A0A087XJ71_POEFO Loading...

Neuronal differentiation 6b

AlphaFold DB , UniProt , Accession A0A087XJ71, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 343 aa.

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

Site Residue pLDDT pLDDT confidence pLDDT10 pLDDT10 confidence SASA SASA [Ų] SASA10 SASA10 [Ų] RSA RSA unformatted RSA10 RSA10 unformatted Surface Surface10 (not used) Disorder (not used) Disorder Sec. str. Secondary structure Isomer Phi (φ) Psi (ψ) Omega (ω) Chi 1 (χ1) Chi 2 (χ2) Chi 3 (χ3) Chi 4 (χ4) Chi 5 (χ5) Tau (τ) Contacts (colored by PAE) Contact details
1M36Very low44.1Very low239 Ų239151.6 Ų151.6100%1.17782%0.818SS**  091.70-69.8178.3131.700106.7
2L39.8Very low43.2Very low160 Ų160151.6 Ų151.684%0.83881%0.805SS**  57.9101.395.8-93.1168.7000113.7
3T42.3Very low43.3Very low110 Ų110155.2 Ų155.268%0.67581%0.814SS**  140.5139.5117.9490000115.8
4R46.8Very low43Very low229 Ų229154.3 Ų154.386%0.86480%0.804SS**  trans71.2127.6147-70.3161.2179.3-179.6-1.8116.4
5G47.2Very low43.3Very low71 Ų71150.1 Ų150.173%0.73279%0.79SS**  cis93.57025.400000109.8
6D45.1Very low42.9Very low136 Ų136150.8 Ų150.873%0.72779%0.787SS**  trans-137.6101.5172-78.7-33.1000109.1
7M42.7Very low42.6Very low196 Ų196153.4 Ų153.497%0.96680%0.797SS**  trans-119.389.2158.1-78.4-72.1-75.700106.2
8L46.5Very low42.6Very low139 Ų139154.2 Ų154.273%0.72880%0.799SS**  trans-87.6129.5176-80.5161.9000110.5
9T45Very low42.5Very low117 Ų117152.9 Ų152.972%0.71880%0.803SS**  trans71.799.114244.30000122.2
10L47.6Very low42.3Very low149 Ų149153.7 Ų153.778%0.7880%0.802SS**  48.5144.2115.7-66.7-177.3000120.8
11P46.2Very low42.3Very low122 Ų122152 Ų15279%0.79280%0.801SS**  -133.1142.455.135.3-17.3000114
12F33.8Very low42.5Very low151 Ų151151.7 Ų151.766%0.66279%0.786SS**  46.283.168.4-149.4-94.5000115.2E14F12-E14 HydrophobicContact CD1-CB 4.36Å; F12-E14 HydrophobicContact CE1-CB 3.61Å; F12-E14 HydrophobicContact CE1-CG 4.24Å; F12-E14 WeakPolarHBondContact CE1-OE2 3.39Å; F12-E14 HydrophobicContact CZ-CB 3.91Å; F12-E14 HydrophobicContact CZ-CG 4.06Å; F12-E14 WeakPolarHBondContact CZ-OE2 3.44Å
13E43.4Very low42.2Very low198 Ų198154.7 Ų154.793%0.92579%0.793SS**  trans-107.2126152.7-90.3-171.7156.200109.1
14E40.3Very low42.4Very low143 Ų143153 Ų15367%0.66880%0.797SS**  trans-123.7175.8170.3-148.3-167.2175.400106.2F12F12-E14 HydrophobicContact CD1-CB 4.36Å; F12-E14 HydrophobicContact CE1-CB 3.61Å; F12-E14 HydrophobicContact CE1-CG 4.24Å; F12-E14 WeakPolarHBondContact CE1-OE2 3.39Å; F12-E14 HydrophobicContact CZ-CB 3.91Å; F12-E14 HydrophobicContact CZ-CG 4.06Å; F12-E14 WeakPolarHBondContact CZ-OE2 3.44Å
15P46.7Very low41.9Very low92 Ų92146.3 Ų146.360%0.59779%0.791SS**  -116.5-178.6-83.338.3-24.5000113.2
16H37.3Very low41.6Very low161 Ų161151 Ų15175%0.74580%0.799SS**  trans63.4107.7149.1-8452.7000119.6
17M37.5Very low41.3Very low195 Ų195154.9 Ų154.996%0.96181%0.805SS**  trans-132.4101.3138.7-73.4-149.8-128.700109.6
18M42.2Very low41.2Very low168 Ų168151.3 Ų151.383%0.82880%0.796SS**PPolyproline II helixtrans-78.6121.8163.5-75-72.1-154.600108E20M18-E20 PolarHBondContact O-N 2.84Å
19C41.6Very low41.2Very low129 Ų129156.7 Ų156.787%0.87281%0.807SS**PPolyproline II helixtrans-66.2123.8169.5-86.30000110.4
20E38.3Very low40.9Very low169 Ų169159.5 Ų159.579%0.7981%0.812SS**PPolyproline II helixtrans-71.1133.3171.6-163.4-165.6-150.500110.8M18 R22M18-E20 PolarHBondContact O-N 2.84Å; E20-R22 PolarHBondContact O-N 3.5Å
21P41.7Very low40.8Very low118 Ų118157.7 Ų157.777%0.76681%0.812SS**  trans-84.2115.3172.6-2.220.4000110.5
22R41.1Very low40.4Very low233 Ų233159.9 Ų159.988%0.87982%0.816SS**  trans-65.6142.8168.9-74.5-178.4168.7158.6-2.3111.5E20 G24E20-R22 PolarHBondContact O-N 3.5Å; R22-G24 PolarHBondContact O-N 3.47Å
23F32.8Very low40.7Very low223 Ų223157.1 Ų157.198%0.97881%0.813SS**SBendtrans-54.6123179-138.4-102.6000112.3
24G46.6Very low40.7Very low73 Ų73154.4 Ų154.475%0.75381%0.805SS**  trans83.288163.500000116.9R22R22-G24 PolarHBondContact O-N 3.47Å
25A35.8Very low40.6Very low89 Ų89152.3 Ų152.374%0.73681%0.806SS**  trans-156.8141.2153.500000110.9
26N42.8Very low40.4Very low169 Ų169154 Ų15490%0.90481%0.809SS**PPolyproline II helixtrans-64.4141.2-174.2-63.6-39.9000113.2
27Y37.7Very low40.8Very low219 Ų219152.4 Ų152.486%0.85980%0.802SS**PPolyproline II helixtrans-90.9134171.6-77.6-85.4000111.8
28P41.3Very low41Very low120 Ų120150.1 Ų150.178%0.77979%0.789SS**PPolyproline II helixtrans-71.9143.6170.2-723.5000110.9
29R45.5Very low41Very low252 Ų252148.5 Ų148.595%0.95178%0.779SS**  trans-97.699.5-179.6-167.5-170.6-150.7-138.26.2109.4
30E39.7Very low40.9Very low177 Ų177149 Ų14983%0.82777%0.769SS**  trans-123.3116.7164.3-73.3-164.5164.600112
31S45.6Very low41.1Very low111 Ų111150 Ų15078%0.77677%0.765SS**  trans32.1110.2149.7530000120.7
32L36.6Very low41Very low168 Ų168152.2 Ų152.288%0.8877%0.766SS**  trans-126.7157.5156.8-87.9171.3000109.5
33P40.9Very low40.9Very low92 Ų92148.8 Ų148.860%0.59776%0.76SS**  trans-81.2154.9-140.831.4-36.1000115.6S35P33-S35 PolarHBondContact O-N 3.4Å
34D42.3Very low41.2Very low142 Ų142147.1 Ų147.176%0.75975%0.747SS**THydrogen-bonded Turntrans-54.1-7.1-172.8-112.1-22.7000116.8L36D34-L36 PolarHBondContact O-N 3.44Å
35S39.2Very low40.8Very low99 Ų99149.4 Ų149.469%0.69275%0.749SS**THydrogen-bonded Turntrans-80.1-17-172.2-460000114.4P33P33-S35 PolarHBondContact O-N 3.4Å
36L41.7Very low40.8Very low126 Ų126150.8 Ų150.866%0.6675%0.748SS**THydrogen-bonded Turntrans-92.8-20.2177.2-66.7177000113.3D34 Q38 Q39D34-L36 PolarHBondContact O-N 3.44Å; L36-Q38 VanDerWaalsContact C-N 3.27Å; L36-Q38 PolarHBondContact O-N 2.93Å; L36-Q39 PolarHBondContact O-N 3.34Å
37Q46Very low40.7Very low129 Ų129148 Ų14860%0.60375%0.749SS**Hα-helixtrans-70.3-25.9-179-156.410586.400112.2R41Q37-R41 PolarHBondContact O-N 3.42Å
38Q40.7Very low40.9Very low147 Ų147148 Ų14869%0.68775%0.747SS**Hα-helixtrans-78.5-26.7-179.4-155.8163.543.800112.7L36L36-Q38 VanDerWaalsContact C-N 3.27Å; L36-Q38 PolarHBondContact O-N 2.93Å
39Q42.5Very low41.2Very low133 Ų133147.7 Ų147.762%0.62175%0.747SS**Hα-helixtrans-81-32178.4-158.216833.800112.5L36 R41L36-Q39 PolarHBondContact O-N 3.34Å; Q39-R41 VanDerWaalsContact C-N 3.35Å
40E41.1Very low40.9Very low139 Ų139141.2 Ų141.265%0.6573%0.732SS**Hα-helixtrans-73.8-23171.3-92.8-170.996.500113.4
41R42.2Very low41.5Very low190 Ų190136.6 Ų136.672%0.71772%0.717SS**Hα-helixtrans-75.9-22.8176.7-99.1-169.6161.6-141.6-2.1114Q37 Q39Q37-R41 PolarHBondContact O-N 3.42Å; Q39-R41 VanDerWaalsContact C-N 3.35Å
42Q38.7Very low41.7Very low166 Ų166137.9 Ų137.978%0.77671%0.711SS**THydrogen-bonded Turntrans-84.5-10.6176.8-75.5179.318.400113.7
43Q40.2Very low42.1Very low160 Ų160137.2 Ų137.275%0.74871%0.705SS**THydrogen-bonded Turntrans-106.510.9178.6-68.5-172.741.400114.2P45Q43-P45 VanDerWaalsContact O-CD 3.29Å; Q43-P45 WeakPolarHBondContact O-CD 3.35Å
44R37.9Very low42.5Very low189 Ų189139.1 Ų139.171%0.71371%0.708SS**PPolyproline II helixtrans-80.6116.3164.6-69.9-171.8-155.2-164.43.6108.4T46R44-T46 PolarHBondContact O-N 2.93Å
45P37.5Very low42.9Very low121 Ų121140.5 Ų140.579%0.78670%0.702SS**PPolyproline II helixtrans-64.4125.9162.525.4-23.3000106.7Q43 A47Q43-P45 VanDerWaalsContact O-CD 3.29Å; Q43-P45 WeakPolarHBondContact O-CD 3.35Å; P45-A47 PolarHBondContact O-N 3.11Å
46T37.1Very low43.1Very low118 Ų118143.2 Ų143.272%0.72470%0.704SS**PPolyproline II helixtrans-49132.6165.345.90000108.5R44 R48R44-T46 PolarHBondContact O-N 2.93Å; T46-R48 PolarHBondContact O-N 3.38Å
47A41Very low43.5Very low111 Ų111139.9 Ų139.992%0.91770%0.695SS**  trans-59.281.5169.100000110P45P45-A47 PolarHBondContact O-N 3.11Å
48R40.9Very low43.6Very low218 Ų218140 Ų14082%0.82370%0.695SS**  trans-111.4116153.7-80.3-173.6173-164-1.7104.1T46 D50T46-R48 PolarHBondContact O-N 3.38Å; R48-D50 PolarHBondContact O-N 2.93Å
49S47Very low43.9Very low113 Ų113138.5 Ų138.579%0.7969%0.692SS**  trans-41.7102.1168.941.20000110.1P51S49-P51 WeakPolarHBondContact O-CD 3.42Å
50D39.9Very low44.1Very low117 Ų117138.3 Ų138.363%0.62670%0.695SS**  trans-77.6114.5176.6-138.9-18.7000107.6R48 E52R48-D50 PolarHBondContact O-N 2.93Å; D50-E52 PolarHBondContact O-N 3.48Å; D50-E52 VanDerWaalsContact O-N 3.15Å
51P51.6Low44.4Very low80 Ų80136.1 Ų136.152%0.51969%0.687SS.*Hα-helixtrans-69.5-8.8-171.925.1-31.2000113.9S49 R55S49-P51 WeakPolarHBondContact O-CD 3.42Å; P51-R55 WeakPolarHBondContact O-CD 3.48Å; P51-R55 VanDerWaalsContact O-CG 3.27Å; P51-R55 WeakPolarHBondContact O-CG 3.36Å; P51-R55 PolarHBondContact O-N 3.3Å
52E50.1Low44.5Very low138 Ų138130.5 Ų130.565%0.64568%0.677SS**Hα-helixtrans-80.3-39-179-69.8-167.3156.400113.6D50 M54 R55 E56D50-E52 PolarHBondContact O-N 3.48Å; D50-E52 VanDerWaalsContact O-N 3.15Å; E52-M54 VanDerWaalsContact C-N 3.35Å; E52-M54 PolarHBondContact O-N 3.37Å; E52-R55 PolarHBondContact O-N 3.35Å; E52-E56 PolarHBondContact O-N 3.48Å
53M44.6Very low44.8Very low154 Ų154129.4 Ų129.476%0.75968%0.677SS**Hα-helixtrans-74.8-21.5178.5-76.8-140.3-57.300114
54M50.4Low45.3Very low131 Ų131130.9 Ų130.965%0.64568%0.676SS**Hα-helixtrans-73.8-38.7167-95-152.7-143.200111.3E52 E56 A57 E58E52-M54 VanDerWaalsContact C-N 3.35Å; E52-M54 PolarHBondContact O-N 3.37Å; M54-E56 PolarHBondContact O-N 3.41Å; M54-A57 PolarHBondContact O-N 3.37Å; M54-A57 VanDerWaalsContact O-N 3.16Å; M54-E58 WeakPolarHBondContact O-CB 3.37Å; M54-E58 WeakPolarHBondContact O-CG 3.34Å; M54-E58 PolarHBondContact O-N 3.45Å
55R49.7Very low45.7Very low171 Ų171128.6 Ų128.665%0.64567%0.673SS**Hα-helixtrans-63.6-39.2-179.2-80.4173.7178176.6-1.3112.9P51 E52 A57 E58 D59P51-R55 WeakPolarHBondContact O-CD 3.48Å; P51-R55 VanDerWaalsContact O-CG 3.27Å; P51-R55 WeakPolarHBondContact O-CG 3.36Å; P51-R55 PolarHBondContact O-N 3.3Å; E52-R55 PolarHBondContact O-N 3.35Å; R55-A57 VanDerWaalsContact C-N 3.29Å; R55-A57 PolarHBondContact O-N 2.98Å; R55-E58 PolarHBondContact O-N 2.99Å; R55-D59 WeakPolarHBondContact O-CB 3.48Å; R55-D59 PolarHBondContact O-N 3.2Å
56E43.5Very low46Very low156 Ų156131.6 Ų131.673%0.72968%0.677SS**Hα-helixtrans-69.8-25.5176-66.8-173170.600113.4E52 M54E52-E56 PolarHBondContact O-N 3.48Å; M54-E56 PolarHBondContact O-N 3.41Å
57A51.1Low46.5Very low57 Ų57133.4 Ų133.447%0.47168%0.682SS.*Hα-helixtrans-83.1-26.4174.800000112.8M54 R55 L61M54-A57 PolarHBondContact O-N 3.37Å; M54-A57 VanDerWaalsContact O-N 3.16Å; R55-A57 VanDerWaalsContact C-N 3.29Å; R55-A57 PolarHBondContact O-N 2.98Å; A57-L61 WeakPolarHBondContact O-CD1 3.47Å; A57-L61 WeakPolarHBondContact O-CG 3.43Å
58E47.5Very low47Very low131 Ų131135.9 Ų135.961%0.61267%0.674SS**Hα-helixtrans-84.6-33.9178.2-61.3-103.9144.200111.8M54 R55 L61 S62M54-E58 WeakPolarHBondContact O-CB 3.37Å; M54-E58 WeakPolarHBondContact O-CG 3.34Å; M54-E58 PolarHBondContact O-N 3.45Å; R55-E58 PolarHBondContact O-N 2.99Å; E58-L61 PolarHBondContact O-N 2.92Å; E58-S62 PolarHBondContact O-N 3.38Å; E58-S62 VanDerWaalsContact O-N 3.1Å
59D46.8Very low47.6Very low116 Ų116136.9 Ų136.962%0.6268%0.678SS**Hα-helixtrans-70.2-32.4178.5-96.5-9.1000113.5R55 L61 S62R55-D59 WeakPolarHBondContact O-CB 3.48Å; R55-D59 PolarHBondContact O-N 3.2Å; D59-L61 PolarHBondContact O-N 3.2Å; D59-S62 PolarHBondContact O-OG 3.42Å; D59-S62 VanDerWaalsContact O-OG 3.13Å
60D46.2Very low47.4Very low129 Ų129140.4 Ų140.469%0.6968%0.682SS**Hα-helixtrans-78.9-5.8175.4-159.145000112.5
61L48.9Very low47.6Very low92 Ų92141 Ų14148%0.48269%0.685SS.*Hα-helixtrans-100.6-26.6174-67176.8000112.7A57 E58 D59A57-L61 WeakPolarHBondContact O-CD1 3.47Å; A57-L61 WeakPolarHBondContact O-CG 3.43Å; E58-L61 PolarHBondContact O-N 2.92Å; D59-L61 PolarHBondContact O-N 3.2Å
