A0A061HYA2_CRIGR Loading...

Histone H2B type F-M-like protein

AlphaFold DB , UniProt , Accession A0A061HYA2, Species CRIGR (Cricetulus griseus, Chinese hamster), Gene n/a, Length 221 aa.

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Site Residue pLDDT pLDDT confidence pLDDT10 pLDDT10 confidence SASA SASA [Ų] SASA10 SASA10 [Ų] RSA RSA unformatted RSA10 RSA10 unformatted Surface Surface10 (not used) Disorder (not used) Disorder Sec. str. Secondary structure Isomer Phi (φ) Psi (ψ) Omega (ω) Chi 1 (χ1) Chi 2 (χ2) Chi 3 (χ3) Chi 4 (χ4) Chi 5 (χ5) Tau (τ) Contacts (colored by PAE) Contact details
1M36.7Very low35.4Very low233 Ų233150.5 Ų150.5100%1.14880%0.796SS**  074.50-68.7154.672.900106.8
2S33.2Very low36Very low121 Ų121153.9 Ų153.985%0.84680%0.799SS**  71.386.291.9-47.40000111.9
3S33.3Very low36.9Very low113 Ų113151.5 Ų151.579%0.7980%0.802SS**  -168.8100.1128.2-137.40000110.5
4W26.3Very low38Very low236 Ų236150.4 Ų150.489%0.89480%0.803SS**  trans-92.4115160.8-86.337.6000106.9L6W4-L6 VanDerWaalsContact C-N 3.33Å; W4-L6 PolarHBondContact O-N 3.21Å
5S34Very low39.2Very low116 Ų116147.8 Ų147.881%0.81180%0.795SS**  trans-85.388.5161-750000108.7I7S5-I7 PolarHBondContact O-N 3.35Å
6L36.5Very low39.9Very low108 Ų108146.8 Ų146.857%0.56578%0.784SS**  trans-67.7105.2166.4-168.683.4000108.8W4 R8W4-L6 VanDerWaalsContact C-N 3.33Å; W4-L6 PolarHBondContact O-N 3.21Å; L6-R8 HydrophobicContact CD2-CB 4.38Å; L6-R8 HydrophobicContact CG-CB 4.42Å
7I36.5Very low40.7Very low173 Ų173147.4 Ų147.489%0.88779%0.786SS**  trans-90.1103.1160.4-63.5172.6000107.3S5S5-I7 PolarHBondContact O-N 3.35Å
8R35.9Very low41.5Very low188 Ų188150.8 Ų150.871%0.70979%0.786SS**  trans-109.9137.8167.5-156.9-164.5-79.2170.5-2104.1L6L6-R8 HydrophobicContact CD2-CB 4.38Å; L6-R8 HydrophobicContact CG-CB 4.42Å
9H41.1Very low42.6Very low144 Ų144148.3 Ų148.367%0.66777%0.772SS**  cis-165.6149.716-140.2-136.4000108.3
10N32.6Very low43.5Very low175 Ų175147.5 Ų147.594%0.93676%0.763SS**SBendtrans-146.478134.4-105.1-25.6000108.6
11G44Very low44.5Very low49 Ų49142.6 Ų142.651%0.50575%0.749SS.*SBendtrans71.495.9151.800000118.6
12K42.2Very low45.8Very low191 Ų191137.7 Ų137.783%0.8373%0.726SS**  trans7691.6151.3-51.9173.9-177.1174.50117.8
13C47.4Very low47.4Very low123 Ų123135.6 Ų135.683%0.83171%0.708SS**  trans-135.581.3157.1-72.30000110.2
14V53Low49Very low136 Ų136136 Ų13682%0.82470%0.699SS**  trans-119.96.4178.9-177.60000113
15T55.8Low50.6Low111 Ų111128 Ų12868%0.68168%0.683SS**SBendtrans-112.3-20.1-179.941.90000115
16H49.3Very low51.7Low132 Ų132125.7 Ų125.761%0.61167%0.671SS**Hα-helixtrans-80.6-27-171-138.1-94.8000114.3R18 F20H16-R18 PolarHBondContact O-N 3.32Å; H16-F20 PolarHBondContact O-N 3.5Å
17L54.2Low52.7Low157 Ų157126.4 Ų126.482%0.82267%0.674SS**Hα-helixtrans-78.2-20.4-175.9-152.467.7000113.3G21L17-G21 PolarHBondContact O-N 3.29Å
18R55Low53.4Low208 Ų208122.2 Ų122.279%0.78567%0.665SS**Hα-helixtrans-81.7-31.2175-76.6-169.9164.5163.2-2113.2H16 L22H16-R18 PolarHBondContact O-N 3.32Å; R18-L22 PolarHBondContact O-N 3.43Å
19I63.2Low54Low103 Ų103116.2 Ų116.253%0.52866%0.662SS.*Hα-helixtrans-71-42.3175.2-61.7172.9000109.9G21 L22 V23I19-G21 VanDerWaalsContact C-N 3.28Å; I19-G21 PolarHBondContact O-N 3.23Å; I19-L22 PolarHBondContact O-N 3.09Å; I19-V23 HydrophobicContact CG2-CG2 4.42Å; I19-V23 WeakPolarHBondContact O-CG2 3.39Å; I19-V23 PolarHBondContact O-N 3.35Å; I19-V23 VanDerWaalsContact O-N 3.09Å
20F60.2Low54.3Low133 Ų133115.4 Ų115.458%0.58367%0.667SS**Hα-helixtrans-61.4-36.7176.7-126.4-94.1000112.6H16 M24H16-F20 PolarHBondContact O-N 3.5Å; F20-M24 WeakPolarHBondContact O-CG 3.37Å; F20-M24 PolarHBondContact O-N 3.3Å
21G63.3Low54.9Low45 Ų45112.6 Ų112.646%0.46466%0.661SS.*Hα-helixtrans-67.1-38.1175.500000114.2L17 I19 A25L17-G21 PolarHBondContact O-N 3.29Å; I19-G21 VanDerWaalsContact C-N 3.28Å; I19-G21 PolarHBondContact O-N 3.23Å; G21-A25 PolarHBondContact O-N 3.34Å
22L65.8Low54.6Low130 Ų130114.9 Ų114.968%0.68168%0.675SS**Hα-helixtrans-73.2-35.8178.8-78.2165.4000112.8R18 I19 A25 A26R18-L22 PolarHBondContact O-N 3.43Å; I19-L22 PolarHBondContact O-N 3.09Å; L22-A25 PolarHBondContact O-N 3.37Å; L22-A26 PolarHBondContact O-N 3.37Å
23V66.4Low54.5Low76 Ų76115.1 Ų115.146%0.46168%0.681SS.*Hα-helixtrans-68.7-40178.31740000111.4I19 A25 A26 I27I19-V23 HydrophobicContact CG2-CG2 4.42Å; I19-V23 WeakPolarHBondContact O-CG2 3.39Å; I19-V23 PolarHBondContact O-N 3.35Å; I19-V23 VanDerWaalsContact O-N 3.09Å; V23-A25 VanDerWaalsContact C-N 3.34Å; V23-A25 PolarHBondContact O-N 3.48Å; V23-A26 PolarHBondContact O-N 3.29Å; V23-I27 HydrophobicContact CG1-CD1 4.12Å; V23-I27 WeakPolarHBondContact O-CG1 3.43Å; V23-I27 PolarHBondContact O-N 3.47Å
24M67.1Low54.1Low122 Ų122118.5 Ų118.560%0.60169%0.685SS**Hα-helixtrans-70.4-30178.1-64.8-62-102.700112.7F20 A28F20-M24 WeakPolarHBondContact O-CG 3.37Å; F20-M24 PolarHBondContact O-N 3.3Å; M24-A28 PolarHBondContact O-N 3.4Å
