confident78.2Confident93 Ų9374.2 Ų74.250%0.49745%0.449SS..Hα-helixtrans-68.1-39.2-177.4-64.6-18.7000111.2Q264 L265Q264-D268 PolarHBondContact NE2-OD1 3.49Å; Q264-D268 PolarHBondContact O-N 2.74Å; L265-D268 PolarHBondContact O-N 3.15Å
269L85.9Confident77.5Confident101 Ų10178.1 Ų78.153%0.52947%0.473SS..Hα-helixtrans-72-35.3179.4-68.4174.3000112.8L265L265-L269 HydrophobicContact CD1-CD1 4.06Å; L265-L269 HydrophobicContact CD1-CG 4.08Å; L265-L269 HydrophobicContact CD2-CD1 4.45Å; L265-L269 HydrophobicContact CG-CD1 3.89Å; L265-L269 HydrophobicContact CG-CG 4.31Å; L265-L269 WeakPolarHBondContact O-CB 3.29Å; L265-L269 VanDerWaalsContact O-CG 3.31Å; L265-L269 WeakPolarHBondContact O-CG 3.47Å; L265-L269 PolarHBondContact O-N 2.74Å
270H81Confident76.6Confident102 Ų10282.8 Ų82.847%0.47250%0.501SS..Hα-helixtrans-105.2-16.1-175-59.290.3000114.1D242 S243 D266D242-H270 PolarHBondContact O-CE1 2.96Å; S243-H270 WeakPolarHBondContact CB-CE1 3.3Å; S243-H270 WeakPolarHBondContact CB-NE2 3.31Å; D266-H270 WeakPolarHBondContact O-CB 3.33Å; D266-H270 PolarHBondContact O-N 3.42Å; D266-H270 VanDerWaalsContact O-N 3.11Å; D266-H270 PolarHBondContact O-ND1 3.39Å; D266-H270 IonicContact OD1-CE1 2.73Å; D266-H270 IonicContact OD1-ND1 3.51Å
271G63.9Low75.6Confident61 Ų6181.7 Ų81.763%0.62950%0.504SS*.Hα-helixtrans-83.6-13.417700000113.9R267 G273R267-G271 WeakPolarHBondContact O-CA 3.39Å; R267-G271 PolarHBondContact O-N 3.14Å; G271-G273 VanDerWaalsContact C-N 3.28Å; G271-G273 PolarHBondContact O-N 3.49Å
272S54.7Low74.6Confident100 Ų10084.2 Ų84.270%0.69951%0.512SS*.THydrogen-bonded Turntrans-81.20176.7-172.20000114.1
273G47.3Very low73.3Confident78 Ų7890.7 Ų90.780%0.80455%0.552SS**THydrogen-bonded Turntrans-91.911.8-178.400000115.6G271G271-G273 VanDerWaalsContact C-N 3.28Å; G271-G273 PolarHBondContact O-N 3.49Å
274G42.3Very low71.8Confident64 Ų6490.8 Ų90.866%0.6657%0.57SS**  trans-129.269.1-17500000113.3
275T33.6Very low70Confident211 Ų21191.7 Ų91.7100%1.29459%0.587SS**  trans-148.80155.154.70000109.8

Retrieved 275 of 275 residues in 78.7 ms (Link to these results)