62S43.8Very low47.3Very low72 Ų72144 Ų14450%0.50370%0.697SS.*Hα-helixtrans-75.4-33.4-179.768.10000112.8E58 D59 R64E58-S62 PolarHBondContact O-N 3.38Å; E58-S62 VanDerWaalsContact O-N 3.1Å; D59-S62 PolarHBondContact O-OG 3.42Å; D59-S62 VanDerWaalsContact O-OG 3.13Å; S62-R64 PolarHBondContact O-N 2.95Å
63D45.6Very low46.9Very low144 Ų144145.2 Ų145.277%0.7770%0.703SS**THydrogen-bonded Turntrans-78.411.5-175.9-149.627.7000114.4
64R49.6Very low46.8Very low191 Ų191144.4 Ų144.472%0.72170%0.701SS**THydrogen-bonded Turntrans-134.41-178-148.2177.7-179.4158.84.4115.2S62 E66S62-R64 PolarHBondContact O-N 2.95Å; R64-E66 VanDerWaalsContact C-N 3.29Å
65E46.4Very low47Very low141 Ų141147 Ų14766%0.65971%0.712SS**THydrogen-bonded Turntrans-84.2-1.4173.9-60.7-148.4149.300113.2K91E65-K91 IonicContact OE1-NZ 3.64Å; E65-K91 PolarHBondContact OE1-NZ 3.23Å
66E44.6Very low47.1Very low184 Ų184145.6 Ų145.686%0.8672%0.717SS**THydrogen-bonded Turntrans-87.1-9.3178.5-74-166.5157.100115.5R64R64-E66 VanDerWaalsContact C-N 3.29Å
67D46.7Very low47.4Very low155 Ų155142.1 Ų142.183%0.82972%0.724SS**SBendtrans-100.516.4-169.1-118.72.3000115.4
68E51.8Low47.3Very low164 Ų164146.9 Ų146.977%0.76674%0.74SS**  trans-124.652.1179.4-68.9-159.9160.600114.5
69R53.1Low47.3Very low239 Ų239149.8 Ų149.890%0.90275%0.754SS**  trans-144.871.6157-65-161.8-141.3-112.26.9113.4
70E44.3Very low47.5Very low187 Ų187151.8 Ų151.887%0.87476%0.757SS**  trans-118.788.6147.6-77-172163.900107.8D72E70-D72 PolarHBondContact O-N 3.1Å
71D43.4Very low47.9Very low129 Ų129156 Ų15669%0.6977%0.769SS**  trans-73.498.7163.4-16832.9000106.2Q73D71-Q73 PolarHBondContact O-N 2.78Å; D71-Q73 PolarHBondContact OD2-NE2 3.23Å
72D45.5Very low48.3Very low143 Ų143159.8 Ų159.877%0.76578%0.777SS**  trans-63.878.7169.4-80.4-43.5000108.9E70 D74E70-D72 PolarHBondContact O-N 3.1Å; D72-D74 VanDerWaalsContact C-N 3.34Å; D72-D74 PolarHBondContact O-N 3.49Å
73Q40.8Very low49.6Very low163 Ų163159.1 Ų159.176%0.76278%0.781SS**  trans-7889.5161.3-77-178.448.900108.2D71 E75D71-Q73 PolarHBondContact O-N 2.78Å; D71-Q73 PolarHBondContact OD2-NE2 3.23Å; Q73-E75 PolarHBondContact O-N 3.31Å
74D42.9Very low50.5Low137 Ų137158.9 Ų158.973%0.73379%0.788SS**  trans-68.2114.5160.5-104.8-21.1000108D72 N76D72-D74 VanDerWaalsContact C-N 3.34Å; D72-D74 PolarHBondContact O-N 3.49Å; D74-N76 PolarHBondContact O-N 3.45Å
75E54.8Low51.2Low187 Ų187159.3 Ų159.387%0.87479%0.789SS**SBendtrans-68.667.2166.1-166.4-169.5-167.500109.2Q73Q73-E75 PolarHBondContact O-N 3.31Å
76N51.6Low52.2Low140 Ų140162.2 Ų162.275%0.74980%0.8SS**SBendtrans178103158-92.6-21.7000109.2D74 L78D74-N76 PolarHBondContact O-N 3.45Å; N76-L78 VanDerWaalsContact C-N 3.32Å; N76-L78 PolarHBondContact O-N 3.09Å
77G49.7Very low53.6Low84 Ų84162.9 Ų162.987%0.86680%0.8SS**  trans-62.969.3-169.100000117.2
78L49.5Very low54.8Low156 Ų156165.7 Ų165.782%0.81780%0.799SS**  trans-119.8106.7169.4-71.2171.2000111.1N76 K80N76-L78 VanDerWaalsContact C-N 3.32Å; N76-L78 PolarHBondContact O-N 3.09Å; L78-K80 PolarHBondContact O-N 3.47Å
79Q47.2Very low55.9Low192 Ų192161.5 Ų161.590%0.89779%0.786SS**  trans-65.799.3176.4-58.6178.7-200110.1K81Q79-K81 PolarHBondContact O-N 3.38Å; Q79-K81 VanDerWaalsContact O-N 3.1Å
80K50.4Low57.5Low159 Ų159152.3 Ų152.369%0.69177%0.765SS**  trans-63.7111.9168.7-75.9172.7-179.3161.20108.7L78 R82L78-K80 PolarHBondContact O-N 3.47Å; K80-R82 PolarHBondContact O-N 3.29Å
81K55.7Low59.4Low217 Ų217150.2 Ų150.294%0.94375%0.753SS**  trans-59.193.3169.9-71.3-178.3177.7178.30109.4Q79Q79-K81 PolarHBondContact O-N 3.38Å; Q79-K81 VanDerWaalsContact O-N 3.1Å
82R56.9Low61.4Low172 Ų172152.3 Ų152.365%0.64976%0.759SS**  trans-89.2135.4173.2-65.6-176.3-179-169.36.6108.4K80K80-R82 PolarHBondContact O-N 3.29Å
83G70Confident63.5Low57 Ų57151.7 Ų151.759%0.58875%0.751SS**SBendtrans-56.3179.6177.300000113.5R85G83-R85 PolarHBondContact O-N 3.16Å
84P65.7Low65.9Low140 Ų140146.3 Ų146.391%0.90973%0.73SS**  trans-50101.1-167.6-24.231.9000111.8K86P84-K86 PolarHBondContact O-N 3.24Å
85R64.1Low68.3Low200 Ų200142.8 Ų142.876%0.75571%0.711SS**  trans-63.8107.1178.2-90.5-177.1157.1170.9-6106.8G83 K87G83-R85 PolarHBondContact O-N 3.16Å; R85-K87 PolarHBondContact O-N 3.45Å
86K67.9Low70.2Confident201 Ų201141.7 Ų141.787%0.87470%0.699SS**  trans-56.3106168.9-166.5176.9-176.8-179.20106.5P84 R88P84-K86 PolarHBondContact O-N 3.24Å; K86-R88 PolarHBondContact O-N 3.27Å
87K73.7Confident72.2Confident198 Ų198137.8 Ų137.886%0.86169%0.686SS**PPolyproline II helixtrans-55.4124.4-179.7-71.8-174.9177-176.90107.8R85R85-K87 PolarHBondContact O-N 3.45Å
88R72.5Confident74.4Confident215 Ų215137.2 Ų137.281%0.81166%0.659SS**PPolyproline II helixtrans-59.7135.6172.6-69-173.3176-172.6-0.1107.6K86 G90K86-R88 PolarHBondContact O-N 3.27Å; R88-G90 PolarHBondContact O-N 3.2Å
89P73.9Confident76.6Confident76 Ų76135 Ų13549%0.49465%0.648SS.*PPolyproline II helixtrans-59.4135.6177.526.6-34.2000109.2Q93 V94P89-Q93 HydrophobicContact CB-CB 4.42Å; P89-Q93 HydrophobicContact CB-CG 4.49Å; P89-V94 HydrophobicContact CB-CG2 3.99Å; P89-V94 HydrophobicContact CG-CG2 3.81Å
90G86.3Confident79Confident46 Ų46132.9 Ų132.947%0.47463%0.632SS.*PPolyproline II helixtrans-64.5153.3177.500000111.6R88 E92 Q93 V94R88-G90 PolarHBondContact O-N 3.2Å; G90-E92 PolarHBondContact O-N 3.18Å; G90-E92 VanDerWaalsContact O-N 3.15Å; G90-Q93 WeakPolarHBondContact O-CA 3.2Å; G90-Q93 WeakPolarHBondContact O-CB 3.29Å; G90-Q93 PolarHBondContact O-N 3.4Å; G90-V94 PolarHBondContact O-N 3.27Å; G90-V94 VanDerWaalsContact O-N 3.14Å
91K85.2Confident81.3Confident142 Ų142134 Ų13462%0.61763%0.632SS**Hα-helixtrans-46.5-46.4-177.9-164.9169.4-178.5174.30111.8E65 Q93 V94 D95E65-K91 IonicContact OE1-NZ 3.64Å; E65-K91 PolarHBondContact OE1-NZ 3.23Å; K91-Q93 PolarHBondContact O-N 3.36Å; K91-V94 WeakPolarHBondContact O-CB 3.37Å; K91-V94 PolarHBondContact O-N 2.97Å; K91-V94 VanDerWaalsContact O-N 3.12Å; K91-D95 VanDerWaalsContact O-CG 3.31Å; K91-D95 PolarHBondContact O-N 3.27Å
92E85.9Confident83.3Confident174 Ų174129.3 Ų129.381%0.81361%0.613SS**Hα-helixtrans-59.5-38.5176.2-61.7179.5175.500114.7G90 V94 D95 R96G90-E92 PolarHBondContact O-N 3.18Å; G90-E92 VanDerWaalsContact O-N 3.15Å; E92-V94 VanDerWaalsContact C-N 3.34Å; E92-D95 PolarHBondContact O-N 3.07Å; E92-R96 WeakPolarHBondContact O-CB 3.27Å; E92-R96 PolarHBondContact O-N 3.47Å
93Q88.3Confident85.3Confident129 Ų129126.1 Ų126.160%0.60361%0.605SS**Hα-helixtrans-69.8-37.7178.4-171.2-179.847.500110.7P89 G90 K91 A97P89-Q93 HydrophobicContact CB-CB 4.42Å; P89-Q93 HydrophobicContact CB-CG 4.49Å; G90-Q93 WeakPolarHBondContact O-CA 3.2Å; G90-Q93 WeakPolarHBondContact O-CB 3.29Å; G90-Q93 PolarHBondContact O-N 3.4Å; K91-Q93 PolarHBondContact O-N 3.36Å; Q93-A97 WeakPolarHBondContact O-CB 3.4Å; Q93-A97 PolarHBondContact O-N 2.9Å; Q93-A97 VanDerWaalsContact O-N 3.1Å
94V91.6Very high86.6Confident51 Ų51125.6 Ų125.631%0.30960%0.596SS.*Hα-helixtrans-65.8-45.5175.3178.10000110.2P89 G90 K91 E92 R96 A97 K98P89-V94 HydrophobicContact CB-CG2 3.99Å; P89-V94 HydrophobicContact CG-CG2 3.81Å; G90-V94 PolarHBondContact O-N 3.27Å; G90-V94 VanDerWaalsContact O-N 3.14Å; K91-V94 WeakPolarHBondContact O-CB 3.37Å; K91-V94 PolarHBondContact O-N 2.97Å; K91-V94 VanDerWaalsContact O-N 3.12Å; E92-V94 VanDerWaalsContact C-N 3.34Å; V94-R96 PolarHBondContact O-N 2.85Å; V94-A97 WeakPolarHBondContact O-CB 3.44Å; V94-A97 PolarHBondContact O-N 3.47Å; V94-A97 VanDerWaalsContact O-N 3.12Å; V94-K98 WeakPolarHBondContact O-CG 3.49Å; V94-K98 PolarHBondContact O-N 3.06Å
95D93.3Very high88.2Confident63 Ų63122.8 Ų122.834%0.33757%0.573SS.*Hα-helixtrans-66.8-39.2-179.5-64.5-28.8000112.2K91 E92 A97 K98 L99K91-D95 VanDerWaalsContact O-CG 3.31Å; K91-D95 PolarHBondContact O-N 3.27Å; E92-D95 PolarHBondContact O-N 3.07Å; D95-A97 VanDerWaalsContact C-N 3.29Å; D95-A97 PolarHBondContact O-N 3.31Å; D95-K98 WeakPolarHBondContact O-CB 3.26Å; D95-K98 PolarHBondContact O-N 2.98Å; D95-K98 IonicContact OD1-NZ 3.69Å; D95-K98 PolarHBondContact OD1-NZ 2.84Å; D95-L99 PolarHBondContact O-N 2.98Å
96R94Very high89.8Confident164 Ų164115 Ų11562%0.61955%0.551SS**Hα-helixtrans-61.8-37.1171.4-170.1178.6-174.7-1672112.3E92 V94 R100E92-R96 WeakPolarHBondContact O-CB 3.27Å; E92-R96 PolarHBondContact O-N 3.47Å; V94-R96 PolarHBondContact O-N 2.85Å; R96-R100 WeakPolarHBondContact O-CG 3.43Å; R96-R100 PolarHBondContact O-N 2.9Å; R96-R100 VanDerWaalsContact O-N 3.14Å
97A94.8Very high91.3Very high58 Ų58112.5 Ų112.548%0.47954%0.536SS..Hα-helixtrans-68.9-40.617600000111.8Q93 V94 D95 R100 R101Q93-A97 WeakPolarHBondContact O-CB 3.4Å; Q93-A97 PolarHBondContact O-N 2.9Å; Q93-A97 VanDerWaalsContact O-N 3.1Å; V94-A97 WeakPolarHBondContact O-CB 3.44Å; V94-A97 PolarHBondContact O-N 3.47Å; V94-A97 VanDerWaalsContact O-N 3.12Å; D95-A97 VanDerWaalsContact C-N 3.29Å; D95-A97 PolarHBondContact O-N 3.31Å; A97-R100 PolarHBondContact O-N 3.26Å; A97-R101 PolarHBondContact O-N 2.91Å
98K95.9Very high92.5Very high71 Ų71107.1 Ų107.131%0.30951%0.514SS..Hα-helixtrans-58.8-47.8172.8-70.5175.5-178.6171.60111.2V94 D95 R100 R101 Q102V94-K98 WeakPolarHBondContact O-CG 3.49Å; V94-K98 PolarHBondContact O-N 3.06Å; D95-K98 WeakPolarHBondContact O-CB 3.26Å; D95-K98 PolarHBondContact O-N 2.98Å; D95-K98 IonicContact OD1-NZ 3.69Å; D95-K98 PolarHBondContact OD1-NZ 2.84Å; K98-R100 PolarHBondContact O-N 3.16Å; K98-R101 WeakPolarHBondContact O-CB 3.41Å; K98-R101 PolarHBondContact O-N 3.17Å; K98-R101 VanDerWaalsContact O-N 3.09Å; K98-Q102 WeakPolarHBondContact O-CG 3.45Å; K98-Q102 PolarHBondContact O-N 2.97Å
99L96.3Very high93.7Very high109 Ų109104 Ų10457%0.57150%0.503SS*.Hα-helixtrans-59-46179-175.865.9000111.9D95 R101 Q102 E103D95-L99 PolarHBondContact O-N 2.98Å; L99-R101 VanDerWaalsContact C-N 3.29Å; L99-R101 PolarHBondContact O-N 3.43Å; L99-Q102 PolarHBondContact O-N 3.35Å; L99-E103 PolarHBondContact O-N 2.96Å
100R97.6Very high94.9Very high149 Ų149104.3 Ų104.356%0.56251%0.506SS*.Hα-helixtrans-60.2-38.8175.5-73.2176.6177.3-150.8-0.5112.4R96 A97 K98 A104R96-R100 WeakPolarHBondContact O-CG 3.43Å; R96-R100 PolarHBondContact O-N 2.9Å; R96-R100 VanDerWaalsContact O-N 3.14Å; A97-R100 PolarHBondContact O-N 3.26Å; K98-R100 PolarHBondContact O-N 3.16Å; R100-A104 WeakPolarHBondContact O-CB 3.28Å; R100-A104 PolarHBondContact O-N 3.23Å
101R98.1Very high95.5Very high182 Ų182109.3 Ų109.369%0.68751%0.511SS*.Hα-helixtrans-66.8-43.2176.5-174.1177.9-178.7-179.6-2.2111.4A97 K98 L99 A104 N105A97-R101 PolarHBondContact O-N 2.91Å; K98-R101 WeakPolarHBondContact O-CB 3.41Å; K98-R101 PolarHBondContact O-N 3.17Å; K98-R101 VanDerWaalsContact O-N 3.09Å; L99-R101 VanDerWaalsContact C-N 3.29Å; L99-R101 PolarHBondContact O-N 3.43Å; R101-A104 PolarHBondContact O-N 3.05Å; R101-N105 WeakPolarHBondContact O-CB 3.47Å; R101-N105 PolarHBondContact O-N 3.34Å; R101-N105 PolarHBondContact O-OD1 3.28Å
102Q97.8Very high96.1Very high119 Ų119105.5 Ų105.556%0.55650%0.496SS*.Hα-helixtrans-61.2-44.6176.3-72173.7-6.200111.5K98 L99 N105 A106K98-Q102 WeakPolarHBondContact O-CG 3.45Å; K98-Q102 PolarHBondContact O-N 2.97Å; L99-Q102 PolarHBondContact O-N 3.35Å; Q102-N105 PolarHBondContact O-N 3.03Å; Q102-A106 PolarHBondContact O-N 3.45Å
103E98.1Very high96.7Very high104 Ų104103.2 Ų103.249%0.48649%0.485SS..Hα-helixtrans-62.2-44.6176.7-165-170.1171.400111.6L99 N105 A106 R107L99-E103 PolarHBondContact O-N 2.96Å; E103-N105 VanDerWaalsContact C-N 3.35Å; E103-N105 PolarHBondContact O-N 3.16Å; E103-A106 PolarHBondContact O-N 3.28Å; E103-R107 WeakPolarHBondContact O-CG 3.49Å; E103-R107 PolarHBondContact O-N 3.01Å; E103-R107 IonicContact OE1-CZ 2.93Å; E103-R107 IonicContact OE1-NE 3.71Å; E103-R107 IonicContact OE1-NH2 2.81Å; E103-R107 PolarHBondContact OE1-NH2 3.08Å; E103-R107 IonicContact OE2-NH2 3.84Å; E103-R107 PolarHBondContact OE2-NH2 3.24Å