25A59.8Low53.2Low67 Ų67117.1 Ų117.155%0.55469%0.688SS**Hα-helixtrans-70.4-31.917500000113.2G21 L22 V23G21-A25 PolarHBondContact O-N 3.34Å; L22-A25 PolarHBondContact O-N 3.37Å; V23-A25 VanDerWaalsContact C-N 3.34Å; V23-A25 PolarHBondContact O-N 3.48Å
26A55.6Low52.1Low69 Ų69115.6 Ų115.657%0.5769%0.694SS**Hα-helixtrans-73.8-29.1176.600000113.1L22 V23L22-A26 PolarHBondContact O-N 3.37Å; V23-A26 PolarHBondContact O-N 3.29Å
27I57.8Low51.8Low123 Ų123118.8 Ų118.863%0.63171%0.71SS**Hα-helixtrans-77.3-29.5179.1-64.3168.2000111.5V23 G29V23-I27 HydrophobicContact CG1-CD1 4.12Å; V23-I27 WeakPolarHBondContact O-CG1 3.43Å; V23-I27 PolarHBondContact O-N 3.47Å; I27-G29 VanDerWaalsContact C-N 3.34Å
28A52.1Low50.8Low84 Ų84119.9 Ų119.969%0.69471%0.71SS**THydrogen-bonded Turntrans-79.3-11.9177.300000114.3M24M24-A28 PolarHBondContact O-N 3.4Å
29G48.6Very low50.3Low62 Ų62117.9 Ų117.964%0.63972%0.715SS**THydrogen-bonded Turntrans-88.7-2.8-172.200000116.6I27I27-G29 VanDerWaalsContact C-N 3.34Å
30V47.9Very low48.7Very low128 Ų128118.1 Ų118.178%0.77672%0.721SS**SBendtrans-123.957.2-176.3-166.10000110.6
31S43.6Very low47.5Very low116 Ų116118.2 Ų118.281%0.81173%0.733SS**  trans-149.976.6167-79.10000109.9
32A37.2Very low46Very low96 Ų96122.5 Ų122.579%0.79375%0.75SS**  trans-163.990.1163.400000110
33M41.9Very low44.7Very low197 Ų197124.3 Ų124.397%0.9775%0.754SS**  trans-167.9100.4144.9-107164.7162.800109.1
34E38.7Very low43.1Very low193 Ų193130 Ų13090%0.90278%0.778SS**  trans-76.3164.5170.1-77.7170.7118.700112.3
35A34Very low41.6Very low108 Ų108128.3 Ų128.389%0.89378%0.784SS**  trans91.2132.8146.900000119.3
36G31.4Very low40.3Very low79 Ų79130.4 Ų130.481%0.81480%0.795SS**  trans135.4102.115500000114.9
37E44.8Very low39.3Very low199 Ų199133.9 Ų133.993%0.9381%0.809SS**  trans-59.7141.9160.2-62.5176.7127.500110.9
38E32.2Very low38.7Very low179 Ų179136.6 Ų136.684%0.83682%0.818SS**  -163.2144.2129-145.6169125.200112.3
39L43.8Very low38Very low167 Ų167141.5 Ų141.587%0.87483%0.827SS**  trans-70.1114.2172.1-170.183.8000109.5
40T30.1Very low37.5Very low108 Ų108143.7 Ų143.766%0.66383%0.83SS**  trans-133.1118.8165.657.90000111.6V42T40-V42 PolarHBondContact O-N 3.11Å
41T34.8Very low37.1Very low135 Ų135145.3 Ų145.383%0.82883%0.833SS**  trans-29.9123.8156.348.50000113
42V32Very low36.7Very low135 Ų135145.4 Ų145.482%0.81883%0.83SS**  trans-108.2103162-178.30000107.3T40T40-V42 PolarHBondContact O-N 3.11Å
43E38.1Very low36.8Very low167 Ų167147.7 Ų147.778%0.7883%0.834SS**  trans-48.4133160.6-76.8176104.100110.2A45E43-A45 VanDerWaalsContact C-N 3.29Å; E43-A45 PolarHBondContact O-N 3.31Å
44M33.8Very low36.7Very low195 Ų195147.1 Ų147.196%0.96183%0.829SS**  trans-7488.5160.2-69.4-175.761.900108.2
45A34.8Very low36.7Very low88 Ų88146.4 Ų146.473%0.72783%0.826SS**  trans-96.4120.7165.700000109.5E43E43-A45 VanDerWaalsContact C-N 3.29Å; E43-A45 PolarHBondContact O-N 3.31Å
46S33Very low37.2Very low111 Ų111147.4 Ų147.478%0.77682%0.823SS**  trans-54.3148167.1-45.70000111.9
47V34.3Very low37.4Very low142 Ų142150.1 Ų150.186%0.86182%0.823SS**  170.1132121.9161.90000108.7
48E46.2Very low37.3Very low179 Ų179145.3 Ų145.384%0.83682%0.818SS**  trans-57.2147.7171.2-69.7163.5129.100111.9
49E37Very low37.3Very low187 Ų187143.3 Ų143.387%0.87482%0.818SS**  -150.1154.5126.3-96-141.415700111.2
50P38.9Very low36.7Very low108 Ų108140 Ų14070%0.70181%0.809SS**  trans-97.7156-147.137.1-32.4000112.8
51I38.6Very low37.6Very low163 Ų163143 Ų14384%0.83682%0.815SS**  trans-108.4139.7169.5-61.4-179.4000109.4
52P35.7Very low37.8Very low117 Ų117145.2 Ų145.276%0.7682%0.816SS**  trans-72.5151.8-152.6-19.934.9000115.7
53V38.2Very low38Very low144 Ų144142.9 Ų142.987%0.87381%0.811SS**  trans-82.5109.5172.8-166.20000108.3
54E40.6Very low37.9Very low186 Ų186138.2 Ų138.287%0.86980%0.797SS**  trans-82.9133.8160.4-78.9-172.1167.200109.6
55E39.5Very low38Very low177 Ų177135 Ų13583%0.82778%0.783SS**  trans-62149.5-176.9-71.2-17914400113.2V57E55-V57 PolarHBondContact O-N 3.45Å
56P43.4Very low38.2Very low130 Ų130134.8 Ų134.884%0.84478%0.782SS**  trans-72.9113.7-178.729-33000111.6
57V36.4Very low38.3Very low135 Ų135139.3 Ų139.382%0.81878%0.783SS**  trans-68.1129.3164.6-176.60000109.1E55 V59E55-V57 PolarHBondContact O-N 3.45Å; V57-V59 PolarHBondContact O-N 3.42Å
58A41.1Very low38.8Very low99 Ų99139.7 Ų139.782%0.81878%0.776SS**  trans-53125.3-17600000113.3
59V32.6Very low38.6Very low137 Ų137140.1 Ų140.183%0.8378%0.775SS**  trans-117.4126.3162.6179.80000108.1V57V57-V59 PolarHBondContact O-N 3.42Å
60S32.7Very low39.4Very low98 Ų98138.4 Ų138.469%0.68577%0.77SS**  trans-51.5137.2-165.652.30000117.1Q62S60-Q62 VanDerWaalsContact C-N 3.29Å; S60-Q62 PolarHBondContact O-N 3.39Å
61E49Very low40Very low169 Ų169144.1 Ų144.179%0.7978%0.777SS**THydrogen-bonded Turntrans-61.210.2-174.6-85.9170.5125.600119.1
62Q38.3Very low39.9Very low183 Ų183147.4 Ų147.486%0.85578%0.779SS**THydrogen-bonded Turntrans-108.85.8-164.4-71.7172.4-14.800116.5S60S60-Q62 VanDerWaalsContact C-N 3.29Å; S60-Q62 PolarHBondContact O-N 3.39Å