104A98.2Very high97.2Very high46 Ų4699.1 Ų99.138%0.3848%0.478SS..Hα-helixtrans-60.6-42.917500000112.2R100 R101 A106 R107 E108R100-A104 WeakPolarHBondContact O-CB 3.28Å; R100-A104 PolarHBondContact O-N 3.23Å; R101-A104 PolarHBondContact O-N 3.05Å; A104-A106 VanDerWaalsContact C-N 3.34Å; A104-A106 PolarHBondContact O-N 2.98Å; A104-R107 PolarHBondContact O-N 3.37Å; A104-E108 PolarHBondContact O-N 3.33Å
105N98.6Very high97.5Very high81 Ų81100.6 Ų100.643%0.43348%0.484SS..Hα-helixtrans-63.8-39.1176.3-71.6-10.6000112R101 Q102 E103 E108 R109R101-N105 WeakPolarHBondContact O-CB 3.47Å; R101-N105 PolarHBondContact O-N 3.34Å; R101-N105 PolarHBondContact O-OD1 3.28Å; Q102-N105 PolarHBondContact O-N 3.03Å; E103-N105 VanDerWaalsContact C-N 3.35Å; E103-N105 PolarHBondContact O-N 3.16Å; N105-E108 PolarHBondContact O-N 3.35Å; N105-R109 WeakPolarHBondContact O-CG 3.47Å; N105-R109 PolarHBondContact O-N 2.89Å
106A98.4Very high97.7Very high36 Ų36100.5 Ų100.530%0.29848%0.483SS..Hα-helixtrans-62.9-44.5175.700000111.3Q102 E103 A104 E108 R109 S110Q102-A106 PolarHBondContact O-N 3.45Å; E103-A106 PolarHBondContact O-N 3.28Å; A104-A106 VanDerWaalsContact C-N 3.34Å; A104-A106 PolarHBondContact O-N 2.98Å; A106-E108 PolarHBondContact O-N 3.38Å; A106-R109 WeakPolarHBondContact O-CB 3.46Å; A106-R109 PolarHBondContact O-N 3.3Å; A106-S110 PolarHBondContact O-N 3.08Å; A106-S110 PolarHBondContact O-OG 3.13Å
107R98.5Very high97.9Very high149 Ų14995.3 Ų95.356%0.56248%0.475SS*.Hα-helixtrans-61.5-42.6175.5-65.9-176.8-149140.8-3.9112.3E103 A104 R109 S110 R111E103-R107 WeakPolarHBondContact O-CG 3.49Å; E103-R107 PolarHBondContact O-N 3.01Å; E103-R107 IonicContact OE1-CZ 2.93Å; E103-R107 IonicContact OE1-NE 3.71Å; E103-R107 IonicContact OE1-NH2 2.81Å; E103-R107 PolarHBondContact OE1-NH2 3.08Å; E103-R107 IonicContact OE2-NH2 3.84Å; E103-R107 PolarHBondContact OE2-NH2 3.24Å; A104-R107 PolarHBondContact O-N 3.37Å; R107-R109 VanDerWaalsContact C-N 3.34Å; R107-R109 PolarHBondContact O-N 3.42Å; R107-S110 PolarHBondContact O-N 3.37Å; R107-R111 PolarHBondContact O-N 3.17Å
108E98.6Very high98.1Very high86 Ų8695.6 Ų95.640%0.40248%0.477SS..Hα-helixtrans-66.1-37.9178.4-176.955.6-157.900111.8A104 N105 A106 R111 M112A104-E108 PolarHBondContact O-N 3.33Å; N105-E108 PolarHBondContact O-N 3.35Å; A106-E108 PolarHBondContact O-N 3.38Å; E108-R111 PolarHBondContact O-N 2.9Å; E108-R111 IonicContact OE1-CZ 3.54Å; E108-R111 IonicContact OE1-NH1 3.17Å; E108-R111 PolarHBondContact OE1-NH1 3.32Å; E108-R111 WeakPolarHBondContact OE2-CD 3.26Å; E108-R111 IonicContact OE2-NH1 2.67Å; E108-R111 PolarHBondContact OE2-NH1 3.39Å; E108-M112 WeakPolarHBondContact O-CB 3.25Å; E108-M112 WeakPolarHBondContact O-CG 3.46Å; E108-M112 PolarHBondContact O-N 3.32Å
109R98.6Very high98.2Very high150 Ų15093 Ų9357%0.56647%0.467SS*.Hα-helixtrans-58.2-48.8171-78.2-175.8-91.6122.4-10.6111.3N105 A106 R107 R111 M112 H113N105-R109 WeakPolarHBondContact O-CG 3.47Å; N105-R109 PolarHBondContact O-N 2.89Å; A106-R109 WeakPolarHBondContact O-CB 3.46Å; A106-R109 PolarHBondContact O-N 3.3Å; R107-R109 VanDerWaalsContact C-N 3.34Å; R107-R109 PolarHBondContact O-N 3.42Å; R109-R111 VanDerWaalsContact C-N 3.34Å; R109-R111 PolarHBondContact O-N 3.37Å; R109-M112 PolarHBondContact O-N 2.69Å; R109-H113 PolarHBondContact O-CD2 3.3Å; R109-H113 PolarHBondContact O-N 3.44Å
110S98.6Very high98.3Very high81 Ų8189.4 Ų89.457%0.56645%0.447SS*.Hα-helixtrans-59-43176.4-620000112.6A106 R107 M112 H113 G114A106-S110 PolarHBondContact O-N 3.08Å; A106-S110 PolarHBondContact O-OG 3.13Å; R107-S110 PolarHBondContact O-N 3.37Å; S110-M112 PolarHBondContact O-N 3.27Å; S110-H113 PolarHBondContact O-N 2.94Å; S110-G114 PolarHBondContact O-N 3.07Å; S110-G114 VanDerWaalsContact O-N 3.1Å
111R98.7Very high98.3Very high151 Ų15185.5 Ų85.557%0.5744%0.442SS*.Hα-helixtrans-59.8-45.7174.7179.9-179.5163.5-85.7-5.4111.6R107 E108 R109 G114 L115R107-R111 PolarHBondContact O-N 3.17Å; E108-R111 PolarHBondContact O-N 2.9Å; E108-R111 IonicContact OE1-CZ 3.54Å; E108-R111 IonicContact OE1-NH1 3.17Å; E108-R111 PolarHBondContact OE1-NH1 3.32Å; E108-R111 WeakPolarHBondContact OE2-CD 3.26Å; E108-R111 IonicContact OE2-NH1 2.67Å; E108-R111 PolarHBondContact OE2-NH1 3.39Å; R109-R111 VanDerWaalsContact C-N 3.34Å; R109-R111 PolarHBondContact O-N 3.37Å; R111-G114 PolarHBondContact O-N 2.73Å; R111-L115 PolarHBondContact O-N 3.48Å; R111-L115 VanDerWaalsContact O-N 3.07Å
112M98.6Very high98.3Very high62 Ų6279.3 Ų79.331%0.30542%0.423SS..Hα-helixtrans-66.8-34.9178.5-74.2-56.4-58.100113E108 R109 S110 L115 N116E108-M112 WeakPolarHBondContact O-CB 3.25Å; E108-M112 WeakPolarHBondContact O-CG 3.46Å; E108-M112 PolarHBondContact O-N 3.32Å; R109-M112 PolarHBondContact O-N 2.69Å; S110-M112 PolarHBondContact O-N 3.27Å; M112-L115 PolarHBondContact O-N 3.33Å; M112-N116 WeakPolarHBondContact O-CB 3.21Å; M112-N116 VanDerWaalsContact O-CG 3.32Å; M112-N116 PolarHBondContact O-N 3.07Å; M112-N116 PolarHBondContact O-ND2 3.42Å
113H98.4Very high98.3Very high126 Ų12675.4 Ų75.458%0.58340%0.403SS*.Hα-helixtrans-61.1-43.6171.1-72.4-58.2000111.6R109 S110 L115 N116 A117R109-H113 PolarHBondContact O-CD2 3.3Å; R109-H113 PolarHBondContact O-N 3.44Å; S110-H113 PolarHBondContact O-N 2.94Å; H113-L115 PolarHBondContact O-N 3.1Å; H113-N116 PolarHBondContact O-N 3.49Å; H113-A117 WeakPolarHBondContact O-CB 3.42Å; H113-A117 PolarHBondContact O-N 3.38Å
114G98.4Very high98.2Very high44 Ų4476.3 Ų76.345%0.45441%0.405SS..Hα-helixtrans-59.3-45.4174.600000113S110 R111 A117 A118S110-G114 PolarHBondContact O-N 3.07Å; S110-G114 VanDerWaalsContact O-N 3.1Å; R111-G114 PolarHBondContact O-N 2.73Å; G114-A117 PolarHBondContact O-N 3.42Å; G114-A118 PolarHBondContact O-N 2.93Å
115L98.4Very high98.1Very high82 Ų8278.9 Ų78.943%0.42942%0.416SS..Hα-helixtrans-62.1-46176.8-173.9157.4000111.9R111 M112 H113 A117 A118 L119R111-L115 PolarHBondContact O-N 3.48Å; R111-L115 VanDerWaalsContact O-N 3.07Å; M112-L115 PolarHBondContact O-N 3.33Å; H113-L115 PolarHBondContact O-N 3.1Å; L115-A117 VanDerWaalsContact C-N 3.3Å; L115-A117 PolarHBondContact O-N 3.31Å; L115-A118 PolarHBondContact O-N 3Å; L115-L119 PolarHBondContact O-N 3.03Å
116N98.3Very high97.9Very high60 Ų6075.4 Ų75.432%0.32140%0.398SS..Hα-helixtrans-65.7-34.4179.4-71-34.6000111.8M112 H113 L119 E120 K137M112-N116 WeakPolarHBondContact O-CB 3.21Å; M112-N116 VanDerWaalsContact O-CG 3.32Å; M112-N116 PolarHBondContact O-N 3.07Å; M112-N116 PolarHBondContact O-ND2 3.42Å; H113-N116 PolarHBondContact O-N 3.49Å; N116-L119 PolarHBondContact O-N 3.5Å; N116-E120 PolarHBondContact O-N 3.25Å; N116-K137 PolarHBondContact OD1-NZ 3.34Å; N116-K137 VanDerWaalsContact OD1-NZ 3.07Å
117A98.3Very high97.6Very high56 Ų5674.8 Ų74.846%0.46339%0.391SS..Hα-helixtrans-66-40.4173.600000112.3H113 G114 L115 E120 S121H113-A117 WeakPolarHBondContact O-CB 3.42Å; H113-A117 PolarHBondContact O-N 3.38Å; G114-A117 PolarHBondContact O-N 3.42Å; L115-A117 VanDerWaalsContact C-N 3.3Å; L115-A117 PolarHBondContact O-N 3.31Å; A117-E120 PolarHBondContact O-N 3.46Å; A117-S121 PolarHBondContact O-N 3.44Å; A117-S121 PolarHBondContact O-OG 3.13Å
118A98.6Very high97Very high63 Ų6368.6 Ų68.652%0.52137%0.37SS..Hα-helixtrans-63.7-43.4173.400000111.7G114 L115 E120 S121 L122G114-A118 PolarHBondContact O-N 2.93Å; L115-A118 PolarHBondContact O-N 3Å; A118-E120 VanDerWaalsContact C-N 3.32Å; A118-E120 PolarHBondContact O-N 3.19Å; A118-S121 WeakPolarHBondContact O-CB 3.29Å; A118-S121 PolarHBondContact O-N 2.94Å; A118-S121 VanDerWaalsContact O-N 3.17Å; A118-L122 PolarHBondContact O-N 3.24Å
119L98.4Very high96.5Very high18 Ų1868.7 Ų68.79%0.09437%0.368CS..Hα-helixtrans-61.8-39.6175.3-177.868.2000112L115 N116 S121 L122 R123 K137 T140L115-L119 PolarHBondContact O-N 3.03Å; N116-L119 PolarHBondContact O-N 3.5Å; L119-S121 VanDerWaalsContact C-N 3.32Å; L119-L122 HydrophobicContact CD1-CD2 4.4Å; L119-L122 WeakPolarHBondContact O-CB 3.46Å; L119-L122 PolarHBondContact O-N 3.01Å; L119-R123 WeakPolarHBondContact O-CG 3.45Å; L119-R123 PolarHBondContact O-N 3.47Å; L119-K137 HydrophobicContact CD2-CB 4.11Å; L119-K137 HydrophobicContact CD2-CD 4.08Å; L119-K137 HydrophobicContact CD2-CG 3.63Å; L119-T140 HydrophobicContact CD1-CG2 3.92Å
120E97.3Very high96Very high33 Ų3363 Ų6315%0.15435%0.351CS..Hα-helixtrans-65.7-37.3175.5-168.664.1-159.500111.9N116 A117 A118 L122 R123 K124 K134N116-E120 PolarHBondContact O-N 3.25Å; A117-E120 PolarHBondContact O-N 3.46Å; A118-E120 VanDerWaalsContact C-N 3.32Å; A118-E120 PolarHBondContact O-N 3.19Å; E120-L122 VanDerWaalsContact C-N 3.33Å; E120-R123 WeakPolarHBondContact O-CB 3.44Å; E120-R123 PolarHBondContact O-N 3.48Å; E120-R123 IonicContact OE2-CZ 2.98Å; E120-R123 IonicContact OE2-NH1 3.02Å; E120-R123 PolarHBondContact OE2-NH1 2.96Å; E120-K124 PolarHBondContact O-N 2.87Å; E120-K134 VanDerWaalsContact OE1-CE 3.26Å; E120-K134 WeakPolarHBondContact OE1-CE 3.49Å; E120-K134 IonicContact OE1-NZ 2.76Å; E120-K134 PolarHBondContact OE1-NZ 3.38Å; E120-K134 IonicContact OE2-NZ 3.47Å; E120-K134 PolarHBondContact OE2-NZ 3.27Å
121S97.8Very high95.3Very high66 Ų6667.7 Ų67.746%0.46236%0.361SS..Hα-helixtrans-64.8-39.4173.5-57.30000111.4A117 A118 L119 R123 K124A117-S121 PolarHBondContact O-N 3.44Å; A117-S121 PolarHBondContact O-OG 3.13Å; A118-S121 WeakPolarHBondContact O-CB 3.29Å; A118-S121 PolarHBondContact O-N 2.94Å; A118-S121 VanDerWaalsContact O-N 3.17Å; L119-S121 VanDerWaalsContact C-N 3.32Å; S121-R123 PolarHBondContact O-N 2.89Å; S121-K124 WeakPolarHBondContact O-CB 3.35Å; S121-K124 PolarHBondContact O-N 3.43Å
122L98.4Very high94.8Very high53 Ų5367 Ų6728%0.27737%0.374SS..Hα-helixtrans-60.3-44172.2-179.862.1000111.6A118 L119 E120 K124 V125 V126 T140 L141 A144A118-L122 PolarHBondContact O-N 3.24Å; L119-L122 HydrophobicContact CD1-CD2 4.4Å; L119-L122 WeakPolarHBondContact O-CB 3.46Å; L119-L122 PolarHBondContact O-N 3.01Å; E120-L122 VanDerWaalsContact C-N 3.33Å; L122-K124 PolarHBondContact O-N 2.89Å; L122-K124 VanDerWaalsContact O-N 3.16Å; L122-V125 HydrophobicContact CD1-CG2 4.09Å; L122-V125 WeakPolarHBondContact O-CG2 3.47Å; L122-V125 PolarHBondContact O-N 3.32Å; L122-V125 VanDerWaalsContact O-N 3.09Å; L122-V126 HydrophobicContact CD1-CG2 3.88Å; L122-V126 HydrophobicContact CG-CG2 4.03Å; L122-V126 VanDerWaalsContact O-CG2 3.28Å; L122-V126 WeakPolarHBondContact O-CG2 3.39Å; L122-V126 PolarHBondContact O-N 3.41Å; L122-V126 VanDerWaalsContact O-N 3.16Å; L122-T140 HydrophobicContact CD2-CG2 4.06Å; L122-T140 HydrophobicContact CG-CG2 4.13Å; L122-L141 HydrophobicContact CD2-CD2 4.11Å; L122-A144 HydrophobicContact CD1-CB 4.04Å; L122-A144 HydrophobicContact CD2-CB 4.12Å; L122-A144 HydrophobicContact CG-CB 4.37Å
123R97.3Very high94.3Very high36 Ų3669.6 Ų69.614%0.13639%0.385CS..Hα-helixtrans-55.7-34.6177.5-72.4-176.9-177.61112.4113L119 E120 S121 V125 Y129 L135 T140L119-R123 WeakPolarHBondContact O-CG 3.45Å; L119-R123 PolarHBondContact O-N 3.47Å; E120-R123 WeakPolarHBondContact O-CB 3.44Å; E120-R123 PolarHBondContact O-N 3.48Å; E120-R123 IonicContact OE2-CZ 2.98Å; E120-R123 IonicContact OE2-NH1 3.02Å; E120-R123 PolarHBondContact OE2-NH1 2.96Å; S121-R123 PolarHBondContact O-N 2.89Å; R123-V125 VanDerWaalsContact C-N 3.3Å; R123-V125 PolarHBondContact O-N 3.29Å; R123-Y129 HydrophobicContact CB-CD2 4.07Å; R123-Y129 HydrophobicContact CB-CE2 4.25Å; R123-Y129 WeakPolarHBondContact O-CB 3.43Å; R123-Y129 WeakPolarHBondContact O-CD2 3.26Å; R123-L135 PolarHBondContact NE-O 2.93Å; R123-L135 PolarHBondContact NH2-O 3.43Å; R123-T140 HydrophobicContact CG-CG2 3.63Å
124K96Very high94Very high123 Ų12369.2 Ų69.254%0.53538%0.381SS..Hα-helixtrans-69-26-178.9-66.4173-176.1177.20113.6E120 S121 L122 Y129E120-K124 PolarHBondContact O-N 2.87Å; S121-K124 WeakPolarHBondContact O-CB 3.35Å; S121-K124 PolarHBondContact O-N 3.43Å; L122-K124 PolarHBondContact O-N 2.89Å; L122-K124 VanDerWaalsContact O-N 3.16Å; K124-Y129 HydrophobicContact CG-CD2 4.3Å; K124-Y129 HydrophobicContact CG-CE1 4.26Å; K124-Y129 HydrophobicContact CG-CE2 3.83Å