63A36.5Very low40.4Very low85 Ų85145.8 Ų145.870%0.70277%0.769SS**SBendtrans-110.9-6.4175.600000114.4
64S35.6Very low40.6Very low69 Ų69148.7 Ų148.748%0.48377%0.77SS.*SBendtrans-81.4-21.6-178.244.30000114.1E68S64-E68 PolarHBondContact O-N 3.39Å
65D35.1Very low40.6Very low127 Ų127142.9 Ų142.968%0.67975%0.75SS**THydrogen-bonded Turntrans-83.1-17.5-169.7-70.5-15.9000114.3
66A38.7Very low41.3Very low84 Ų84137 Ų13769%0.69473%0.731SS**THydrogen-bonded Turntrans-88.4-1917700000113.5
67Y35.4Very low42.1Very low206 Ų206135.7 Ų135.781%0.80872%0.721SS**THydrogen-bonded Turntrans-100.5-21.3-176.9-162.3-101.3000113.7
68E46.1Very low43.5Very low151 Ų151132.5 Ų132.571%0.70671%0.709SS**G310 helixtrans-82.8-15.6-179.8-159.662.6-150.200113.2S64 I70S64-E68 PolarHBondContact O-N 3.39Å; E68-I70 PolarHBondContact O-N 3.14Å
69K42.1Very low44.9Very low188 Ų188134.6 Ų134.682%0.81770%0.7SS**G310 helixtrans-88.63.9-172.4-149.9163.9-170.4172.80115.8
70I52.1Low46.9Very low150 Ų150135.8 Ų135.877%0.76969%0.694SS**G310 helixtrans-110.19-177.3-59.1-179.1000114.5E68E68-I70 PolarHBondContact O-N 3.14Å
71R51.8Low48.9Very low228 Ų228140.4 Ų140.486%0.8670%0.696SS**SBendtrans-15144.2178.2-130.9-179.9-172.5-169.75121.4
72R37.5Very low50.4Low232 Ų232139.1 Ų139.188%0.87569%0.69SS**  trans-139.6101.5161-76.7-170.1170.9-161.71.4114.7
73P45.4Very low52.5Low84 Ų84137 Ų13755%0.54568%0.678SS.*  trans-83.2130.2153.627.8-20.9000109.8S75 A76P73-S75 PolarHBondContact O-N 3.15Å; P73-A76 VanDerWaalsContact O-CB 3.28Å; P73-A76 WeakPolarHBondContact O-CB 3.27Å; P73-A76 PolarHBondContact O-N 2.75Å
74K42.5Very low54.6Low204 Ų204139 Ų13989%0.88767%0.673SS**THydrogen-bonded Turntrans-60.3-6.2178.6-68.7178.5177175.70114.5A76 T77K74-A76 VanDerWaalsContact C-N 3.28Å; K74-T77 PolarHBondContact O-OG1 3.35Å
75S41.2Very low56.9Low64 Ų64140 Ų14045%0.44867%0.673SS.*THydrogen-bonded Turntrans-78.1-7.4171.1610000114.1P73 K79P73-S75 PolarHBondContact O-N 3.15Å; S75-K79 WeakPolarHBondContact O-CG 3.28Å
76A53.7Low59.3Low53 Ų53138.3 Ų138.344%0.43866%0.66SS.*Hα-helixtrans-70.6-27.7-177.200000114.1P73 K74 K80P73-A76 VanDerWaalsContact O-CB 3.28Å; P73-A76 WeakPolarHBondContact O-CB 3.27Å; P73-A76 PolarHBondContact O-N 2.75Å; K74-A76 VanDerWaalsContact C-N 3.28Å; A76-K80 WeakPolarHBondContact O-CB 3.46Å; A76-K80 PolarHBondContact O-N 3.29Å
77T60.1Low61.3Low103 Ų103143 Ų14363%0.63266%0.66SS**Hα-helixtrans-74.9-41.7-176.126.70000113.1K74 R81K74-T77 PolarHBondContact O-OG1 3.35Å; T77-R81 WeakPolarHBondContact O-CG 3.41Å; T77-R81 PolarHBondContact O-N 3.47Å
78A66.5Low63.6Low69 Ų69141.3 Ų141.357%0.5765%0.652SS**Hα-helixtrans-68.4-45.5174.600000111.6K80 R81 Q82A78-K80 VanDerWaalsContact C-N 3.3Å; A78-K80 PolarHBondContact O-N 2.79Å; A78-R81 PolarHBondContact O-N 3.48Å; A78-Q82 PolarHBondContact O-N 2.93Å
79K70.1Confident65.4Low142 Ų142142 Ų14262%0.61765%0.648SS**Hα-helixtrans-61-36.4175.8-72-176.8177.6-1770112.5S75 K83S75-K79 WeakPolarHBondContact O-CG 3.28Å; K79-K83 VanDerWaalsContact O-CB 3.28Å; K79-K83 WeakPolarHBondContact O-CB 3.49Å; K79-K83 PolarHBondContact O-N 2.98Å
80K74.6Confident67.2Low162 Ų162140.6 Ų140.670%0.70464%0.638SS**Hα-helixtrans-68.3-40177-171.3176.3-176.9-177.40112.4A76 A78 Q84A76-K80 WeakPolarHBondContact O-CB 3.46Å; A76-K80 PolarHBondContact O-N 3.29Å; A78-K80 VanDerWaalsContact C-N 3.3Å; A78-K80 PolarHBondContact O-N 2.79Å; K80-Q84 WeakPolarHBondContact O-CB 3.45Å; K80-Q84 PolarHBondContact O-N 3.24Å; K80-Q84 VanDerWaalsContact O-N 3.1Å
81R75.6Confident68.4Low196 Ų196138.8 Ų138.874%0.7463%0.625SS**Hα-helixtrans-67.5-43176.1-71179.483.8-176.15.8112T77 A78 Q84 L85T77-R81 WeakPolarHBondContact O-CG 3.41Å; T77-R81 PolarHBondContact O-N 3.47Å; A78-R81 PolarHBondContact O-N 3.48Å; R81-Q84 PolarHBondContact O-N 3.28Å; R81-L85 PolarHBondContact O-N 3.36Å
82Q79.3Confident69.8Low142 Ų142134.2 Ų134.266%0.66461%0.613SS**Hα-helixtrans-63.4-43.9177.7-164.4169.56.900111.6A78 Q84 L85 E86A78-Q82 PolarHBondContact O-N 2.93Å; Q82-Q84 VanDerWaalsContact C-N 3.28Å; Q82-Q84 PolarHBondContact O-N 3.45Å; Q82-L85 PolarHBondContact O-N 3.04Å; Q82-E86 WeakPolarHBondContact O-CB 3.49Å; Q82-E86 PolarHBondContact O-N 3.39Å
83K81.8Confident72.1Confident139 Ų139127.6 Ų127.660%0.60460%0.603SS**Hα-helixtrans-62.1-32.4174.4-171.7170.8-174.6171.10113.2K79 R87K79-K83 VanDerWaalsContact O-CB 3.28Å; K79-K83 WeakPolarHBondContact O-CB 3.49Å; K79-K83 PolarHBondContact O-N 2.98Å; K83-R87 WeakPolarHBondContact O-CB 2.92Å; K83-R87 WeakPolarHBondContact O-CG 3.27Å; K83-R87 PolarHBondContact O-N 2.78Å; K83-R87 VanDerWaalsContact O-N 3.15Å
84Q80.9Confident74Confident126 Ų126125.9 Ų125.959%0.58959%0.588SS**Hα-helixtrans-74-40.3177.4-167.1-179.825.800112.1K80 R81 Q82 R87 R88K80-Q84 WeakPolarHBondContact O-CB 3.45Å; K80-Q84 PolarHBondContact O-N 3.24Å; K80-Q84 VanDerWaalsContact O-N 3.1Å; R81-Q84 PolarHBondContact O-N 3.28Å; Q82-Q84 VanDerWaalsContact C-N 3.28Å; Q82-Q84 PolarHBondContact O-N 3.45Å; Q84-R87 PolarHBondContact O-N 3.17Å; Q84-R88 PolarHBondContact O-N 3.02Å; Q84-R88 VanDerWaalsContact O-N 3.11Å