125V95.9Very high93.9Very high100 Ų10068.1 Ų68.161%0.60637%0.365SS*.Hα-helixtrans-102.5-12.6-176.5-59.60000113.3L122 R123L122-V125 HydrophobicContact CD1-CG2 4.09Å; L122-V125 WeakPolarHBondContact O-CG2 3.47Å; L122-V125 PolarHBondContact O-N 3.32Å; L122-V125 VanDerWaalsContact O-N 3.09Å; R123-V125 VanDerWaalsContact C-N 3.3Å; R123-V125 PolarHBondContact O-N 3.29Å
126V94.9Very high93.8Very high9 Ų967.1 Ų67.16%0.05537%0.365CS..SBendtrans-80.1147.1173.7174.30000109.3L122 L143 A144L122-V126 HydrophobicContact CD1-CG2 3.88Å; L122-V126 HydrophobicContact CG-CG2 4.03Å; L122-V126 VanDerWaalsContact O-CG2 3.28Å; L122-V126 WeakPolarHBondContact O-CG2 3.39Å; L122-V126 PolarHBondContact O-N 3.41Å; L122-V126 VanDerWaalsContact O-N 3.16Å; V126-L143 HydrophobicContact CG1-CB 3.93Å; V126-L143 HydrophobicContact CG1-CD2 3.38Å; V126-L143 HydrophobicContact CG1-CG 3.39Å; V126-A144 HydrophobicContact CG2-CB 3.75Å
127P91.8Very high93.8Very high23 Ų2369.2 Ų69.215%0.14937%0.371CS..THydrogen-bonded Turntrans-55152.1177.5-26.535.8000112.1Y129 Y147 L170P127-Y129 VanDerWaalsContact C-N 3.32Å; P127-Y129 PolarHBondContact O-N 3.49Å; P127-Y147 VanDerWaalsContact CD-CD1 3.5Å; P127-Y147 HydrophobicContact CG-CD1 4Å; P127-Y147 HydrophobicContact CG-CD2 3.68Å; P127-Y147 HydrophobicContact CG-CE1 4.07Å; P127-Y147 HydrophobicContact CG-CE2 3.79Å; P127-Y147 HydrophobicContact CG-CG 3.78Å; P127-L170 HydrophobicContact CG-CD1 4.41Å; P127-L170 HydrophobicContact CG-CD2 4.42Å
128C85.8Confident93.8Very high19 Ų1970.7 Ų70.713%0.12837%0.37CS..THydrogen-bonded Turntrans67.229.4174.7-390000113.9S130 L181 V182 C185C128-S130 PolarHBondContact O-N 3.28Å; C128-L181 HydrophobicContact CB-CD2 4.48Å; C128-L181 HydrophobicContact CB-CG 4.32Å; C128-V182 VanDerWaalsContact SG-CA 3.57Å; C128-C185 HydrophobicContact CB-CB 3.87Å; C128-C185 VanDerWaalsContact CB-SG 3.55Å; C128-C185 WeakPolarHBondContact SG-CB 3.49Å
129Y89.1Confident93.7Very high88 Ų8868.1 Ų68.135%0.34535%0.348SS..  trans-57.1126.9171176.9-111.9000111R123 K124 P127 K131R123-Y129 HydrophobicContact CB-CD2 4.07Å; R123-Y129 HydrophobicContact CB-CE2 4.25Å; R123-Y129 WeakPolarHBondContact O-CB 3.43Å; R123-Y129 WeakPolarHBondContact O-CD2 3.26Å; K124-Y129 HydrophobicContact CG-CD2 4.3Å; K124-Y129 HydrophobicContact CG-CE1 4.26Å; K124-Y129 HydrophobicContact CG-CE2 3.83Å; P127-Y129 VanDerWaalsContact C-N 3.32Å; P127-Y129 PolarHBondContact O-N 3.49Å; Y129-K131 HydrophobicContact CE1-CG 3.94Å
130S86.4Confident93.7Very high30 Ų3067.3 Ų67.321%0.2134%0.343CS..  trans-124136.6172170.70000110.4C128 T132 Q133C128-S130 PolarHBondContact O-N 3.28Å; S130-T132 VanDerWaalsContact C-N 3.33Å; S130-T132 PolarHBondContact OG-N 3.3Å; S130-T132 PolarHBondContact OG-OG1 3.01Å; S130-Q133 WeakPolarHBondContact CB-O 3.38Å; S130-Q133 PolarHBondContact OG-N 2.88Å; S130-Q133 VanDerWaalsContact OG-N 3.08Å
131K85.1Confident93.8Very high180 Ų18070.4 Ų70.478%0.78336%0.36SS*.SBendtrans-71.4-30.9176.5-66.6-178-178.7177.40111.9Y129Y129-K131 HydrophobicContact CE1-CG 3.94Å
132T87.1Confident93.8Very high136 Ų13672.4 Ų72.483%0.83436%0.358SS*.SBendtrans-96.6-31.1-174.853.60000112.5S130S130-T132 VanDerWaalsContact C-N 3.33Å; S130-T132 PolarHBondContact OG-N 3.3Å; S130-T132 PolarHBondContact OG-OG1 3.01Å
133Q88.3Confident93.8Very high116 Ų11669.9 Ų69.954%0.54235%0.345SS..SBendtrans-120.4108-178.7-169.5-1791500110.7S130S130-Q133 WeakPolarHBondContact CB-O 3.38Å; S130-Q133 PolarHBondContact OG-N 2.88Å; S130-Q133 VanDerWaalsContact OG-N 3.08Å
134K93.4Very high93.8Very high118 Ų11868.7 Ų68.751%0.51334%0.343SS..PPolyproline II helixtrans-92.3133.6179.6-62.2-174.4178.4-163.90110.9E120E120-K134 VanDerWaalsContact OE1-CE 3.26Å; E120-K134 WeakPolarHBondContact OE1-CE 3.49Å; E120-K134 IonicContact OE1-NZ 2.76Å; E120-K134 PolarHBondContact OE1-NZ 3.38Å; E120-K134 IonicContact OE2-NZ 3.47Å; E120-K134 PolarHBondContact OE2-NZ 3.27Å
135L95Very high93.9Very high22 Ų2270.1 Ų70.112%0.11535%0.349CS..PPolyproline II helixtrans-63.1145.7167.3-63.4-178.8000110.8R123 E139 T140 L143 T178 L181R123-L135 PolarHBondContact NE-O 2.93Å; R123-L135 PolarHBondContact NH2-O 3.43Å; L135-E139 HydrophobicContact CB-CB 4.31Å; L135-T140 WeakPolarHBondContact CB-OG1 3.31Å; L135-T140 PolarHBondContact O-OG1 3.37Å; L135-L143 HydrophobicContact CD1-CD2 3.68Å; L135-T178 HydrophobicContact CD1-CG2 4.36Å; L135-T178 HydrophobicContact CD2-CG2 3.68Å; L135-L181 HydrophobicContact CD2-CD2 4.03Å
136S96.9Very high94Very high60 Ų6066.2 Ų66.242%0.4232%0.324SS..PPolyproline II helixtrans-60.7164173.381.20000110.8I138 E139 T140S136-I138 VanDerWaalsContact C-N 3.3Å; S136-I138 PolarHBondContact O-N 2.96Å; S136-I138 WeakPolarHBondContact OG-CG2 3.46Å; S136-E139 PolarHBondContact O-N 3.19Å; S136-E139 VanDerWaalsContact OG-CG 3.22Å; S136-E139 WeakPolarHBondContact OG-CG 3.42Å; S136-E139 PolarHBondContact OG-N 3.42Å; S136-T140 WeakPolarHBondContact O-CB 3.39Å; S136-T140 PolarHBondContact O-N 3.47Å; S136-T140 PolarHBondContact O-OG1 3.36Å
137K98Very high94.2Very high104 Ų10469.1 Ų69.145%0.45234%0.335SS..Hα-helixtrans-56.9-45.6-179.2-59-164.8168.8-176.80111.4N116 L119 L141N116-K137 PolarHBondContact OD1-NZ 3.34Å; N116-K137 VanDerWaalsContact OD1-NZ 3.07Å; L119-K137 HydrophobicContact CD2-CB 4.11Å; L119-K137 HydrophobicContact CD2-CD 4.08Å; L119-K137 HydrophobicContact CD2-CG 3.63Å; K137-L141 VanDerWaalsContact O-CG 3.31Å; K137-L141 WeakPolarHBondContact O-CG 3.44Å; K137-L141 PolarHBondContact O-N 2.89Å
138I98.1Very high94.5Very high87 Ų8773.4 Ų73.445%0.44636%0.355SS..Hα-helixtrans-69.2-42.5-178.5-175.159.5000112.2S136 T140 L141 R142S136-I138 VanDerWaalsContact C-N 3.3Å; S136-I138 PolarHBondContact O-N 2.96Å; S136-I138 WeakPolarHBondContact OG-CG2 3.46Å; I138-T140 VanDerWaalsContact C-N 3.34Å; I138-T140 PolarHBondContact O-N 2.96Å; I138-L141 PolarHBondContact O-N 2.93Å; I138-R142 HydrophobicContact CD1-CG 4.24Å; I138-R142 HydrophobicContact CG1-CG 4.36Å; I138-R142 WeakPolarHBondContact O-CB 3.34Å; I138-R142 WeakPolarHBondContact O-CG 3.49Å; I138-R142 PolarHBondContact O-N 2.93Å
139E97.6Very high95Very high10 Ų1080.1 Ų80.15%0.04738%0.378CS..Hα-helixtrans-66.5-38.7179.9-64.5-65.8102.300111L135 S136 L141 R142 L143 L174 S175 T178L135-E139 HydrophobicContact CB-CB 4.31Å; S136-E139 PolarHBondContact O-N 3.19Å; S136-E139 VanDerWaalsContact OG-CG 3.22Å; S136-E139 WeakPolarHBondContact OG-CG 3.42Å; S136-E139 PolarHBondContact OG-N 3.42Å; E139-L141 PolarHBondContact O-N 2.81Å; E139-R142 PolarHBondContact O-N 3.39Å; E139-R142 IonicContact OE1-NH1 3.45Å; E139-R142 PolarHBondContact OE1-NH1 2.94Å; E139-L143 VanDerWaalsContact O-CB 3.26Å; E139-L143 WeakPolarHBondContact O-CB 3.4Å; E139-L143 PolarHBondContact O-N 2.96Å; E139-L174 WeakPolarHBondContact OE2-CA 3.48Å; E139-S175 WeakPolarHBondContact OE2-CB 3.39Å; E139-S175 PolarHBondContact OE2-N 3.14Å; E139-S175 PolarHBondContact OE2-OG 2.77Å; E139-T178 WeakPolarHBondContact OE2-CB 3.46Å; E139-T178 PolarHBondContact OE2-OG1 3.42Å
140T97.9Very high95.4Very high0 Ų076.1 Ų76.10%036%0.363CS..Hα-helixtrans-59.2-46.5173.9-53.30000111L119 L122 R123 L135 S136 I138 A144L119-T140 HydrophobicContact CD1-CG2 3.92Å; L122-T140 HydrophobicContact CD2-CG2 4.06Å; L122-T140 HydrophobicContact CG-CG2 4.13Å; R123-T140 HydrophobicContact CG-CG2 3.63Å; L135-T140 WeakPolarHBondContact CB-OG1 3.31Å; L135-T140 PolarHBondContact O-OG1 3.37Å; S136-T140 WeakPolarHBondContact O-CB 3.39Å; S136-T140 PolarHBondContact O-N 3.47Å; S136-T140 PolarHBondContact O-OG1 3.36Å; I138-T140 VanDerWaalsContact C-N 3.34Å; I138-T140 PolarHBondContact O-N 2.96Å; T140-A144 VanDerWaalsContact O-CB 3.26Å; T140-A144 WeakPolarHBondContact O-CB 3.46Å; T140-A144 PolarHBondContact O-N 3.48Å
141L98.5Very high95.8Very high98 Ų9877.9 Ų77.951%0.51337%0.37SS..Hα-helixtrans-68.2-41.2-179.5-68.1174000112.4L122 K137 I138 E139 A144 K145L122-L141 HydrophobicContact CD2-CD2 4.11Å; K137-L141 VanDerWaalsContact O-CG 3.31Å; K137-L141 WeakPolarHBondContact O-CG 3.44Å; K137-L141 PolarHBondContact O-N 2.89Å; I138-L141 PolarHBondContact O-N 2.93Å; E139-L141 PolarHBondContact O-N 2.81Å; L141-A144 PolarHBondContact O-N 2.96Å; L141-K145 PolarHBondContact O-N 3.05Å
142R98.3Very high96.4Very high109 Ų10972.3 Ų72.341%0.41135%0.354SS..Hα-helixtrans-62.1-49.8175.7-74.3173.1173.6170.2-6.9111.2I138 E139 A144 K145 N146 G173 L174I138-R142 HydrophobicContact CD1-CG 4.24Å; I138-R142 HydrophobicContact CG1-CG 4.36Å; I138-R142 WeakPolarHBondContact O-CB 3.34Å; I138-R142 WeakPolarHBondContact O-CG 3.49Å; I138-R142 PolarHBondContact O-N 2.93Å; E139-R142 PolarHBondContact O-N 3.39Å; E139-R142 IonicContact OE1-NH1 3.45Å; E139-R142 PolarHBondContact OE1-NH1 2.94Å; R142-A144 VanDerWaalsContact C-N 3.34Å; R142-A144 PolarHBondContact O-N 3.16Å; R142-K145 PolarHBondContact O-N 3.26Å; R142-N146 VanDerWaalsContact O-CG 3.23Å; R142-N146 PolarHBondContact O-N 3.34Å; R142-N146 PolarHBondContact O-OD1 3.26Å; R142-G173 WeakPolarHBondContact CD-O 3.49Å; R142-G173 PolarHBondContact NH1-O 3.41Å; R142-L174 HydrophobicContact CB-CD2 3.66Å
143L97.4Very high96.7Very high0 Ų071 Ų710%034%0.338CS..Hα-helixtrans-64.9-38.2-179.8-175.760.2000111.5V126 L135 E139 N146 Y147 L170 L174 V182V126-L143 HydrophobicContact CG1-CB 3.93Å; V126-L143 HydrophobicContact CG1-CD2 3.38Å; V126-L143 HydrophobicContact CG1-CG 3.39Å; L135-L143 HydrophobicContact CD1-CD2 3.68Å; E139-L143 VanDerWaalsContact O-CB 3.26Å; E139-L143 WeakPolarHBondContact O-CB 3.4Å; E139-L143 PolarHBondContact O-N 2.96Å; L143-N146 PolarHBondContact O-N 3.07Å; L143-Y147 VanDerWaalsContact O-CB 3.27Å; L143-Y147 WeakPolarHBondContact O-CB 3.22Å; L143-Y147 PolarHBondContact O-N 3.35Å; L143-L170 HydrophobicContact CD1-CB 4.15Å; L143-L170 HydrophobicContact CD1-CD2 4.18Å; L143-L174 HydrophobicContact CB-CD1 4.35Å; L143-L174 HydrophobicContact CB-CD2 4.24Å; L143-L174 HydrophobicContact CD1-CD1 3.86Å; L143-V182 HydrophobicContact CD1-CG2 4.39Å; L143-V182 HydrophobicContact CD2-CG2 4.45Å
144A98.5Very high97Very high11 Ų1167 Ų679%0.09132%0.322CS..Hα-helixtrans-61-47.2173.700000112.4L122 V126 T140 L141 R142 N146 Y147 I148L122-A144 HydrophobicContact CD1-CB 4.04Å; L122-A144 HydrophobicContact CD2-CB 4.12Å; L122-A144 HydrophobicContact CG-CB 4.37Å; V126-A144 HydrophobicContact CG2-CB 3.75Å; T140-A144 VanDerWaalsContact O-CB 3.26Å; T140-A144 WeakPolarHBondContact O-CB 3.46Å; T140-A144 PolarHBondContact O-N 3.48Å; L141-A144 PolarHBondContact O-N 2.96Å; R142-A144 VanDerWaalsContact C-N 3.34Å; R142-A144 PolarHBondContact O-N 3.16Å; A144-N146 VanDerWaalsContact C-N 3.35Å; A144-N146 PolarHBondContact O-N 3.4Å; A144-Y147 PolarHBondContact O-N 2.93Å; A144-I148 WeakPolarHBondContact O-CG1 3.41Å; A144-I148 PolarHBondContact O-N 3.47Å
145K98.4Very high97.1Very high152 Ų15268.2 Ų68.266%0.66133%0.333SS*.Hα-helixtrans-57.7-48.5175.5177.2-171.9172.9-177.20111.2L141 R142 Y147 I148 W149L141-K145 PolarHBondContact O-N 3.05Å; R142-K145 PolarHBondContact O-N 3.26Å; K145-Y147 VanDerWaalsContact C-N 3.29Å; K145-Y147 PolarHBondContact O-N 2.95Å; K145-I148 PolarHBondContact O-N 3.37Å; K145-W149 PolarHBondContact O-N 3.13Å; K145-W149 VanDerWaalsContact O-N 3.07Å
146N98.1Very high97.1Very high18 Ų1872 Ų7210%0.09636%0.362CS..Hα-helixtrans-63.4-38-179.9-67.9-7.4000111.4R142 L143 A144 W149 A150 T169 L170 K172R142-N146 VanDerWaalsContact O-CG 3.23Å; R142-N146 PolarHBondContact O-N 3.34Å; R142-N146 PolarHBondContact O-OD1 3.26Å; L143-N146 PolarHBondContact O-N 3.07Å; A144-N146 VanDerWaalsContact C-N 3.35Å; A144-N146 PolarHBondContact O-N 3.4Å; N146-W149 WeakPolarHBondContact O-CB 3.39Å; N146-W149 PolarHBondContact O-N 3.04Å; N146-A150 WeakPolarHBondContact O-CB 3.49Å; N146-A150 PolarHBondContact O-N 2.67Å; N146-T169 WeakPolarHBondContact CB-O 3.42Å; N146-T169 PolarHBondContact ND2-O 2.88Å; N146-L170 PolarHBondContact ND2-O 3Å; N146-K172 PolarHBondContact ND2-O 3.47Å