85L84.3Confident76.2Confident91 Ų91120 Ų12048%0.47657%0.569SS.*Hα-helixtrans-65.7-41.6175.6-175.764.4000111.5R81 Q82 R88 R89R81-L85 PolarHBondContact O-N 3.36Å; Q82-L85 PolarHBondContact O-N 3.04Å; L85-R88 WeakPolarHBondContact O-CB 3.39Å; L85-R88 PolarHBondContact O-N 3.24Å; L85-R89 PolarHBondContact O-N 3.2Å
86E84.6Confident78.4Confident91 Ų91121.9 Ų121.943%0.42557%0.571SS.*Hα-helixtrans-64.4-40.2176.7-162-174157.600111.9Q82 R88 R89 R90Q82-E86 WeakPolarHBondContact O-CB 3.49Å; Q82-E86 PolarHBondContact O-N 3.39Å; E86-R88 VanDerWaalsContact C-N 3.32Å; E86-R88 PolarHBondContact O-N 3.33Å; E86-R89 PolarHBondContact O-N 2.97Å; E86-R90 WeakPolarHBondContact O-CG 3.15Å; E86-R90 PolarHBondContact O-N 3.5Å; E86-R90 IonicContact OE1-CZ 2.88Å; E86-R90 IonicContact OE1-NE 3.95Å; E86-R90 PolarHBondContact OE1-NE 3.44Å; E86-R90 IonicContact OE1-NH2 3.3Å; E86-R90 PolarHBondContact OE1-NH2 3.46Å
87R82.3Confident80Confident181 Ų181125 Ų12568%0.68358%0.577SS**Hα-helixtrans-59.5-39.8171.7-85.1178.2152.8-163.8-5.8112.8K83 Q84 F91K83-R87 WeakPolarHBondContact O-CB 2.92Å; K83-R87 WeakPolarHBondContact O-CG 3.27Å; K83-R87 PolarHBondContact O-N 2.78Å; K83-R87 VanDerWaalsContact O-N 3.15Å; Q84-R87 PolarHBondContact O-N 3.17Å; R87-F91 WeakPolarHBondContact O-CB 3.33Å; R87-F91 PolarHBondContact O-N 3.09Å
88R82.2Confident81.3Confident172 Ų172124.3 Ų124.365%0.64957%0.566SS**Hα-helixtrans-65.6-44.2175.5-84.6-177.7161.9-130.6-0.4112Q84 L85 E86 F91 Q92Q84-R88 PolarHBondContact O-N 3.02Å; Q84-R88 VanDerWaalsContact O-N 3.11Å; L85-R88 WeakPolarHBondContact O-CB 3.39Å; L85-R88 PolarHBondContact O-N 3.24Å; E86-R88 VanDerWaalsContact C-N 3.32Å; E86-R88 PolarHBondContact O-N 3.33Å; R88-F91 PolarHBondContact O-N 3.42Å; R88-Q92 WeakPolarHBondContact O-CG 3.38Å; R88-Q92 PolarHBondContact O-N 2.88Å
89R84.9Confident82.2Confident165 Ų165125 Ų12562%0.62355%0.554SS**Hα-helixtrans-61.1-45.7176.3-71.4-178.8179.8-177.2-0.8111.6L85 E86 F91 Q92 S93L85-R89 PolarHBondContact O-N 3.2Å; E86-R89 PolarHBondContact O-N 2.97Å; R89-F91 VanDerWaalsContact C-N 3.32Å; R89-F91 PolarHBondContact O-N 2.93Å; R89-Q92 PolarHBondContact O-N 3Å; R89-S93 PolarHBondContact O-N 3.49Å; R89-S93 PolarHBondContact O-OG 2.71Å
90R80.3Confident82.9Confident159 Ų159125.2 Ų125.260%0.655%0.551SS**Hα-helixtrans-60.9-39.5174.7-71-177.7-169.4-148.94112.3E86 Q92 S93 M94E86-R90 WeakPolarHBondContact O-CG 3.15Å; E86-R90 PolarHBondContact O-N 3.5Å; E86-R90 IonicContact OE1-CZ 2.88Å; E86-R90 IonicContact OE1-NE 3.95Å; E86-R90 PolarHBondContact OE1-NE 3.44Å; E86-R90 IonicContact OE1-NH2 3.3Å; E86-R90 PolarHBondContact OE1-NH2 3.46Å; R90-Q92 VanDerWaalsContact C-N 3.34Å; R90-S93 WeakPolarHBondContact CA-OG 3Å; R90-S93 PolarHBondContact O-N 2.88Å; R90-S93 PolarHBondContact O-OG 2.86Å; R90-M94 WeakPolarHBondContact O-CG 3.28Å; R90-M94 PolarHBondContact O-N 2.86Å
91F77.8Confident83.4Confident111 Ų111124.1 Ų124.149%0.48754%0.542SS..Hα-helixtrans-66.9-36.2177.1-171.7-94.9000112.5R87 R88 R89 M94 R99R87-F91 WeakPolarHBondContact O-CB 3.33Å; R87-F91 PolarHBondContact O-N 3.09Å; R88-F91 PolarHBondContact O-N 3.42Å; R89-F91 VanDerWaalsContact C-N 3.32Å; R89-F91 PolarHBondContact O-N 2.93Å; F91-M94 HydrophobicContact CD2-CE 3.44Å; F91-M94 VanDerWaalsContact CD2-CE 3.44Å; F91-M94 HydrophobicContact CE2-CE 3.76Å; F91-M94 HydrophobicContact CG-CE 4.21Å; F91-R99 HydrophobicContact CZ-CG 4.46Å; F91-R99 PolarHBondContact O-NE 3.23Å; F91-R99 PolarHBondContact O-NH2 3.24Å
92Q81.3Confident83.7Confident132 Ų132115.9 Ų115.962%0.61752%0.516SS*.Hα-helixtrans-69.4-35.5175.6-74.1172.5-1400112.2R88 R89 R90 M94 R99R88-Q92 WeakPolarHBondContact O-CG 3.38Å; R88-Q92 PolarHBondContact O-N 2.88Å; R89-Q92 PolarHBondContact O-N 3Å; R90-Q92 VanDerWaalsContact C-N 3.34Å; Q92-M94 VanDerWaalsContact C-N 3.33Å; Q92-M94 PolarHBondContact O-N 3.11Å; Q92-R99 PolarHBondContact O-NH2 3.35Å
93S84.2Confident83.8Confident94 Ų94111.9 Ų111.966%0.65751%0.507SS*.Hα-helixtrans-79.1-8.8177.967.90000114.8R89 R90R89-S93 PolarHBondContact O-N 3.49Å; R89-S93 PolarHBondContact O-OG 2.71Å; R90-S93 WeakPolarHBondContact CA-OG 3Å; R90-S93 PolarHBondContact O-N 2.88Å; R90-S93 PolarHBondContact O-OG 2.86Å
94M85.6Confident83.5Confident48 Ų48112.6 Ų112.624%0.23651%0.506CS..SBendtrans-72.7141.4177.2-78.5-178.9-20.700111.9R90 F91 Q92 E98 R99 A102R90-M94 WeakPolarHBondContact O-CG 3.28Å; R90-M94 PolarHBondContact O-N 2.86Å; F91-M94 HydrophobicContact CD2-CE 3.44Å; F91-M94 VanDerWaalsContact CD2-CE 3.44Å; F91-M94 HydrophobicContact CE2-CE 3.76Å; F91-M94 HydrophobicContact CG-CE 4.21Å; Q92-M94 VanDerWaalsContact C-N 3.33Å; Q92-M94 PolarHBondContact O-N 3.11Å; M94-E98 WeakPolarHBondContact CA-OE2 3.3Å; M94-E98 HydrophobicContact CB-CB 4.03Å; M94-E98 HydrophobicContact CG-CB 4.16Å; M94-E98 HydrophobicContact SD-CB 4.42Å; M94-R99 HydrophobicContact CB-CG 3.97Å; M94-R99 HydrophobicContact CE-CB 4.36Å; M94-R99 HydrophobicContact CE-CG 3.59Å; M94-R99 PolarHBondContact O-NE 3.46Å; M94-A102 HydrophobicContact CE-CB 4.17Å
95T90Very high83Confident80 Ų80112 Ų11249%0.49151%0.507SS..  trans-66.3161.7169.761.30000111.6E97 E98 R99T95-E97 VanDerWaalsContact C-N 3.28Å; T95-E97 PolarHBondContact O-N 3.26Å; T95-E98 PolarHBondContact N-OE2 3.24Å; T95-E98 PolarHBondContact O-N 3.12Å; T95-E98 WeakPolarHBondContact OG1-CB 3.43Å; T95-E98 VanDerWaalsContact OG1-CD 3.24Å; T95-E98 WeakPolarHBondContact OG1-CG 3.44Å; T95-E98 PolarHBondContact OG1-N 3.06Å; T95-E98 PolarHBondContact OG1-OE2 3.22Å; T95-R99 WeakPolarHBondContact O-CG 3.22Å; T95-R99 PolarHBondContact O-N 3Å
96E86.6Confident82.4Confident103 Ų103112.7 Ų112.748%0.48151%0.51SS..Hα-helixtrans-60.2-36.7179.1179.356.6-159.600112.3R99 R100E96-R99 PolarHBondContact O-N 3.31Å; E96-R100 VanDerWaalsContact O-CG 3.28Å; E96-R100 WeakPolarHBondContact O-CG 3.47Å; E96-R100 PolarHBondContact O-N 3.33Å; E96-R100 IonicContact OE1-CZ 2.81Å; E96-R100 IonicContact OE1-NE 3.68Å; E96-R100 PolarHBondContact OE1-NE 2.91Å; E96-R100 IonicContact OE1-NH2 3.28Å; E96-R100 PolarHBondContact OE1-NH2 2.85Å
97E87.6Confident81.5Confident120 Ų120115.7 Ų115.756%0.56152%0.521SS*.Hα-helixtrans-65.6-42.8174.2-73.1-164.8-178.100113T95 R99 R100 R101T95-E97 VanDerWaalsContact C-N 3.28Å; T95-E97 PolarHBondContact O-N 3.26Å; E97-R99 VanDerWaalsContact C-N 3.35Å; E97-R100 PolarHBondContact O-N 3.45Å; E97-R101 WeakPolarHBondContact O-CG 3.46Å; E97-R101 PolarHBondContact O-N 3.18Å; E97-R101 IonicContact OE2-CZ 2.73Å; E97-R101 IonicContact OE2-NH2 3.53Å; E97-R101 PolarHBondContact OE2-NH2 2.98Å
98E86.8Confident80.5Confident88 Ų88115.9 Ų115.941%0.41152%0.522SS..Hα-helixtrans-65.6-38.9177.2-72.1169.5141.100111.5M94 T95 R100 R101 A102M94-E98 WeakPolarHBondContact CA-OE2 3.3Å; M94-E98 HydrophobicContact CB-CB 4.03Å; M94-E98 HydrophobicContact CG-CB 4.16Å; M94-E98 HydrophobicContact SD-CB 4.42Å; T95-E98 PolarHBondContact N-OE2 3.24Å; T95-E98 PolarHBondContact O-N 3.12Å; T95-E98 WeakPolarHBondContact OG1-CB 3.43Å; T95-E98 VanDerWaalsContact OG1-CD 3.24Å; T95-E98 WeakPolarHBondContact OG1-CG 3.44Å; T95-E98 PolarHBondContact OG1-N 3.06Å; T95-E98 PolarHBondContact OG1-OE2 3.22Å; E98-R100 VanDerWaalsContact C-N 3.35Å; E98-R101 PolarHBondContact O-N 3.38Å; E98-A102 VanDerWaalsContact O-CB 3.27Å; E98-A102 WeakPolarHBondContact O-CB 3.27Å; E98-A102 PolarHBondContact O-N 2.64Å
99R85.1Confident79.4Confident83 Ų83117.4 Ų117.431%0.31353%0.528SS..Hα-helixtrans-61.2-42.8171.9-73.6178.8-178.1173.18.5111.6F91 Q92 M94 T95 E96 E97 A102 A103F91-R99 HydrophobicContact CZ-CG 4.46Å; F91-R99 PolarHBondContact O-NE 3.23Å; F91-R99 PolarHBondContact O-NH2 3.24Å; Q92-R99 PolarHBondContact O-NH2 3.35Å; M94-R99 HydrophobicContact CB-CG 3.97Å; M94-R99 HydrophobicContact CE-CB 4.36Å; M94-R99 HydrophobicContact CE-CG 3.59Å; M94-R99 PolarHBondContact O-NE 3.46Å; T95-R99 WeakPolarHBondContact O-CG 3.22Å; T95-R99 PolarHBondContact O-N 3Å; E96-R99 PolarHBondContact O-N 3.31Å; E97-R99 VanDerWaalsContact C-N 3.35Å; R99-A102 PolarHBondContact O-N 3.44Å; R99-A103 VanDerWaalsContact O-CB 3.24Å; R99-A103 WeakPolarHBondContact O-CB 3.47Å; R99-A103 PolarHBondContact O-N 2.93Å
100R85.5Confident78.4Confident146 Ų146118 Ų11855%0.55154%0.535SS*.Hα-helixtrans-65.5-37.7175.2-71.8172.8-175-163.40.4112.6E96 E97 E98 R104E96-R100 VanDerWaalsContact O-CG 3.28Å; E96-R100 WeakPolarHBondContact O-CG 3.47Å; E96-R100 PolarHBondContact O-N 3.33Å; E96-R100 IonicContact OE1-CZ 2.81Å; E96-R100 IonicContact OE1-NE 3.68Å; E96-R100 PolarHBondContact OE1-NE 2.91Å; E96-R100 IonicContact OE1-NH2 3.28Å; E96-R100 PolarHBondContact OE1-NH2 2.85Å; E97-R100 PolarHBondContact O-N 3.45Å; E98-R100 VanDerWaalsContact C-N 3.35Å; R100-R104 WeakPolarHBondContact O-CB 3.49Å; R100-R104 VanDerWaalsContact O-CG 3.3Å; R100-R104 WeakPolarHBondContact O-CG 3.34Å; R100-R104 PolarHBondContact O-N 3.01Å; R100-R104 PolarHBondContact O-NE 3.46Å
101R84.5Confident78.1Confident139 Ų139115.5 Ų115.553%0.52553%0.534SS..Hα-helixtrans-68.2-45174.7-70.3175.3-165.3168.79.6111E97 E98 A103 R104 L105E97-R101 WeakPolarHBondContact O-CG 3.46Å; E97-R101 PolarHBondContact O-N 3.18Å; E97-R101 IonicContact OE2-CZ 2.73Å; E97-R101 IonicContact OE2-NH2 3.53Å; E97-R101 PolarHBondContact OE2-NH2 2.98Å; E98-R101 PolarHBondContact O-N 3.38Å; R101-A103 PolarHBondContact O-N 3.32Å; R101-R104 WeakPolarHBondContact O-CB 3.26Å; R101-R104 PolarHBondContact O-N 3.43Å; R101-L105 WeakPolarHBondContact O-CG 3.48Å; R101-L105 PolarHBondContact O-N 3.2Å
102A81.9Confident78.5Confident24 Ų24112.2 Ų112.220%0.19852%0.524CS..Hα-helixtrans-62.3-41.8175.500000112M94 E98 R99 L105 I106M94-A102 HydrophobicContact CE-CB 4.17Å; E98-A102 VanDerWaalsContact O-CB 3.27Å; E98-A102 WeakPolarHBondContact O-CB 3.27Å; E98-A102 PolarHBondContact O-N 2.64Å; R99-A102 PolarHBondContact O-N 3.44Å; A102-L105 PolarHBondContact O-N 3.04Å; A102-I106 WeakPolarHBondContact O-CB 3.27Å; A102-I106 WeakPolarHBondContact O-CD1 3.26Å; A102-I106 WeakPolarHBondContact O-CG1 3.26Å; A102-I106 PolarHBondContact O-N 2.92Å