147Y97.6Very high96.9Very high70 Ų7072.2 Ų72.228%0.27537%0.367SS..Hα-helixtrans-67.4-44.6178.6-174.7-140.2000112.2P127 L143 A144 K145 W149 A150 L151 F166 L170P127-Y147 VanDerWaalsContact CD-CD1 3.5Å; P127-Y147 HydrophobicContact CG-CD1 4Å; P127-Y147 HydrophobicContact CG-CD2 3.68Å; P127-Y147 HydrophobicContact CG-CE1 4.07Å; P127-Y147 HydrophobicContact CG-CE2 3.79Å; P127-Y147 HydrophobicContact CG-CG 3.78Å; L143-Y147 VanDerWaalsContact O-CB 3.27Å; L143-Y147 WeakPolarHBondContact O-CB 3.22Å; L143-Y147 PolarHBondContact O-N 3.35Å; A144-Y147 PolarHBondContact O-N 2.93Å; K145-Y147 VanDerWaalsContact C-N 3.29Å; K145-Y147 PolarHBondContact O-N 2.95Å; Y147-W149 VanDerWaalsContact C-N 3.29Å; Y147-W149 PolarHBondContact O-N 3.17Å; Y147-A150 PolarHBondContact O-N 2.76Å; Y147-L151 HydrophobicContact CD1-CD1 4.23Å; Y147-L151 HydrophobicContact CD2-CD1 4.06Å; Y147-L151 HydrophobicContact CD2-CD2 4.4Å; Y147-L151 HydrophobicContact CD2-CG 3.87Å; Y147-L151 HydrophobicContact CE1-CD1 3.86Å; Y147-L151 HydrophobicContact CE2-CD1 3.66Å; Y147-L151 HydrophobicContact CE2-CD2 3.73Å; Y147-L151 HydrophobicContact CE2-CG 3.6Å; Y147-L151 HydrophobicContact CG-CD1 4.35Å; Y147-L151 WeakPolarHBondContact O-CB 3.48Å; Y147-L151 WeakPolarHBondContact O-CG 3.39Å; Y147-L151 PolarHBondContact O-N 3.25Å; Y147-F166 HydrophobicContact CD2-CZ 4.21Å; Y147-F166 HydrophobicContact CE2-CZ 4.04Å; Y147-L170 HydrophobicContact CD2-CD2 3.95Å; Y147-L170 HydrophobicContact CG-CD2 4.37Å
148I98.2Very high96.6Very high113 Ų11370.6 Ų70.658%0.57938%0.379SS*.Hα-helixtrans-56.1-47.4172.9-67.4166.3000109.9A144 K145 L151 S152A144-I148 WeakPolarHBondContact O-CG1 3.41Å; A144-I148 PolarHBondContact O-N 3.47Å; K145-I148 PolarHBondContact O-N 3.37Å; I148-L151 PolarHBondContact O-N 3.01Å; I148-S152 WeakPolarHBondContact O-CB 3.45Å; I148-S152 PolarHBondContact O-N 3.47Å; I148-S152 PolarHBondContact O-OG 2.89Å
149W97.6Very high96.1Very high161 Ų16174.3 Ų74.361%0.6139%0.392SS*.Hα-helixtrans-58.4-50.2177.5-176-77.4000112.4K145 N146 Y147 L151 S152 E153K145-W149 PolarHBondContact O-N 3.13Å; K145-W149 VanDerWaalsContact O-N 3.07Å; N146-W149 WeakPolarHBondContact O-CB 3.39Å; N146-W149 PolarHBondContact O-N 3.04Å; Y147-W149 VanDerWaalsContact C-N 3.29Å; Y147-W149 PolarHBondContact O-N 3.17Å; W149-L151 VanDerWaalsContact C-N 3.32Å; W149-L151 PolarHBondContact O-N 2.99Å; W149-S152 PolarHBondContact O-N 3.25Å; W149-E153 PolarHBondContact O-N 3.18Å
150A95.8Very high95.6Very high4 Ų485.3 Ų85.33%0.03343%0.433CS..Hα-helixtrans-62.3-38.7-177.800000112.4N146 Y147 T154 F166 T169N146-A150 WeakPolarHBondContact O-CB 3.49Å; N146-A150 PolarHBondContact O-N 2.67Å; Y147-A150 PolarHBondContact O-N 2.76Å; A150-T154 WeakPolarHBondContact O-CB 3.48Å; A150-T154 PolarHBondContact O-N 3.47Å; A150-T154 VanDerWaalsContact O-N 3.1Å; A150-T154 PolarHBondContact O-OG1 3.45Å; A150-F166 HydrophobicContact CB-CD2 3.76Å; A150-F166 HydrophobicContact CB-CE2 3.53Å; A150-F166 HydrophobicContact CB-CZ 4.38Å; A150-T169 HydrophobicContact CB-CG2 3.85Å
151L95.8Very high95.1Very high66 Ų6687.8 Ų87.835%0.34645%0.449SS..Hα-helixtrans-68.9-42174.6-69-179000112Y147 I148 W149 E153 T154 L155Y147-L151 HydrophobicContact CD1-CD1 4.23Å; Y147-L151 HydrophobicContact CD2-CD1 4.06Å; Y147-L151 HydrophobicContact CD2-CD2 4.4Å; Y147-L151 HydrophobicContact CD2-CG 3.87Å; Y147-L151 HydrophobicContact CE1-CD1 3.86Å; Y147-L151 HydrophobicContact CE2-CD1 3.66Å; Y147-L151 HydrophobicContact CE2-CD2 3.73Å; Y147-L151 HydrophobicContact CE2-CG 3.6Å; Y147-L151 HydrophobicContact CG-CD1 4.35Å; Y147-L151 WeakPolarHBondContact O-CB 3.48Å; Y147-L151 WeakPolarHBondContact O-CG 3.39Å; Y147-L151 PolarHBondContact O-N 3.25Å; I148-L151 PolarHBondContact O-N 3.01Å; W149-L151 VanDerWaalsContact C-N 3.32Å; W149-L151 PolarHBondContact O-N 2.99Å; L151-E153 VanDerWaalsContact C-N 3.34Å; L151-E153 PolarHBondContact O-N 2.9Å; L151-T154 WeakPolarHBondContact O-CB 3.38Å; L151-T154 PolarHBondContact O-N 3.41Å; L151-L155 WeakPolarHBondContact O-CG 3.36Å; L151-L155 PolarHBondContact O-N 3.42Å
152S96.9Very high94.6Very high63 Ų6387.9 Ų87.944%0.44145%0.45SS..Hα-helixtrans-58.8-45.1176.1-65.70000111.9I148 W149 T154 L155 S156I148-S152 WeakPolarHBondContact O-CB 3.45Å; I148-S152 PolarHBondContact O-N 3.47Å; I148-S152 PolarHBondContact O-OG 2.89Å; W149-S152 PolarHBondContact O-N 3.25Å; S152-T154 VanDerWaalsContact C-N 3.34Å; S152-T154 PolarHBondContact O-N 3.5Å; S152-L155 PolarHBondContact O-N 3.31Å; S152-S156 WeakPolarHBondContact O-CB 3.49Å; S152-S156 PolarHBondContact O-N 3.03Å
153E94.8Very high94.2Very high109 Ų10987.1 Ų87.151%0.50945%0.454SS..Hα-helixtrans-62.9-40.9175.9-72.7-69.492.300111.8W149 L151 L155 S156 A157W149-E153 PolarHBondContact O-N 3.18Å; L151-E153 VanDerWaalsContact C-N 3.34Å; L151-E153 PolarHBondContact O-N 2.9Å; E153-L155 PolarHBondContact O-N 3.12Å; E153-S156 PolarHBondContact O-N 3.29Å; E153-A157 WeakPolarHBondContact O-CB 3.45Å; E153-A157 PolarHBondContact O-N 2.99Å
154T94.6Very high93.7Very high33 Ų3390.4 Ų90.420%0.20247%0.471CS..Hα-helixtrans-61.5-44.6177.3-60.20000111.7A150 L151 S152 G158 P161A150-T154 WeakPolarHBondContact O-CB 3.48Å; A150-T154 PolarHBondContact O-N 3.47Å; A150-T154 VanDerWaalsContact O-N 3.1Å; A150-T154 PolarHBondContact O-OG1 3.45Å; L151-T154 WeakPolarHBondContact O-CB 3.38Å; L151-T154 PolarHBondContact O-N 3.41Å; S152-T154 VanDerWaalsContact C-N 3.34Å; S152-T154 PolarHBondContact O-N 3.5Å; T154-G158 PolarHBondContact O-N 3.37Å; T154-P161 HydrophobicContact CG2-CB 4.36Å; T154-P161 HydrophobicContact CG2-CG 3.88Å
155L95.2Very high93.3Very high143 Ų14391.8 Ų91.875%0.74948%0.483SS*.Hα-helixtrans-68-39.1178.3-68.5173.5000111.7L151 S152 E153 G158L151-L155 WeakPolarHBondContact O-CG 3.36Å; L151-L155 PolarHBondContact O-N 3.42Å; S152-L155 PolarHBondContact O-N 3.31Å; E153-L155 PolarHBondContact O-N 3.12Å; L155-G158 PolarHBondContact O-N 3.37Å
156S95.1Very high93Very high102 Ų10286.3 Ų86.371%0.71346%0.459SS*.Hα-helixtrans-65.6-42.2177.6-172.70000112.5S152 E153 G158S152-S156 WeakPolarHBondContact O-CB 3.49Å; S152-S156 PolarHBondContact O-N 3.03Å; E153-S156 PolarHBondContact O-N 3.29Å; S156-G158 VanDerWaalsContact C-N 3.28Å; S156-G158 PolarHBondContact O-N 2.89Å
157A92.8Very high92.7Very high64 Ų6485.8 Ų85.853%0.52946%0.457SS..Hα-helixtrans-71.5-20.6179.600000113.7E153 K159E153-A157 WeakPolarHBondContact O-CB 3.45Å; E153-A157 PolarHBondContact O-N 2.99Å; A157-K159 PolarHBondContact O-N 3.07Å; A157-K159 VanDerWaalsContact O-N 3.11Å
158G90.8Very high92.5Very high69 Ų6987.2 Ų87.271%0.71147%0.466SS*.THydrogen-bonded Turntrans61.917-178.100000114.2T154 L155 S156T154-G158 PolarHBondContact O-N 3.37Å; L155-G158 PolarHBondContact O-N 3.37Å; S156-G158 VanDerWaalsContact C-N 3.28Å; S156-G158 PolarHBondContact O-N 2.89Å
159K89Confident92.3Very high166 Ų16684 Ų8472%0.72245%0.451SS*.SBendtrans-132.3155.7-175.9-68.1176.6-174.2175.60109.8A157A157-K159 PolarHBondContact O-N 3.07Å; A157-K159 VanDerWaalsContact O-N 3.11Å
160R86.2Confident92.2Very high240 Ų24076.3 Ų76.391%0.90642%0.422SS*.PPolyproline II helixtrans-59.1129174.1-169177.6179118.8-1.1108.9
161P86.6Confident92.2Very high52 Ų5277 Ų7734%0.33843%0.427SS..PPolyproline II helixtrans-70.2143.6-177.428.8-31.4000109.6T154 L163 F166T154-P161 HydrophobicContact CG2-CB 4.36Å; T154-P161 HydrophobicContact CG2-CG 3.88Å; P161-L163 PolarHBondContact O-N 3.27Å; P161-F166 HydrophobicContact CB-CB 4.46Å; P161-F166 HydrophobicContact CB-CD2 4.37Å; P161-F166 HydrophobicContact CG-CD2 4.28Å
162D89.6Confident92.2Very high100 Ų10081.4 Ų81.454%0.53544%0.443SS..PPolyproline II helixtrans-59.7126.9166.7170.640.6000108.8L164 A165 F166D162-L164 PolarHBondContact O-N 3.36Å; D162-L164 PolarHBondContact OD1-N 3.29Å; D162-L164 WeakPolarHBondContact OD2-CB 3.44Å; D162-A165 HydrophobicContact CB-CB 4.12Å; D162-A165 PolarHBondContact O-N 2.78Å; D162-A165 PolarHBondContact OD2-N 2.7Å; D162-F166 VanDerWaalsContact O-CB 3.29Å; D162-F166 WeakPolarHBondContact O-CB 3.47Å; D162-F166 PolarHBondContact O-N 3.09Å
163L88.7Confident92.1Very high94 Ų9481 Ų8149%0.49245%0.449SS..Hα-helixtrans-60.7-38.1-174.2179.560.5000110.8P161 F166 V167 L188P161-L163 PolarHBondContact O-N 3.27Å; L163-F166 PolarHBondContact O-N 3.36Å; L163-V167 HydrophobicContact CD1-CG2 4.29Å; L163-V167 VanDerWaalsContact O-CG2 3.25Å; L163-V167 WeakPolarHBondContact O-CG2 3.27Å; L163-V167 PolarHBondContact O-N 2.82Å; L163-L188 HydrophobicContact CD1-CD2 4.39Å; L163-L188 HydrophobicContact CD2-CD2 3.58Å; L163-L188 HydrophobicContact CG-CD2 3.81Å
164L88.3Confident92.2Very high68 Ų6876.8 Ų76.836%0.35643%0.429SS..Hα-helixtrans-67.7-52.7-179.4163.240.9000111.2D162 F166 V167 Q168 F193D162-L164 PolarHBondContact O-N 3.36Å; D162-L164 PolarHBondContact OD1-N 3.29Å; D162-L164 WeakPolarHBondContact OD2-CB 3.44Å; L164-F166 PolarHBondContact O-N 3.46Å; L164-V167 PolarHBondContact O-N 3.34Å; L164-Q168 HydrophobicContact CD1-CG 3.84Å; L164-Q168 WeakPolarHBondContact O-CG 3.35Å; L164-Q168 PolarHBondContact O-N 3.16Å; L164-F193 HydrophobicContact CD1-CE1 3.31Å; L164-F193 HydrophobicContact CD1-CE2 4.46Å; L164-F193 HydrophobicContact CD1-CZ 3.18Å; L164-F193 HydrophobicContact CD2-CZ 4.29Å; L164-F193 HydrophobicContact CG-CZ 4.21Å
165A89.9Confident92.2Very high41 Ų4177.4 Ų77.434%0.33944%0.435SS..Hα-helixtrans-57.9-37.8174.600000112.8D162 T169D162-A165 HydrophobicContact CB-CB 4.12Å; D162-A165 PolarHBondContact O-N 2.78Å; D162-A165 PolarHBondContact OD2-N 2.7Å; A165-T169 PolarHBondContact O-N 2.98Å; A165-T169 PolarHBondContact O-OG1 3.31Å
166F92.3Very high92.2Very high36 Ų3675.5 Ų75.516%0.15842%0.423CS..Hα-helixtrans-62.5-47.7177.2-175.4-99.5000111.7Y147 A150 P161 D162 L163 L164 T169 L170Y147-F166 HydrophobicContact CD2-CZ 4.21Å; Y147-F166 HydrophobicContact CE2-CZ 4.04Å; A150-F166 HydrophobicContact CB-CD2 3.76Å; A150-F166 HydrophobicContact CB-CE2 3.53Å; A150-F166 HydrophobicContact CB-CZ 4.38Å; P161-F166 HydrophobicContact CB-CB 4.46Å; P161-F166 HydrophobicContact CB-CD2 4.37Å; P161-F166 HydrophobicContact CG-CD2 4.28Å; D162-F166 VanDerWaalsContact O-CB 3.29Å; D162-F166 WeakPolarHBondContact O-CB 3.47Å; D162-F166 PolarHBondContact O-N 3.09Å; L163-F166 PolarHBondContact O-N 3.36Å; L164-F166 PolarHBondContact O-N 3.46Å; F166-T169 WeakPolarHBondContact O-CB 3.38Å; F166-T169 PolarHBondContact O-N 2.92Å; F166-L170 HydrophobicContact CD1-CD1 3.9Å; F166-L170 HydrophobicContact CD1-CG 4.34Å; F166-L170 HydrophobicContact CE1-CD1 3.44Å; F166-L170 VanDerWaalsContact CE1-CD1 3.44Å; F166-L170 HydrophobicContact CE1-CG 4.07Å; F166-L170 HydrophobicContact CZ-CD1 4.1Å; F166-L170 HydrophobicContact CZ-CG 4.41Å; F166-L170 WeakPolarHBondContact O-CG 3.47Å; F166-L170 PolarHBondContact O-N 3.41Å
167V92.3Very high92.1Very high8 Ų875 Ų755%0.04842%0.416CS..Hα-helixtrans-68.2-39.9179.1176.20000112.2L163 L164 T169 L170 C171 V182 L186 L188L163-V167 HydrophobicContact CD1-CG2 4.29Å; L163-V167 VanDerWaalsContact O-CG2 3.25Å; L163-V167 WeakPolarHBondContact O-CG2 3.27Å; L163-V167 PolarHBondContact O-N 2.82Å; L164-V167 PolarHBondContact O-N 3.34Å; V167-T169 PolarHBondContact O-N 3.31Å; V167-L170 PolarHBondContact O-N 2.95Å; V167-L170 VanDerWaalsContact O-N 3.13Å; V167-C171 WeakPolarHBondContact O-CB 3.43Å; V167-C171 PolarHBondContact O-N 3.15Å; V167-C171 PolarHBondContact O-SG 3.1Å; V167-C171 VanDerWaalsContact O-SG 3.36Å; V167-V182 HydrophobicContact CG1-CG1 4.37Å; V167-L186 HydrophobicContact CG2-CD1 3.45Å; V167-L186 VanDerWaalsContact CG2-CD1 3.45Å; V167-L188 HydrophobicContact CB-CD1 3.88Å; V167-L188 HydrophobicContact CG1-CD1 3.62Å; V167-L188 HydrophobicContact CG2-CD1 3.61Å; V167-L188 HydrophobicContact CG2-CD2 4.45Å; V167-L188 HydrophobicContact CG2-CG 4.39Å
168Q91.9Very high92.1Very high99 Ų9972.5 Ų72.546%0.46340%0.395SS..Hα-helixtrans-56.4-42.2173.9-77175.5-18.800111.6L164 C171 K172L164-Q168 HydrophobicContact CD1-CG 3.84Å; L164-Q168 WeakPolarHBondContact O-CG 3.35Å; L164-Q168 PolarHBondContact O-N 3.16Å; Q168-C171 PolarHBondContact O-N 2.97Å; Q168-K172 PolarHBondContact O-N 3.3Å
169T94.8Very high92.3Very high45 Ų4570.6 Ų70.628%0.27637%0.37SS..Hα-helixtrans-63.5-45.9176.1-57.20000111.1N146 A150 A165 F166 V167 C171 K172N146-T169 WeakPolarHBondContact CB-O 3.42Å; N146-T169 PolarHBondContact ND2-O 2.88Å; A150-T169 HydrophobicContact CB-CG2 3.85Å; A165-T169 PolarHBondContact O-N 2.98Å; A165-T169 PolarHBondContact O-OG1 3.31Å; F166-T169 WeakPolarHBondContact O-CB 3.38Å; F166-T169 PolarHBondContact O-N 2.92Å; V167-T169 PolarHBondContact O-N 3.31Å; T169-C171 PolarHBondContact O-N 3.44Å; T169-K172 PolarHBondContact O-N 2.88Å
170L95.4Very high92.3Very high0 Ų067.1 Ų67.10%036%0.359CS..Hα-helixtrans-60-45.2177.6-71.8-176.9000112.6P127 L143 N146 Y147 F166 V167 K172 L174 V182 L186P127-L170 HydrophobicContact CG-CD1 4.41Å; P127-L170 HydrophobicContact CG-CD2 4.42Å; L143-L170 HydrophobicContact CD1-CB 4.15Å; L143-L170 HydrophobicContact CD1-CD2 4.18Å; N146-L170 PolarHBondContact ND2-O 3Å; Y147-L170 HydrophobicContact CD2-CD2 3.95Å; Y147-L170 HydrophobicContact CG-CD2 4.37Å; F166-L170 HydrophobicContact CD1-CD1 3.9Å; F166-L170 HydrophobicContact CD1-CG 4.34Å; F166-L170 HydrophobicContact CE1-CD1 3.44Å; F166-L170 VanDerWaalsContact CE1-CD1 3.44Å; F166-L170 HydrophobicContact CE1-CG 4.07Å; F166-L170 HydrophobicContact CZ-CD1 4.1Å; F166-L170 HydrophobicContact CZ-CG 4.41Å; F166-L170 WeakPolarHBondContact O-CG 3.47Å; F166-L170 PolarHBondContact O-N 3.41Å; V167-L170 PolarHBondContact O-N 2.95Å; V167-L170 VanDerWaalsContact O-N 3.13Å; L170-K172 VanDerWaalsContact C-N 3.29Å; L170-K172 PolarHBondContact O-N 3.06Å; L170-L174 WeakPolarHBondContact O-CD1 3.47Å; L170-V182 HydrophobicContact CB-CG1 4.4Å; L170-V182 HydrophobicContact CD1-CG1 4.35Å; L170-L186 HydrophobicContact CD1-CD1 3.99Å
171C95.6Very high92.6Very high19 Ų1957.5 Ų57.513%0.12833%0.325CS..Hα-helixtrans-78.9-7.4-173.2-64.90000114.3V167 Q168 T169 G173 L174 T179V167-C171 WeakPolarHBondContact O-CB 3.43Å; V167-C171 PolarHBondContact O-N 3.15Å; V167-C171 PolarHBondContact O-SG 3.1Å; V167-C171 VanDerWaalsContact O-SG 3.36Å; Q168-C171 PolarHBondContact O-N 2.97Å; T169-C171 PolarHBondContact O-N 3.44Å; C171-G173 PolarHBondContact O-N 3.08Å; C171-G173 VanDerWaalsContact O-N 3.12Å; C171-L174 WeakPolarHBondContact O-CB 3.4Å; C171-L174 PolarHBondContact O-N 3.42Å; C171-L174 VanDerWaalsContact O-N 3.09Å; C171-T179 HydrophobicContact CB-CG2 3.95Å
172K95.3Very high92.7Very high159 Ų15955.1 Ų55.169%0.69131%0.31SS*.THydrogen-bonded Turntrans-57.8117.3-175.7-174.1175.7-179173.20112.2N146 Q168 T169 L170 L174N146-K172 PolarHBondContact ND2-O 3.47Å; Q168-K172 PolarHBondContact O-N 3.3Å; T169-K172 PolarHBondContact O-N 2.88Å; L170-K172 VanDerWaalsContact C-N 3.29Å; L170-K172 PolarHBondContact O-N 3.06Å; K172-L174 PolarHBondContact O-N 3.08Å
173G95.5Very high92.6Very high54 Ų5451.7 Ų51.756%0.55730%0.295SS*.THydrogen-bonded Turntrans72.113.217700000114.7R142 C171R142-G173 WeakPolarHBondContact CD-O 3.49Å; R142-G173 PolarHBondContact NH1-O 3.41Å; C171-G173 PolarHBondContact O-N 3.08Å; C171-G173 VanDerWaalsContact O-N 3.12Å
174L96.2Very high92.4Very high20 Ų2049.8 Ų49.811%0.10530%0.299CS..  trans-81.6155.9169-59.3-175.8000110.7E139 R142 L143 L170 C171 K172 T178 V182E139-L174 WeakPolarHBondContact OE2-CA 3.48Å; R142-L174 HydrophobicContact CB-CD2 3.66Å; L143-L174 HydrophobicContact CB-CD1 4.35Å; L143-L174 HydrophobicContact CB-CD2 4.24Å; L143-L174 HydrophobicContact CD1-CD1 3.86Å; L170-L174 WeakPolarHBondContact O-CD1 3.47Å; C171-L174 WeakPolarHBondContact O-CB 3.4Å; C171-L174 PolarHBondContact O-N 3.42Å; C171-L174 VanDerWaalsContact O-N 3.09Å; K172-L174 PolarHBondContact O-N 3.08Å; L174-T178 HydrophobicContact CB-CG2 4.25Å; L174-T178 HydrophobicContact CD1-CG2 3.8Å; L174-T178 HydrophobicContact CG-CG2 4.42Å; L174-V182 HydrophobicContact CD1-CG2 4.36Å
175S95.9Very high92.3Very high46 Ų4649.7 Ų49.732%0.32230%0.303SS..  trans-65.3149.5170.358.20000111.4E139 P177 T178 T179E139-S175 WeakPolarHBondContact OE2-CB 3.39Å; E139-S175 PolarHBondContact OE2-N 3.14Å; E139-S175 PolarHBondContact OE2-OG 2.77Å; S175-P177 VanDerWaalsContact C-CD 3.46Å; S175-T178 WeakPolarHBondContact O-CA 3.39Å; S175-T178 WeakPolarHBondContact O-CB 3.35Å; S175-T178 PolarHBondContact O-N 2.94Å; S175-T178 WeakPolarHBondContact OG-CB 3.07Å; S175-T178 PolarHBondContact OG-OG1 2.88Å; S175-T179 PolarHBondContact O-N 3.46Å; S175-T179 PolarHBondContact O-OG1 3.48Å
176Q93.4Very high91.8Very high104 Ų10450.4 Ų50.449%0.48630%0.3SS..Hα-helixtrans-51.4-44.9179.2-172.36443.300114T178 T179 N180Q176-T178 VanDerWaalsContact C-N 3.26Å; Q176-T178 PolarHBondContact O-N 3.23Å; Q176-T179 PolarHBondContact O-N 2.92Å; Q176-N180 PolarHBondContact NE2-OD1 3.45Å; Q176-N180 VanDerWaalsContact O-CG 3.27Å; Q176-N180 PolarHBondContact O-N 3.3Å; Q176-N180 PolarHBondContact O-OD1 3.36Å
177P93.1Very high90.9Very high90 Ų9057.1 Ų57.158%0.58433%0.332SS*.Hα-helixtrans-62.9-35178-2234.9000112.7S175 N180 L181S175-P177 VanDerWaalsContact C-CD 3.46Å; P177-N180 PolarHBondContact O-N 2.93Å; P177-L181 PolarHBondContact O-N 3.42Å; P177-L181 VanDerWaalsContact O-N 3.07Å
178T93.9Very high89.5Confident12 Ų1258.2 Ų58.27%0.07434%0.338CS..Hα-helixtrans-72.6-41.3178.7-56.90000110.8L135 E139 L174 S175 Q176 N180 L181 V182L135-T178 HydrophobicContact CD1-CG2 4.36Å; L135-T178 HydrophobicContact CD2-CG2 3.68Å; E139-T178 WeakPolarHBondContact OE2-CB 3.46Å; E139-T178 PolarHBondContact OE2-OG1 3.42Å; L174-T178 HydrophobicContact CB-CG2 4.25Å; L174-T178 HydrophobicContact CD1-CG2 3.8Å; L174-T178 HydrophobicContact CG-CG2 4.42Å; S175-T178 WeakPolarHBondContact O-CA 3.39Å; S175-T178 WeakPolarHBondContact O-CB 3.35Å; S175-T178 PolarHBondContact O-N 2.94Å; S175-T178 WeakPolarHBondContact OG-CB 3.07Å; S175-T178 PolarHBondContact OG-OG1 2.88Å; Q176-T178 VanDerWaalsContact C-N 3.26Å; Q176-T178 PolarHBondContact O-N 3.23Å; T178-N180 VanDerWaalsContact C-N 3.29Å; T178-N180 PolarHBondContact O-N 3.36Å; T178-L181 WeakPolarHBondContact O-CB 3.47Å; T178-L181 PolarHBondContact O-N 3.02Å; T178-L181 VanDerWaalsContact O-N 3.16Å; T178-V182 WeakPolarHBondContact O-CG2 3.45Å; T178-V182 PolarHBondContact O-N 3.2Å
179T93.9Very high87.5Confident30 Ų3059.9 Ų59.918%0.18435%0.35CS..Hα-helixtrans-57.5-42.9172.5-61.40000111.5C171 S175 Q176 L181 V182 A183C171-T179 HydrophobicContact CB-CG2 3.95Å; S175-T179 PolarHBondContact O-N 3.46Å; S175-T179 PolarHBondContact O-OG1 3.48Å; Q176-T179 PolarHBondContact O-N 2.92Å; T179-L181 PolarHBondContact O-N 3.27Å; T179-V182 PolarHBondContact O-N 2.97Å; T179-A183 PolarHBondContact O-N 3.09Å
180N90.7Very high85.3Confident93 Ų9362.2 Ų62.250%0.49737%0.373SS..Hα-helixtrans-63.5-40.5176.3-67.3-8.9000112.1Q176 P177 T178 V182 A183 G184Q176-N180 PolarHBondContact NE2-OD1 3.45Å; Q176-N180 VanDerWaalsContact O-CG 3.27Å; Q176-N180 PolarHBondContact O-N 3.3Å; Q176-N180 PolarHBondContact O-OD1 3.36Å; P177-N180 PolarHBondContact O-N 2.93Å; T178-N180 VanDerWaalsContact C-N 3.29Å; T178-N180 PolarHBondContact O-N 3.36Å; N180-V182 VanDerWaalsContact C-N 3.34Å; N180-A183 PolarHBondContact O-N 3.23Å; N180-G184 PolarHBondContact O-N 2.89Å
181L90.6Very high83.3Confident38 Ų3873.7 Ų73.720%0.19942%0.417CS..Hα-helixtrans-60.7-45174.5-179.566.4000111.1C128 L135 P177 T178 T179 G184 C185C128-L181 HydrophobicContact CB-CD2 4.48Å; C128-L181 HydrophobicContact CB-CG 4.32Å; L135-L181 HydrophobicContact CD2-CD2 4.03Å; P177-L181 PolarHBondContact O-N 3.42Å; P177-L181 VanDerWaalsContact O-N 3.07Å; T178-L181 WeakPolarHBondContact O-CB 3.47Å; T178-L181 PolarHBondContact O-N 3.02Å; T178-L181 VanDerWaalsContact O-N 3.16Å; T179-L181 PolarHBondContact O-N 3.27Å; L181-G184 PolarHBondContact O-N 3.04Å; L181-C185 WeakPolarHBondContact O-CB 3.39Å; L181-C185 PolarHBondContact O-N 3.37Å; L181-C185 PolarHBondContact O-SG 3.12Å; L181-C185 VanDerWaalsContact O-SG 3.35Å
182V90.4Very high81.1Confident1 Ų178.7 Ų78.71%0.00644%0.442CS..Hα-helixtrans-61.5-45.8177.8175.80000111.4C128 L143 V167 L170 L174 T178 T179 N180 G184 C185 L186C128-V182 VanDerWaalsContact SG-CA 3.57Å; L143-V182 HydrophobicContact CD1-CG2 4.39Å; L143-V182 HydrophobicContact CD2-CG2 4.45Å; V167-V182 HydrophobicContact CG1-CG1 4.37Å; L170-V182 HydrophobicContact CB-CG1 4.4Å; L170-V182 HydrophobicContact CD1-CG1 4.35Å; L174-V182 HydrophobicContact CD1-CG2 4.36Å; T178-V182 WeakPolarHBondContact O-CG2 3.45Å; T178-V182 PolarHBondContact O-N 3.2Å; T179-V182 PolarHBondContact O-N 2.97Å; N180-V182 VanDerWaalsContact C-N 3.34Å; V182-G184 VanDerWaalsContact C-N 3.32Å; V182-G184 PolarHBondContact O-N 3.5Å; V182-C185 PolarHBondContact O-N 3.5Å; V182-L186 HydrophobicContact CG1-CD1 3.84Å; V182-L186 WeakPolarHBondContact O-CB 3.48Å; V182-L186 WeakPolarHBondContact O-CG 3.43Å; V182-L186 PolarHBondContact O-N 2.91Å; V182-L186 VanDerWaalsContact O-N 3.08Å
183A86.6Confident79Confident29 Ų2974.3 Ų74.324%0.2442%0.423CS..Hα-helixtrans-59.9-41.9176.500000112.2T179 N180 Q187 L188T179-A183 PolarHBondContact O-N 3.09Å; N180-A183 PolarHBondContact O-N 3.23Å; A183-Q187 PolarHBondContact O-N 3.16Å; A183-L188 PolarHBondContact O-N 3.42Å; A183-L188 VanDerWaalsContact O-N 3.13Å
184G85.1Confident76.6Confident54 Ų5480.3 Ų80.356%0.55744%0.441SS*.Hα-helixtrans-66.5-44.117700000113.3N180 L181 V182 L186 Q187N180-G184 PolarHBondContact O-N 2.89Å; L181-G184 PolarHBondContact O-N 3.04Å; V182-G184 VanDerWaalsContact C-N 3.32Å; V182-G184 PolarHBondContact O-N 3.5Å; G184-L186 VanDerWaalsContact C-N 3.28Å; G184-L186 PolarHBondContact O-N 2.95Å; G184-Q187 PolarHBondContact O-N 3.44Å
185C84.8Confident74.3Confident65 Ų6582.8 Ų82.844%0.43946%0.458SS..Hα-helixtrans-66.2-29.6178.8-730000113.2C128 L181 V182 Q187C128-C185 HydrophobicContact CB-CB 3.87Å; C128-C185 VanDerWaalsContact CB-SG 3.55Å; C128-C185 WeakPolarHBondContact SG-CB 3.49Å; L181-C185 WeakPolarHBondContact O-CB 3.39Å; L181-C185 PolarHBondContact O-N 3.37Å; L181-C185 PolarHBondContact O-SG 3.12Å; L181-C185 VanDerWaalsContact O-SG 3.35Å; V182-C185 PolarHBondContact O-N 3.5Å; C185-Q187 VanDerWaalsContact C-N 3.34Å
186L80.1Confident71.4Confident56 Ų5686.1 Ų86.129%0.29347%0.472SS..THydrogen-bonded Turntrans-93.68.3178.4-62.6175.6000113.1V167 L170 V182 G184 L188V167-L186 HydrophobicContact CG2-CD1 3.45Å; V167-L186 VanDerWaalsContact CG2-CD1 3.45Å; L170-L186 HydrophobicContact CD1-CD1 3.99Å; V182-L186 HydrophobicContact CG1-CD1 3.84Å; V182-L186 WeakPolarHBondContact O-CB 3.48Å; V182-L186 WeakPolarHBondContact O-CG 3.43Å; V182-L186 PolarHBondContact O-N 2.91Å; V182-L186 VanDerWaalsContact O-N 3.08Å; G184-L186 VanDerWaalsContact C-N 3.28Å; G184-L186 PolarHBondContact O-N 2.95Å; L186-L188 HydrophobicContact CB-CG 4.26Å; L186-L188 PolarHBondContact O-N 3.32Å; L186-L188 VanDerWaalsContact O-N 3.16Å
187Q72.7Confident69.3Low178 Ų17888.7 Ų88.783%0.83248%0.484SS*.THydrogen-bonded Turntrans5038.2178-60.6-179.86.400113.2A183 G184 C185 N189A183-Q187 PolarHBondContact O-N 3.16Å; G184-Q187 PolarHBondContact O-N 3.44Å; C185-Q187 VanDerWaalsContact C-N 3.34Å; Q187-N189 PolarHBondContact O-N 2.94Å