103A80.9Confident79Confident58 Ų58109 Ų10948%0.47951%0.508SS..Hα-helixtrans-63.3-40.7174.900000111.9R99 R101 I106 K107R99-A103 VanDerWaalsContact O-CB 3.24Å; R99-A103 WeakPolarHBondContact O-CB 3.47Å; R99-A103 PolarHBondContact O-N 2.93Å; R101-A103 PolarHBondContact O-N 3.32Å; A103-I106 PolarHBondContact O-N 3.35Å; A103-K107 WeakPolarHBondContact O-CB 3.31Å; A103-K107 PolarHBondContact O-N 3.05Å
104R76.2Confident79.3Confident153 Ų153106.2 Ų106.258%0.57749%0.487SS*.Hα-helixtrans-61.6-43.3172.7-78.6-177.5-91.2-169.4-4.9112R100 R101 K107 R108R100-R104 WeakPolarHBondContact O-CB 3.49Å; R100-R104 VanDerWaalsContact O-CG 3.3Å; R100-R104 WeakPolarHBondContact O-CG 3.34Å; R100-R104 PolarHBondContact O-N 3.01Å; R100-R104 PolarHBondContact O-NE 3.46Å; R101-R104 WeakPolarHBondContact O-CB 3.26Å; R101-R104 PolarHBondContact O-N 3.43Å; R104-K107 PolarHBondContact O-N 2.86Å; R104-R108 WeakPolarHBondContact O-CG 3.34Å; R104-R108 PolarHBondContact O-N 3.15Å
105L71.5Confident79.5Confident114 Ų114108.8 Ų108.860%0.59750%0.501SS*.Hα-helixtrans-65.3-39.9175.8-70.8167.5000112.3R101 A102 R108 R109R101-L105 WeakPolarHBondContact O-CG 3.48Å; R101-L105 PolarHBondContact O-N 3.2Å; A102-L105 PolarHBondContact O-N 3.04Å; L105-R108 PolarHBondContact O-N 3.39Å; L105-R109 PolarHBondContact O-N 3.41Å; L105-R109 VanDerWaalsContact O-N 3.14Å
106I71.1Confident79.6Confident106 Ų106111.1 Ų111.154%0.54450%0.502SS..Hα-helixtrans-67.6-39.6175.9-68.1162.7000110.8A102 A103 R109 K110A102-I106 WeakPolarHBondContact O-CB 3.27Å; A102-I106 WeakPolarHBondContact O-CD1 3.26Å; A102-I106 WeakPolarHBondContact O-CG1 3.26Å; A102-I106 PolarHBondContact O-N 2.92Å; A103-I106 PolarHBondContact O-N 3.35Å; I106-R109 WeakPolarHBondContact O-CB 3.36Å; I106-R109 PolarHBondContact O-N 2.99Å; I106-R109 VanDerWaalsContact O-N 3.11Å; I106-K110 PolarHBondContact O-N 2.98Å
107K64.8Low79.8Confident153 Ų153107.7 Ų107.767%0.66549%0.485SS*.Hα-helixtrans-62.2-46.8174.7-171.7-179.9179.2-1760111.1A103 R104 R109 K110A103-K107 WeakPolarHBondContact O-CB 3.31Å; A103-K107 PolarHBondContact O-N 3.05Å; R104-K107 PolarHBondContact O-N 2.86Å; K107-R109 PolarHBondContact O-N 3.41Å; K107-R109 VanDerWaalsContact O-N 3.12Å; K107-K110 WeakPolarHBondContact O-CB 3.49Å; K107-K110 PolarHBondContact O-N 3.35Å
108R61.1Low79.9Confident186 Ų186104.8 Ų104.870%0.70248%0.477SS*.Hα-helixtrans-57-26.8172.8-74.7178.5176.7-168.5-2.8113.3R104 L105R104-R108 WeakPolarHBondContact O-CG 3.34Å; R104-R108 PolarHBondContact O-N 3.15Å; L105-R108 PolarHBondContact O-N 3.39Å
109R61.1Low80Confident204 Ų204107.2 Ų107.277%0.7748%0.482SS*.Hα-helixtrans-81.3-20.8178-154.9-179-171.1170.95.8113.6L105 I106 K107 D111L105-R109 PolarHBondContact O-N 3.41Å; L105-R109 VanDerWaalsContact O-N 3.14Å; I106-R109 WeakPolarHBondContact O-CB 3.36Å; I106-R109 PolarHBondContact O-N 2.99Å; I106-R109 VanDerWaalsContact O-N 3.11Å; K107-R109 PolarHBondContact O-N 3.41Å; K107-R109 VanDerWaalsContact O-N 3.12Å; R109-D111 VanDerWaalsContact C-N 3.26Å; R109-D111 PolarHBondContact O-N 3.47Å
110K62.2Low80.3Confident177 Ų177107.1 Ų107.177%0.7749%0.491SS*.Hα-helixtrans-68.7-28177.9-104.8178.8170.7-173.50112.1I106 K107 S112I106-K110 PolarHBondContact O-N 2.98Å; K107-K110 WeakPolarHBondContact O-CB 3.49Å; K107-K110 PolarHBondContact O-N 3.35Å; K110-S112 PolarHBondContact O-N 3.38Å
111D74.8Confident80.5Confident107 Ų107102 Ų10257%0.57247%0.474SS*.SBendtrans-95.171.4-179.8-51.2-29000109.2R109 K143R109-D111 VanDerWaalsContact C-N 3.26Å; R109-D111 PolarHBondContact O-N 3.47Å; D111-K143 WeakPolarHBondContact O-CE 3.38Å; D111-K143 PolarHBondContact O-NZ 3.03Å
112S86.6Confident80.7Confident41 Ų41102.5 Ų102.529%0.28748%0.476SS..  trans-110.4134.8176.283.60000111.4K110 T114 D139K110-S112 PolarHBondContact O-N 3.38Å; S112-T114 VanDerWaalsContact C-N 3.25Å; S112-T114 PolarHBondContact O-N 2.88Å; S112-T114 PolarHBondContact OG-OG1 3.45Å; S112-T114 VanDerWaalsContact OG-OG1 3.11Å; S112-D139 WeakPolarHBondContact CA-OD1 3.42Å
113F91Very high80.9Confident64 Ų64108.1 Ų108.128%0.28150%0.503SS..  trans-85.32.5177.3-62.2-77.3000113.2I115 Y116 F117 D139 V142 K143 F146F113-I115 PolarHBondContact O-N 3.4Å; F113-Y116 HydrophobicContact CB-CD2 4.15Å; F113-Y116 HydrophobicContact CD1-CD2 4.02Å; F113-Y116 HydrophobicContact CD1-CE2 4.13Å; F113-Y116 WeakPolarHBondContact O-CD2 3.49Å; F113-Y116 PolarHBondContact O-N 2.99Å; F113-F117 HydrophobicContact CB-CE2 3.97Å; F113-F117 HydrophobicContact CB-CZ 3.82Å; F113-F117 WeakPolarHBondContact O-CD2 3.5Å; F113-F117 WeakPolarHBondContact O-CE2 3.26Å; F113-D139 PolarHBondContact N-OD1 3.28Å; F113-V142 HydrophobicContact CD2-CB 4.33Å; F113-V142 HydrophobicContact CD2-CG1 3.74Å; F113-V142 HydrophobicContact CE2-CG1 3.87Å; F113-V142 HydrophobicContact CG-CG1 4.11Å; F113-V142 HydrophobicContact CZ-CG1 4.34Å; F113-K143 HydrophobicContact CD2-CG 4.44Å; F113-K143 HydrophobicContact CE2-CG 4.06Å; F113-F146 HydrophobicContact CE1-CE2 4.08Å; F113-F146 HydrophobicContact CE2-CD2 4.21Å; F113-F146 HydrophobicContact CE2-CE2 4.19Å; F113-F146 AromaticContact CZ-CD2 3.99Å; F113-F146 HydrophobicContact CZ-CD2 3.99Å; F113-F146 AromaticContact CZ-CE2 3.7Å; F113-F146 HydrophobicContact CZ-CE2 3.7Å