188L63.4Low66.7Low31 Ų3191.1 Ų91.116%0.16249%0.492CS..  trans-73.5129175.2-61.4-175.9000109.3L163 V167 A183 L186 A190 F193L163-L188 HydrophobicContact CD1-CD2 4.39Å; L163-L188 HydrophobicContact CD2-CD2 3.58Å; L163-L188 HydrophobicContact CG-CD2 3.81Å; V167-L188 HydrophobicContact CB-CD1 3.88Å; V167-L188 HydrophobicContact CG1-CD1 3.62Å; V167-L188 HydrophobicContact CG2-CD1 3.61Å; V167-L188 HydrophobicContact CG2-CD2 4.45Å; V167-L188 HydrophobicContact CG2-CG 4.39Å; A183-L188 PolarHBondContact O-N 3.42Å; A183-L188 VanDerWaalsContact O-N 3.13Å; L186-L188 HydrophobicContact CB-CG 4.26Å; L186-L188 PolarHBondContact O-N 3.32Å; L186-L188 VanDerWaalsContact O-N 3.16Å; L188-A190 PolarHBondContact O-N 3.21Å; L188-A190 VanDerWaalsContact O-N 3.07Å; L188-F193 HydrophobicContact CD1-CD2 4.44Å; L188-F193 HydrophobicContact CD1-CE2 4.1Å
189N49.4Very low64.5Low134 Ų13494.2 Ų94.272%0.71753%0.526SS*.  trans-56.5117.5173.3-86.4-51.1000109.6Q187 R191 N192Q187-N189 PolarHBondContact O-N 2.94Å; N189-R191 PolarHBondContact O-N 3.1Å; N189-N192 PolarHBondContact O-N 3.15Å
190A50.1Low61.7Low93 Ų9399.9 Ų99.977%0.76955%0.55SS**G310 helixtrans-55.8-17.3-174.300000114.5L188 N192L188-A190 PolarHBondContact O-N 3.21Å; L188-A190 VanDerWaalsContact O-N 3.07Å; A190-N192 VanDerWaalsContact C-N 3.27Å; A190-N192 PolarHBondContact O-N 2.9Å
191R52.5Low59.8Low242 Ų242100.4 Ų100.491%0.91356%0.557SS**G310 helixtrans-72.4-10.7179.2-69-168.398.51656.7114.9N189N189-R191 PolarHBondContact O-N 3.1Å
192N50.5Low57.5Low123 Ų123106.6 Ų106.666%0.65859%0.587SS**G310 helixtrans-95.8-7.7-176.8-76.311.5000115.2N189 A190N189-N192 PolarHBondContact O-N 3.15Å; A190-N192 VanDerWaalsContact C-N 3.27Å; A190-N192 PolarHBondContact O-N 2.9Å
193F50Low55.4Low68 Ų68115.2 Ų115.230%0.29862%0.624SS.*  trans-136.246.9-169.6-64.3-74.5000115.2L164 L188 T195L164-F193 HydrophobicContact CD1-CE1 3.31Å; L164-F193 HydrophobicContact CD1-CE2 4.46Å; L164-F193 HydrophobicContact CD1-CZ 3.18Å; L164-F193 HydrophobicContact CD2-CZ 4.29Å; L164-F193 HydrophobicContact CG-CZ 4.21Å; L188-F193 HydrophobicContact CD1-CD2 4.44Å; L188-F193 HydrophobicContact CD1-CE2 4.1Å; F193-T195 PolarHBondContact O-N 3.12Å
194L44.3Very low53.5Low179 Ų179120 Ų12094%0.93766%0.656SS**  trans-7177.9151.8-71.3175000107.8
195T48.3Very low51.4Low73 Ų73119.1 Ų119.145%0.44865%0.647SS.*  trans-90.8114.9171.42.50000108.2F193 V201F193-T195 PolarHBondContact O-N 3.12Å; T195-V201 HydrophobicContact CG2-CG2 4.37Å
196D35.3Very low49.5Very low116 Ų116125 Ų12562%0.6266%0.66SS**  trans-64145169.1-147.3-16.4000109.7N198D196-N198 PolarHBondContact O-N 3.14Å
197H49.8Very low47.7Very low158 Ų158126 Ų12673%0.73167%0.672SS**THydrogen-bonded Turntrans-80.929.2-164.641.3-80.9000114
198N37.4Very low46.3Very low140 Ų140123.1 Ų123.175%0.74967%0.668SS**THydrogen-bonded Turntrans-125.415.3-170.2-10430.6000116.4D196 E200D196-N198 PolarHBondContact O-N 3.14Å; N198-E200 VanDerWaalsContact C-N 3.3Å; N198-E200 PolarHBondContact O-N 3.32Å
199G48.3Very low45.4Very low77 Ų77128.9 Ų128.979%0.79469%0.689SS**SBendtrans76.38.8167.400000116.3
200E35.3Very low45Very low149 Ų149127.9 Ų127.970%0.69668%0.68SS**  trans-120.9118.2173-74.1-75.6142.100108.9N198 M202N198-E200 VanDerWaalsContact C-N 3.3Å; N198-E200 PolarHBondContact O-N 3.32Å; E200-M202 PolarHBondContact O-N 3.02Å
201V50.2Low45Very low104 Ų104127.6 Ų127.663%0.6368%0.678SS**  trans-90.292.5178.5-1760000108.5T195 F203T195-V201 HydrophobicContact CG2-CG2 4.37Å; V201-F203 PolarHBondContact O-N 2.87Å
202M43.8Very low44.8Very low169 Ų169122.4 Ų122.483%0.83367%0.666SS**  trans-83.4108.7166.7-75.8-83.2164.600108.8E200 S204E200-M202 PolarHBondContact O-N 3.02Å; M202-S204 PolarHBondContact O-N 3.45Å
203F44.9Very low44.6Very low181 Ų181124.4 Ų124.479%0.79467%0.665SS**  trans-76.1118.5173.1-158.2-106.3000108.4V201 G205V201-F203 PolarHBondContact O-N 2.87Å; F203-G205 PolarHBondContact O-N 3.36Å
204S46.1Very low43.9Very low130 Ų130126.6 Ų126.691%0.90969%0.689SS**  trans-7569.1157.5-159.40000107.8M202M202-S204 PolarHBondContact O-N 3.45Å
205G41.2Very low43.6Very low36 Ų36128.5 Ų128.537%0.37169%0.685SS.*  trans-74.7138.5163.800000107.9F203 S207F203-G205 PolarHBondContact O-N 3.36Å; G205-S207 PolarHBondContact O-N 3.24Å
206R46.3Very low43.6Very low188 Ų188131.2 Ų131.271%0.70970%0.702SS**  trans-32.2129164.8-90.2173.7152.7-109.6-13.3111.4E210R206-E210 VanDerWaalsContact CZ-CD 3.49Å; R206-E210 IonicContact CZ-OE1 3.22Å; R206-E210 VanDerWaalsContact CZ-OE1 3.31Å; R206-E210 IonicContact CZ-OE2 3.03Å; R206-E210 VanDerWaalsContact CZ-OE2 3.22Å; R206-E210 IonicContact NE-OE2 3.39Å; R206-E210 IonicContact NH1-OE1 3.32Å; R206-E210 PolarHBondContact NH1-OE1 3.13Å; R206-E210 IonicContact NH1-OE2 2.73Å; R206-E210 PolarHBondContact NH1-OE2 3.1Å; R206-E210 IonicContact NH2-OE1 3.37Å; R206-E210 PolarHBondContact NH2-OE1 3.43Å; R206-E210 IonicContact NH2-OE2 3.31Å; R206-E210 PolarHBondContact NH2-OE2 3.07Å
207S41.4Very low43.3Very low76 Ų76131.5 Ų131.553%0.53171%0.713SS.*  trans-53.1135.9173176.10000110.3G205 Y209 E210G205-S207 PolarHBondContact O-N 3.24Å; S207-Y209 PolarHBondContact O-N 3.46Å; S207-Y209 WeakPolarHBondContact OG-CB 3.44Å; S207-Y209 PolarHBondContact OG-N 2.92Å; S207-E210 PolarHBondContact O-N 3.29Å
208P44.4Very low42.9Very low118 Ų118129.2 Ų129.277%0.76672%0.715SS**G310 helixtrans-59.3-11.2174.5-2133.3000113.5
209Y42.8Very low42.9Very low152 Ų152129.5 Ų129.560%0.59672%0.716SS**G310 helixtrans-75.7-21.2-178.4-137-96.6000113.8S207 A211 Y213S207-Y209 PolarHBondContact O-N 3.46Å; S207-Y209 WeakPolarHBondContact OG-CB 3.44Å; S207-Y209 PolarHBondContact OG-N 2.92Å; Y209-A211 VanDerWaalsContact C-N 3.26Å; Y209-A211 PolarHBondContact O-N 3.2Å; Y209-Y213 HydrophobicContact CE1-CE2 4.2Å
210E42.5Very low42.6Very low113 Ų113133.7 Ų133.753%0.52872%0.717SS.*G310 helixtrans-77.7-11.3-177.6-148.2-175.2151.200112.9R206 S207R206-E210 VanDerWaalsContact CZ-CD 3.49Å; R206-E210 IonicContact CZ-OE1 3.22Å; R206-E210 VanDerWaalsContact CZ-OE1 3.31Å; R206-E210 IonicContact CZ-OE2 3.03Å; R206-E210 VanDerWaalsContact CZ-OE2 3.22Å; R206-E210 IonicContact NE-OE2 3.39Å; R206-E210 IonicContact NH1-OE1 3.32Å; R206-E210 PolarHBondContact NH1-OE1 3.13Å; R206-E210 IonicContact NH1-OE2 2.73Å; R206-E210 PolarHBondContact NH1-OE2 3.1Å; R206-E210 IonicContact NH2-OE1 3.37Å; R206-E210 PolarHBondContact NH2-OE1 3.43Å; R206-E210 IonicContact NH2-OE2 3.31Å; R206-E210 PolarHBondContact NH2-OE2 3.07Å; S207-E210 PolarHBondContact O-N 3.29Å
211A49.8Very low42.6Very low88 Ų88133.9 Ų133.973%0.72772%0.723SS**G310 helixtrans-86.4-12.8177.600000113.9Y209Y209-A211 VanDerWaalsContact C-N 3.26Å; Y209-A211 PolarHBondContact O-N 3.2Å
212M48.5Very low42Very low132 Ų132134 Ų13465%0.6573%0.729SS**SBendtrans-87-10-176.2-92.5-156.4-90.200115.1
213Y46.2Very low42.3Very low165 Ų165131.4 Ų131.465%0.64772%0.724SS**  trans-129.368.4178.7-58.3-74.8000111.4Y209 Y215Y209-Y213 HydrophobicContact CE1-CE2 4.2Å; Y213-Y215 PolarHBondContact O-N 3.02Å
214S34.1Very low42.7Very low115 Ų115128.4 Ų128.480%0.80472%0.723SS**  trans-80.797.5163.2-1470000107.9T216S214-T216 PolarHBondContact O-N 3.05Å
215Y39.3Very low42Very low219 Ų219125.4 Ų125.486%0.85971%0.712SS**  trans-69114.2169.8-105.4-91.6000108.4Y213 S217Y213-Y215 PolarHBondContact O-N 3.02Å; Y215-S217 PolarHBondContact O-N 2.96Å
216T47.8Very low42Very low129 Ų129132.9 Ų132.979%0.79174%0.738SS**  trans-61.6109.9165.153.80000108.3S214S214-T216 PolarHBondContact O-N 3.05Å
217S29.4Very low41.6Very low123 Ų123129.4 Ų129.486%0.8674%0.742SS**  trans-112.1109.7164.1-160.60000107.9Y215Y215-S217 PolarHBondContact O-N 2.96Å
218S40.8Very low41.1Very low109 Ų109129.5 Ų129.576%0.76276%0.755SS**  trans-69.1137-177.9-44.50000111.3
219D37Very low40.5Very low147 Ų147127.6 Ų127.679%0.78676%0.757SS**  trans-53.3138.3160.4-68.7-61.3000111.4
220M43Very low40.2Very low164 Ų164124.4 Ų124.481%0.80876%0.762SS**  trans-164.6121.4146.1-93.4-49.210700111.8
221N36.2Very low39.9Very low153 Ų153126.9 Ų126.982%0.81878%0.778SS**  trans42.3124.7141.7-88.727.1000122.8
222S37Very low39.3Very low107 Ų107129.2 Ų129.275%0.74878%0.778SS**  trans-83178.8146.4-53.60000110.7
223P49.3Very low38.6Very low115 Ų115129.3 Ų129.375%0.74779%0.786SS**  cis-140.8-144.61.742.3-19.7000112
224P53.9Low38Very low117 Ų117124.5 Ų124.576%0.7679%0.787SS**  cis-126.3167.8-41.929.9-10.4000114.9
225G31.4Very low38.3Very low67 Ų67125.1 Ų125.169%0.69179%0.791SS**  trans100.2141.1137.800000121.2
226H41.8Very low38.4Very low194 Ų194123.7 Ų123.790%0.89879%0.79SS**  trans104.4127.4151.8-59.1-72.7000121.6
227S36.8Very low38.6Very low114 Ų114123 Ų12380%0.79779%0.787SS**  trans-72.8162.6173.548.70000115.6
228G32.2Very low38.7Very low78 Ų78126.8 Ų126.880%0.80479%0.788SS**  trans111.8115.1159.700000112.3
229G31.6Very low38.8Very low78 Ų78131.6 Ų131.680%0.80479%0.79SS**  92.796.175.300000108.2
230A34.9Very low38.4Very low86 Ų86132.9 Ų132.971%0.71179%0.791SS**  100.5137.490.200000112.4
231L37.8Very low37.8Very low164 Ų164135 Ų13586%0.85979%0.791SS**  trans71.4147.5162.2-63.2135.2000116.8
232D36Very low37.5Very low137 Ų137133 Ų13373%0.73379%0.789SS**  cis-179173.1-25.5-143.9-42.2000104.3
233T34.9Very low37.5Very low134 Ų134138.5 Ų138.582%0.82280%0.795SS**  trans85.1119170.5-360000114.6
234G32.6Very low36.7Very low64 Ų64136.9 Ų136.966%0.6679%0.787SS**  cis137.796.811.900000108.9
235S40.1Very low35.6Very low128 Ų128136.7 Ų136.790%0.89579%0.788SS**  trans-170.899.9152.813.70000111.1
236K42.4Very low35.8Very low190 Ų190138 Ų13883%0.82679%0.792SS**  trans-77.1163.3159.3-79.2179.2-178.4169.70108.7
237P50.8Low35.8Very low114 Ų114139.1 Ų139.174%0.7479%0.79SS**  cis-141.7-179.938.741.1-19.7000113.6
238F33.1Very low35.7Very low202 Ų202142 Ų14289%0.88679%0.791SS**  cis-159.9155.931.8-140-89.9000107.3
239R41.4Very low35.8Very low210 Ų210142.8 Ų142.879%0.79278%0.78SS**  trans-86.6168.4-162.2-49.9-165.6-154-122.813.4116
240H29.4Very low36Very low175 Ų175149.3 Ų149.381%0.8178%0.782SS**  -160127.6111.3-115.1-95.7000115
241Y30.2Very low36Very low209 Ų209155 Ų15582%0.8279%0.791SS**  trans53.1111.9159.6-105.7-97.9000123.7
242S30.4Very low35.7Very low109 Ų109154.9 Ų154.976%0.76279%0.786SS**  trans-136.5143.7156.4-172.50000107.5
243Y37.2Very low35.7Very low223 Ų223155.5 Ų155.588%0.87579%0.789SS**  trans-130.5100.8160.8-170.2-100000108.1
244S31.4Very low36Very low82 Ų82155 Ų15557%0.57379%0.788SS**  trans-53.1148.1165.7-87.40000111.3
245S31.2Very low36.2Very low113 Ų113157.2 Ų157.279%0.7979%0.794SS**  56.6136.870-143.40000111.2
246A35.1Very low37Very low93 Ų93156 Ų15677%0.76978%0.783SS**  cis-163.7174.415.500000108.7
247Y42.9Very low36.5Very low219 Ų219154 Ų15486%0.85978%0.781SS**  trans-60.3153171.1-117-109.2000116.1
248E34.9Very low35.7Very low175 Ų175154 Ų15482%0.81878%0.784SS**  trans-161.5136.5140.5-92.5-133.6132.600107.5
249T32.9Very low35.8Very low93 Ų93148.3 Ų148.357%0.57178%0.782SS**  cis102.6104.738.5-61.10000112.1
250Y35.7Very low35.6Very low216 Ų216144 Ų14485%0.84778%0.784SS**  trans60.5123.5151.3-76.9-110.2000122.2
251F35.2Very low36.6Very low205 Ų205141.4 Ų141.490%0.89978%0.783SS**  -163163.5120.6-108.9-76000112
252E31.9Very low36.8Very low161 Ų161140.6 Ų140.675%0.75279%0.786SS**  trans-85.4152.6-161.7-166.9171.4166.700114.2
253N36.2Very low37.5Very low150 Ų150144.3 Ų144.380%0.80279%0.789SS**  trans-9.5154.1168.9-70.4-59000120.8
254P40.8Very low37.8Very low125 Ų125141.2 Ų141.281%0.81279%0.788SS**  cis-146.7168.943.538.6-16.4000118
255S36.1Very low38.3Very low110 Ų110140.7 Ų140.777%0.76980%0.795SS**  trans-79.7168.9161.1-151.30000109.9
256P57.8Low38.9Very low103 Ų103144.3 Ų144.367%0.66980%0.8SS**  cis-141.2171.717.639.9-18.4000116.7
257D31.6Very low39.5Very low146 Ų146148.1 Ų148.178%0.78181%0.806SS**  160.3131.6120.7-101.1-34000115.2
258S34.7Very low40Very low115 Ų115143 Ų14380%0.80480%0.802SS**  trans45.5116.5147.563.10000122.8