114T90.3Very high81.2Confident36 Ų36110.5 Ų110.522%0.22151%0.506CS..THydrogen-bonded Turntrans-54.3-30-172.858.60000114.7S112 Y116 P118 L135 D139S112-T114 VanDerWaalsContact C-N 3.25Å; S112-T114 PolarHBondContact O-N 2.88Å; S112-T114 PolarHBondContact OG-OG1 3.45Å; S112-T114 VanDerWaalsContact OG-OG1 3.11Å; T114-Y116 VanDerWaalsContact C-N 3.32Å; T114-Y116 PolarHBondContact O-N 2.94Å; T114-P118 WeakPolarHBondContact O-CD 3.39Å; T114-L135 HydrophobicContact CG2-CB 4.4Å; T114-D139 HydrophobicContact CG2-CB 4.29Å
115I90.2Very high81.5Confident102 Ų102109.5 Ų109.552%0.52351%0.508SS..THydrogen-bonded Turntrans-70.7-28.2179.2-61.3169.8000111.9F113F113-I115 PolarHBondContact O-N 3.4Å
116Y91.2Very high81.9Confident130 Ų130111.8 Ų111.851%0.5152%0.517SS..THydrogen-bonded Turntrans-82.3-33.7-174.1-57.2-72.5000112.6F113 T114 R119 V120F113-Y116 HydrophobicContact CB-CD2 4.15Å; F113-Y116 HydrophobicContact CD1-CD2 4.02Å; F113-Y116 HydrophobicContact CD1-CE2 4.13Å; F113-Y116 WeakPolarHBondContact O-CD2 3.49Å; F113-Y116 PolarHBondContact O-N 2.99Å; T114-Y116 VanDerWaalsContact C-N 3.32Å; T114-Y116 PolarHBondContact O-N 2.94Å; Y116-R119 WeakPolarHBondContact O-CA 3.33Å; Y116-R119 WeakPolarHBondContact O-CB 3.12Å; Y116-R119 PolarHBondContact O-N 3.38Å; Y116-V120 WeakPolarHBondContact O-CG2 3.44Å; Y116-V120 PolarHBondContact O-N 3.22Å
117F92.1Very high82.3Confident31 Ų31110.5 Ų110.514%0.13653%0.53CS..Hα-helixtrans-58.9-47.4-175.7-51.9-68.6000113.3F113 R119 V120 L121 L130 L135 L138 D139 V142F113-F117 HydrophobicContact CB-CE2 3.97Å; F113-F117 HydrophobicContact CB-CZ 3.82Å; F113-F117 WeakPolarHBondContact O-CD2 3.5Å; F113-F117 WeakPolarHBondContact O-CE2 3.26Å; F117-R119 PolarHBondContact O-N 2.74Å; F117-V120 PolarHBondContact O-N 3.01Å; F117-L121 WeakPolarHBondContact O-CB 3.42Å; F117-L121 WeakPolarHBondContact O-CD1 3.2Å; F117-L121 VanDerWaalsContact O-CG 3.26Å; F117-L121 WeakPolarHBondContact O-CG 3.3Å; F117-L121 PolarHBondContact O-N 3.02Å; F117-L130 HydrophobicContact CB-CD1 4.11Å; F117-L135 HydrophobicContact CB-CD2 3.78Å; F117-L135 HydrophobicContact CD2-CD2 3.68Å; F117-L135 HydrophobicContact CG-CD2 4.12Å; F117-L138 HydrophobicContact CD1-CB 4.34Å; F117-L138 HydrophobicContact CD1-CD1 4.42Å; F117-L138 HydrophobicContact CD2-CB 4.45Å; F117-L138 HydrophobicContact CE1-CB 3.91Å; F117-L138 HydrophobicContact CE2-CB 4.03Å; F117-L138 HydrophobicContact CG-CD1 4.48Å; F117-L138 HydrophobicContact CZ-CB 3.74Å; F117-D139 HydrophobicContact CE2-CB 4.4Å; F117-V142 HydrophobicContact CE1-CG2 3.97Å; F117-V142 HydrophobicContact CZ-CG2 4.06Å
118P89.6Confident83.2Confident59 Ų59108.5 Ų108.538%0.38352%0.522SS..Hα-helixtrans-65.9-24.5176.3-20.233.7000113.5T114 R122T114-P118 WeakPolarHBondContact O-CD 3.39Å; P118-R122 VanDerWaalsContact O-CG 3.3Å; P118-R122 WeakPolarHBondContact O-CG 3.41Å; P118-R122 PolarHBondContact O-N 3.23Å; P118-R122 PolarHBondContact O-NE 3.35Å
119R89.5Confident84.4Confident139 Ų139105.7 Ų105.753%0.52553%0.526SS..Hα-helixtrans-71.8-45.7174.8-62.1177.1-179-170.6-1.4110.7Y116 F117 N123Y116-R119 WeakPolarHBondContact O-CA 3.33Å; Y116-R119 WeakPolarHBondContact O-CB 3.12Å; Y116-R119 PolarHBondContact O-N 3.38Å; F117-R119 PolarHBondContact O-N 2.74Å; R119-N123 PolarHBondContact O-OD1 2.97Å
120V90.7Very high85.8Confident81 Ų8198 Ų9849%0.49150%0.499SS..Hα-helixtrans-67-42.9178.2176.30000111.2Y116 F117 R122 N123 I124Y116-V120 WeakPolarHBondContact O-CG2 3.44Å; Y116-V120 PolarHBondContact O-N 3.22Å; F117-V120 PolarHBondContact O-N 3.01Å; V120-R122 VanDerWaalsContact C-N 3.34Å; V120-R122 PolarHBondContact O-N 3.08Å; V120-N123 WeakPolarHBondContact O-CB 3.46Å; V120-N123 PolarHBondContact O-N 3.39Å; V120-N123 VanDerWaalsContact O-N 3.08Å; V120-I124 HydrophobicContact CG1-CD1 4.33Å
121L89.3Confident87.3Confident39 Ų3992.3 Ų92.320%0.20448%0.482CS..Hα-helixtrans-65.9-35-177.2-73.8165.4000113.3F117 N123 I124 H125 F128 L130F117-L121 WeakPolarHBondContact O-CB 3.42Å; F117-L121 WeakPolarHBondContact O-CD1 3.2Å; F117-L121 VanDerWaalsContact O-CG 3.26Å; F117-L121 WeakPolarHBondContact O-CG 3.3Å; F117-L121 PolarHBondContact O-N 3.02Å; L121-N123 PolarHBondContact O-N 3.27Å; L121-I124 PolarHBondContact O-N 3.01Å; L121-H125 PolarHBondContact O-N 2.93Å; L121-F128 HydrophobicContact CB-CD1 4.29Å; L121-F128 HydrophobicContact CD1-CD1 3.71Å; L121-F128 HydrophobicContact CD1-CE1 3.71Å; L121-F128 HydrophobicContact CD2-CD1 3.81Å; L121-F128 HydrophobicContact CD2-CE1 3.91Å; L121-F128 HydrophobicContact CG-CD1 4.14Å; L121-F128 HydrophobicContact CG-CE1 4.39Å; L121-L130 HydrophobicContact CD1-CD1 3.27Å; L121-L130 HydrophobicContact CD1-CD2 4.4Å; L121-L130 HydrophobicContact CD1-CG 3.51Å