259G34.5Very low40.8Very low82 Ų82140.2 Ų140.285%0.84580%0.799SS**  trans175.677.3157.100000114.2
260S37.2Very low42Very low121 Ų121142 Ų14285%0.84681%0.812SS**  trans-78.7174.9166.8-65.10000111.5
261P49.9Very low42.6Very low119 Ų119139.5 Ų139.577%0.77381%0.81SS**  -124.9160.3-5335.4-20.6000111.1
262H36.2Very low42.8Very low193 Ų193136.7 Ų136.789%0.89481%0.805SS**  trans-138.4126.5155.1-146.157.4000111.4
263F44.8Very low43.1Very low186 Ų186137.4 Ų137.482%0.81681%0.806SS**  trans-84.5118.2-173.7-144-98.6000106.9
264D42.7Very low43Very low159 Ų159137.8 Ų137.885%0.8581%0.808SS**  trans-163.6129.4134.6-109.6-37.1000111.3
265G42.1Very low43Very low71 Ų71134.3 Ų134.373%0.73280%0.795SS**  trans-72145.4-16900000113.2
266Q44.9Very low43.7Very low189 Ų189136.6 Ų136.688%0.88380%0.796SS**  trans-65.3138178.9-70.6-169.5-7.600113.3S268Q266-S268 PolarHBondContact O-N 2.78Å
267L46.9Very low42.7Very low173 Ų173141.5 Ų141.591%0.90681%0.808SS**  trans-50.1112.6162.9-61.6159.4000110.8
268S53.2Low43.1Very low112 Ų112140.3 Ų140.378%0.78381%0.811SS**PPolyproline II helixtrans-85.4139.7162.8-71.40000110.2Q266Q266-S268 PolarHBondContact O-N 2.78Å
269P51.9Low43.5Very low115 Ų115142.9 Ų142.975%0.74782%0.815SS**PPolyproline II helixtrans-71.7148.617628-31.8000111.7M271P269-M271 PolarHBondContact O-N 3.2Å
270P58Low43.7Very low131 Ų131148.7 Ų148.785%0.85182%0.817SS**PPolyproline II helixtrans-73.2129.1-17128-33000112.7
271M47.4Very low43.7Very low163 Ų163150 Ų15080%0.80381%0.809SS**PPolyproline II helixtrans-64.4124.8167.5-85.7-73.5-5600110.8P269P269-M271 PolarHBondContact O-N 3.2Å
272N39.1Very low42.9Very low147 Ų147151.5 Ų151.579%0.78681%0.81SS**  trans-92.7110.9176.3-157.4-10.9000109.5
273F39Very low42.8Very low176 Ų176148.2 Ų148.277%0.77280%0.8SS**  trans-11388.7178.3-140.5-88000108.9G275F273-G275 VanDerWaalsContact C-N 3.27Å; F273-G275 PolarHBondContact O-N 2.88Å
274N35Very low43.1Very low157 Ų157144.3 Ų144.384%0.8479%0.793SS**  trans-82.577.7171.3-118.235.4000109.3
275G39.1Very low42.8Very low52 Ų52145.3 Ų145.354%0.53679%0.793SS.*  trans-84.9115.1168.800000110.6F273 F277F273-G275 VanDerWaalsContact C-N 3.27Å; F273-G275 PolarHBondContact O-N 2.88Å; G275-F277 VanDerWaalsContact C-N 3.32Å; G275-F277 PolarHBondContact O-N 3.42Å
276I51.9Low42.5Very low158 Ų158148 Ų14881%0.8179%0.79SS**SBendtrans-74.483.3172.3-59.2159.9000107.7
277F36.6Very low42.1Very low207 Ų207149.9 Ų149.991%0.90879%0.791SS**  trans-168.288156.1-88.1-68.4000108.3G275 L279G275-F277 VanDerWaalsContact C-N 3.32Å; G275-F277 PolarHBondContact O-N 3.42Å; F277-L279 PolarHBondContact O-N 2.89Å
278S40.3Very low41.5Very low120 Ų120144.8 Ų144.884%0.83978%0.78SS**  trans-79.795.1163.8-70.10000109K280S278-K280 PolarHBondContact O-N 3.27Å
279L42.4Very low40.8Very low170 Ų170149.4 Ų149.489%0.8979%0.786SS**  trans-67.5103.6157.9-172.273000107.3F277F277-L279 PolarHBondContact O-N 2.89Å
280K39.2Very low40.1Very low203 Ų203148.9 Ų148.988%0.88379%0.785SS**  trans-89.4112.7167.5-87.1-172.2168.2-172.80108.7S278S278-K280 PolarHBondContact O-N 3.27Å
281H37.9Very low38.7Very low148 Ų148148.2 Ų148.269%0.68578%0.783SS**  trans-94.9125.1158.3-176.3-77000107.3D283H281-D283 IonicContact CE1-OD2 3.97Å
282D32.1Very low38.6Very low151 Ų151149.1 Ų149.181%0.80779%0.785SS**  trans-168.3159.7143.1-128.3-92.7000111.3
283D35Very low38.5Very low124 Ų124152.8 Ų152.866%0.66379%0.79SS**  trans-84.4177.9-138.3-92.7-72.1000118.5H281H281-D283 IonicContact CE1-OD2 3.97Å
284P49.9Very low38.6Very low104 Ų104147.7 Ų147.768%0.67579%0.787SS**  trans-98.2150.1-16038.1-31.8000114.1
285Q36.3Very low38.9Very low181 Ų181145.9 Ų145.985%0.84678%0.781SS**  trans-178.7130.5139.4-104.8168.9-10.800114.2
286D36.8Very low38.9Very low126 Ų126154.9 Ų154.967%0.67480%0.799SS**  trans60.2120140.8-71.6-47.7000124.2
287Y37.1Very low38.3Very low230 Ų230157.5 Ų157.590%0.90280%0.8SS**  trans51.5114.7137.7-92.3-92.7000120.3
288G32.6Very low38.4Very low66 Ų66153.9 Ų153.968%0.6880%0.799SS**  trans158.293.3145.900000116.8
289K38.9Very low38.3Very low209 Ų209151.8 Ų151.891%0.90980%0.797SS**  trans50.5124.2136.2-63.8172-179.5175.50119.2
290S36.9Very low38.3Very low104 Ų104148.3 Ų148.373%0.72779%0.792SS**  trans91.998.8146.8-142.60000116.6
291S29.8Very low38.6Very low116 Ų116144.9 Ų144.981%0.81179%0.791SS**  trans-126.789.8159.3-78.90000109.1
292H44.7Very low38.5Very low183 Ų183141.3 Ų141.385%0.84779%0.794SS**  trans-87.398.9155.8-83.8-72.5000107.8
293Y38Very low38.8Very low223 Ų223146.2 Ų146.288%0.87580%0.801SS**  trans-105.3106.3161.5-101-87.2000108.8
294G39.4Very low38.8Very low69 Ų69146.2 Ų146.271%0.71181%0.811SS**  trans-75130.5176.100000111.7R296G294-R296 PolarHBondContact O-N 2.79Å
295V41.6Very low38Very low119 Ų119145.7 Ų145.772%0.72182%0.815SS**  trans-73.6115.9172.7-179.20000109.1Y297V295-Y297 HydrophobicContact CG1-CD2 3.61Å; V295-Y297 HydrophobicContact CG1-CE2 3.48Å; V295-Y297 VanDerWaalsContact CG1-CE2 3.48Å
296R40.5Very low38.2Very low242 Ų242145.3 Ų145.391%0.91382%0.818SS**  trans-87.1104.9170.4-62.4-86.2-146.9-154.61.7108.4G294G294-R296 PolarHBondContact O-N 2.79Å
297Y38.9Very low38.1Very low212 Ų212144.1 Ų144.183%0.83183%0.826SS**  trans-85124.6164.4-86-86.3000109.7V295 G299V295-Y297 HydrophobicContact CG1-CD2 3.61Å; V295-Y297 HydrophobicContact CG1-CE2 3.48Å; V295-Y297 VanDerWaalsContact CG1-CE2 3.48Å; Y297-G299 PolarHBondContact O-N 3.24Å
298C37.5Very low38.5Very low131 Ų131138.4 Ų138.489%0.88582%0.817SS**  trans-72.9115.1167.2-68.30000109.3
299G37.9Very low38.6Very low77 Ų77143 Ų14379%0.79483%0.826SS**PPolyproline II helixtrans-78.1127172.700000111.5Y297Y297-G299 PolarHBondContact O-N 3.24Å
300A43.2Very low38.4Very low96 Ų96138.4 Ų138.479%0.79382%0.82SS**PPolyproline II helixtrans-76.5140.616700000110.1
301P45.1Very low38.9Very low131 Ų131141.7 Ų141.785%0.85183%0.826SS**PPolyproline II helixtrans-77.6130.6177.829.5-30.3000111.1
302G36.6Very low39.5Very low73 Ų73147 Ų14775%0.75383%0.829SS**PPolyproline II helixtrans-71.4159.1177.500000113.8
303R38.7Very low39.3Very low254 Ų254148.6 Ų148.696%0.95883%0.828SS**PPolyproline II helixtrans-64.4144.7-179.5-73.5172152.5-119.9-2112.8
304S34.3Very low39.2Very low124 Ų124143.8 Ų143.887%0.86782%0.822SS**PPolyproline II helixtrans-69.3153.2-174.7-43.40000115.6
305A33.7Very low38.8Very low93 Ų93145.9 Ų145.977%0.76983%0.826SS**  trans-131.8119.4157.300000110.7
306L39.2Very low39.1Very low174 Ų174145.1 Ų145.191%0.91182%0.823SS**  trans42.9115.8145.9-55.6171.3000121.9
307A35.9Very low39Very low100 Ų100142.7 Ų142.783%0.82682%0.822SS**  176.8156.6117.400000112.2
308P45.7Very low38.9Very low111 Ų111136.8 Ų136.872%0.72182%0.817SS**  trans-102.2169.1-16238.9-31.2000114.5
309N33.9Very low38.9Very low163 Ų163142.3 Ų142.387%0.87282%0.819SS**  trans100.199.3172-61.2-36.3000116.3
310S34.6Very low38.9Very low112 Ų112147.9 Ų147.978%0.78382%0.822SS**  trans-161.6119.6133.3-169.20000109.8
311M47.4Very low39.2Very low172 Ų172148.5 Ų148.585%0.84782%0.818SS**  trans-85.9120.8172.9-70.7-135.2-66.700109.5
312Y41.9Very low38.8Very low227 Ų227152.8 Ų152.889%0.8982%0.819SS**  trans-135131.8152.4-104.6-90.7000109.5
313R41.9Very low38.8Very low218 Ų218156.1 Ų156.182%0.82382%0.819SS**  trans-92.8142.1-173.6-87-145.1-179.5-159.94.3111.9
314V34.8Very low38.8Very low122 Ų122151.2 Ų151.274%0.73981%0.812SS**  trans69.2127.4139.1179.60000116
315S31.2Very low39.2Very low113 Ų113153.3 Ų153.379%0.7981%0.807SS**  -160.8159.562.7-143.20000114.1
316P48.3Very low39.5Very low103 Ų103154.8 Ų154.867%0.66981%0.807SS**  trans-106.8134-165.536.7-24.1000113
317E37.9Very low39.2Very low190 Ų190156.2 Ų156.289%0.88880%0.8SS**  trans-164.2100.8154.8-156.561.6-128.200110
318A36.8Very low39.1Very low89 Ų89156.8 Ų156.874%0.73680%0.798SS**  trans165.672.9155.700000109.5
319R39.1Very low38.4Very low246 Ų246156.3 Ų156.393%0.92879%0.786SS**  trans-90.5100.8162.4-102-179.7-175.8151.81.6108.7
320F37.8Very low38.4Very low194 Ų194154 Ų15485%0.85178%0.782SS**  trans-75.3128.5153-81.1-85.8000108.1
321P47.7Very low38.2Very low109 Ų109156.8 Ų156.871%0.70878%0.781SS**  trans-92111178.833-25.6000108.8
322Y36.5Very low37.7Very low221 Ų221157.6 Ų157.687%0.86778%0.782SS**  trans-179.584141.4-102.6-73.1000108.1
323D38.1Very low37.3Very low143 Ų143153.2 Ų153.277%0.76578%0.779SS**  trans-111.1104162.3-103.7-26.3000108.6H325D323-H325 PolarHBondContact O-N 3.1Å; D323-H325 VanDerWaalsContact O-N 3.08Å; D323-H325 PolarHBondContact O-ND1 2.99Å; D323-H325 VanDerWaalsContact O-ND1 3.08Å
324L39Very low37Very low152 Ų152152.1 Ų152.180%0.79678%0.784SS**  trans-74.291.3177.1-15981.4000108.5V326L324-V326 PolarHBondContact O-N 3.45Å
325H42.8Very low37Very low167 Ų167149.5 Ų149.577%0.77378%0.782SS**  trans-7199.1175.1-69.581.9000110.2D323 R327D323-H325 PolarHBondContact O-N 3.1Å; D323-H325 VanDerWaalsContact O-N 3.08Å; D323-H325 PolarHBondContact O-ND1 2.99Å; D323-H325 VanDerWaalsContact O-ND1 3.08Å; H325-R327 PolarHBondContact O-N 3.18Å
326V38.6Very low37.2Very low125 Ų125153 Ų15376%0.75879%0.785SS**  trans-71.595.9164.5177.20000107.8L324 S328L324-V326 PolarHBondContact O-N 3.45Å; V326-S328 PolarHBondContact O-N 3.29Å; V326-S328 VanDerWaalsContact O-N 3.1Å
327R33.9Very low36.9Very low204 Ų204153.6 Ų153.677%0.7779%0.787SS**  trans-71.494.8171-174.1176.2-175.7179.3-1.4108.9H325 Q329H325-R327 PolarHBondContact O-N 3.18Å; R327-Q329 VanDerWaalsContact NE-NE2 3.11Å; R327-Q329 VanDerWaalsContact NH2-NE2 3.19Å; R327-Q329 PolarHBondContact O-N 2.74Å; R327-Q329 VanDerWaalsContact O-N 3.13Å
328S33.8Very low36.9Very low112 Ų112152.6 Ų152.678%0.78379%0.788SS**  trans-68.797.6160.938.30000108.6V326V326-S328 PolarHBondContact O-N 3.29Å; V326-S328 VanDerWaalsContact O-N 3.1Å
329Q31.3Very low37.1Very low101 Ų101151.9 Ų151.947%0.47279%0.789SS.*  trans-95.899.8171.6-147.6177.9110.500108.5R327 F331R327-Q329 VanDerWaalsContact NE-NE2 3.11Å; R327-Q329 VanDerWaalsContact NH2-NE2 3.19Å; R327-Q329 PolarHBondContact O-N 2.74Å; R327-Q329 VanDerWaalsContact O-N 3.13Å; Q329-F331 HydrophobicContact CG-CE2 4.29Å; Q329-F331 PolarHBondContact O-N 2.82Å; Q329-F331 VanDerWaalsContact OE1-CZ 3.27Å
330S32.4Very low37.1Very low114 Ų114146.2 Ų146.280%0.79779%0.787SS**  trans-70.7114.6167.945.50000109.7
331F31.7Very low37.1Very low170 Ų170147.3 Ų147.375%0.74679%0.787SS**  trans-95.8117.2163.1-87.3-80.7000109.4Q329Q329-F331 HydrophobicContact CG-CE2 4.29Å; Q329-F331 PolarHBondContact O-N 2.82Å; Q329-F331 VanDerWaalsContact OE1-CZ 3.27Å
332Q35.8Very low36.7Very low189 Ų189151 Ų15188%0.88380%0.795SS**  trans-73126.5162-76.7173.4-15.300108.5
333T34.7Very low36.7Very low135 Ų135151.6 Ų151.683%0.82881%0.813SS**  trans-116.6100.516139.40000108.2
334Q35.2Very low36.6Very low195 Ų195152.1 Ų152.191%0.91182%0.815SS**  trans-64.8129.7143.5-68.3178.4-23.300105.1
335G34.7Very low36.5Very low68 Ų68152.1 Ų152.170%0.70182%0.816SS**  cis110.499.539.300000105.5
336E36Very low36.2Very low185 Ų185151.2 Ų151.286%0.86482%0.819SS**  trans-178.7124.8145.1-104.3178.4-173.600113.3
337V41.3Very low36Very low117 Ų117152.8 Ų152.871%0.70982%0.822SS**  trans37.1115.2147.9-77.80000121.1
338N37.1Very low36.2Very low169 Ų169149.6 Ų149.690%0.90483%0.826SS**  -160.5125.6115.2-96.7-36000111.1
339G41.7Very low36.3Very low74 Ų74152.1 Ų152.176%0.76383%0.828SS**  trans-71.4151.6-177.300000112.9
340S39.4Very low36.7Very low126 Ų126155.7 Ų155.788%0.88185%0.854SS**  trans-141.6134.2161.4-144.70000110.1
341Y37.6Very low37Very low218 Ų218158.9 Ų158.986%0.85586%0.858SS**  trans-72.1143.5-168.5-68.6-108.4000112.5
342H40.1Very low37.4Very low187 Ų187158 Ų15887%0.86687%0.868SS**  trans-150.8126.7147.1-11627.2000112.2
343N35.7Very low37.6Very low233 Ų233155.2 Ų155.2100%1.24687%0.866SS**  trans36.20166.4-109.3-72.7000119.4

Retrieved 343 of 343 residues in 282.2 ms (Link to these results)