122R87.9Confident88Confident148 Ų14894.1 Ų94.156%0.55849%0.487SS*.Hα-helixtrans-60.2-27.5174.2-79.2-174-64.1175.56.6112.8P118 V120 I124 M126P118-R122 VanDerWaalsContact O-CG 3.3Å; P118-R122 WeakPolarHBondContact O-CG 3.41Å; P118-R122 PolarHBondContact O-N 3.23Å; P118-R122 PolarHBondContact O-NE 3.35Å; V120-R122 VanDerWaalsContact C-N 3.34Å; V120-R122 PolarHBondContact O-N 3.08Å; R122-I124 VanDerWaalsContact C-N 3.33Å; R122-M126 HydrophobicContact CB-CE 4.06Å; R122-M126 HydrophobicContact CG-CE 4.33Å; R122-M126 WeakPolarHBondContact O-CE 3.41Å
123N86Confident88.3Confident143 Ų14399 Ų9977%0.76551%0.506SS*.Hα-helixtrans-74.9-24.3176.8-60-11.2000112.6R119 V120 L121R119-N123 PolarHBondContact O-OD1 2.97Å; V120-N123 WeakPolarHBondContact O-CB 3.46Å; V120-N123 PolarHBondContact O-N 3.39Å; V120-N123 VanDerWaalsContact O-N 3.08Å; L121-N123 PolarHBondContact O-N 3.27Å
124I88.8Confident88.4Confident108 Ų10898.1 Ų98.155%0.55451%0.507SS*.Hα-helixtrans-96.7-47.7-175.2-53.5171.4000110.2V120 L121 R122V120-I124 HydrophobicContact CG1-CD1 4.33Å; L121-I124 PolarHBondContact O-N 3.01Å; R122-I124 VanDerWaalsContact C-N 3.33Å
125H81.3Confident88.5Confident131 Ų13196.9 Ų96.961%0.60650%0.499SS*.  trans-142.9119.9178.2-65.1-60.2000111.2L121 G127 F128L121-H125 PolarHBondContact O-N 2.93Å; H125-G127 PolarHBondContact O-N 2.9Å; H125-F128 HydrophobicContact CB-CB 4.45Å
126M81.1Confident88.6Confident162 Ų16296.5 Ų96.580%0.79850%0.498SS*.THydrogen-bonded Turntrans-73122.2169.3-56.9-115.887.900108.4R122R122-M126 HydrophobicContact CB-CE 4.06Å; R122-M126 HydrophobicContact CG-CE 4.33Å; R122-M126 WeakPolarHBondContact O-CE 3.41Å
127G79Confident88.8Confident79 Ų7995.6 Ų95.681%0.81450%0.501SS*.THydrogen-bonded Turntrans110.8-5.2178.800000115.6H125H125-G127 PolarHBondContact O-N 2.9Å
128F84.4Confident88.9Confident112 Ų11297 Ų9749%0.49151%0.51SS..  trans-86.4126174.6-173.8-106.1000111.8L121 H125 L130L121-F128 HydrophobicContact CB-CD1 4.29Å; L121-F128 HydrophobicContact CD1-CD1 3.71Å; L121-F128 HydrophobicContact CD1-CE1 3.71Å; L121-F128 HydrophobicContact CD2-CD1 3.81Å; L121-F128 HydrophobicContact CD2-CE1 3.91Å; L121-F128 HydrophobicContact CG-CD1 4.14Å; L121-F128 HydrophobicContact CG-CE1 4.39Å; H125-F128 HydrophobicContact CB-CB 4.45Å; F128-L130 HydrophobicContact CD1-CD2 4.48Å; F128-L130 HydrophobicContact CD1-CG 4.38Å; F128-L130 HydrophobicContact CE1-CD2 3.33Å; F128-L130 HydrophobicContact CE1-CG 3.6Å; F128-L130 HydrophobicContact CZ-CD2 3.51Å; F128-L130 HydrophobicContact CZ-CG 4.25Å
129T86.3Confident89.1Confident127 Ų12795 Ų9578%0.77950%0.496SS*.  trans-124.2123.7176.759.10000110.2
130L89.3Confident89.2Confident41 Ų4191.8 Ų91.822%0.21550%0.495CS..  trans-81.3143.4177.1-75.2176.4000112.4F117 L121 F128 L135 L138F117-L130 HydrophobicContact CB-CD1 4.11Å; L121-L130 HydrophobicContact CD1-CD1 3.27Å; L121-L130 HydrophobicContact CD1-CD2 4.4Å; L121-L130 HydrophobicContact CD1-CG 3.51Å; F128-L130 HydrophobicContact CD1-CD2 4.48Å; F128-L130 HydrophobicContact CD1-CG 4.38Å; F128-L130 HydrophobicContact CE1-CD2 3.33Å; F128-L130 HydrophobicContact CE1-CG 3.6Å; F128-L130 HydrophobicContact CZ-CD2 3.51Å; F128-L130 HydrophobicContact CZ-CG 4.25Å; L130-L135 HydrophobicContact CB-CD2 4.01Å; L130-L135 HydrophobicContact CB-CG 4.01Å; L130-L135 HydrophobicContact CD1-CD2 3.65Å; L130-L135 HydrophobicContact CD1-CG 4.38Å; L130-L138 HydrophobicContact CD1-CD1 3.5Å
131S93.4Very high89.4Confident59 Ų5993.5 Ų93.541%0.41350%0.496SS..  trans-70157.9168.685.20000111.2E133 S134 L135S131-E133 PolarHBondContact O-N 2.99Å; S131-E133 PolarHBondContact OG-N 2.95Å; S131-S134 PolarHBondContact O-N 3.48Å; S131-S134 PolarHBondContact OG-N 3.44Å; S131-S134 VanDerWaalsContact OG-N 3.09Å; S131-S134 PolarHBondContact OG-OG 2.95Å; S131-L135 WeakPolarHBondContact O-CG 2.99Å; S131-L135 PolarHBondContact O-N 3.27Å
132Q89.8Confident89.6Confident144 Ų14493.2 Ų93.267%0.67350%0.495SS*.Hα-helixtrans-63.8-29.2176.6-66.8-64.6-20.700112.8N136Q132-N136 VanDerWaalsContact O-CG 3.25Å; Q132-N136 PolarHBondContact O-N 3.23Å; Q132-N136 PolarHBondContact O-ND2 2.99Å
133E92.3Very high89.9Confident145 Ų14588.8 Ų88.868%0.67848%0.48SS*.Hα-helixtrans-71.4-44.8176.5-174.3168-167.900111.1S131 L135 N136 I137S131-E133 PolarHBondContact O-N 2.99Å; S131-E133 PolarHBondContact OG-N 2.95Å; E133-L135 VanDerWaalsContact C-N 3.29Å; E133-L135 PolarHBondContact O-N 3.29Å; E133-N136 PolarHBondContact O-N 3.36Å; E133-N136 VanDerWaalsContact O-N 3.1Å; E133-I137 HydrophobicContact CG-CD1 4.45Å; E133-I137 WeakPolarHBondContact O-CG1 3.43Å; E133-I137 PolarHBondContact O-N 3.26Å; E133-I137 VanDerWaalsContact O-N 3.07Å
134S94.1Very high90.2Very high44 Ų4484.9 Ų84.931%0.30846%0.459SS..Hα-helixtrans-59.3-41.2174-49.80000111.6S131 N136 I137 L138S131-S134 PolarHBondContact O-N 3.48Å; S131-S134 PolarHBondContact OG-N 3.44Å; S131-S134 VanDerWaalsContact OG-N 3.09Å; S131-S134 PolarHBondContact OG-OG 2.95Å; S134-N136 VanDerWaalsContact C-N 3.32Å; S134-N136 PolarHBondContact O-N 3.42Å; S134-I137 PolarHBondContact O-N 3.48Å; S134-L138 WeakPolarHBondContact O-CB 3.26Å; S134-L138 VanDerWaalsContact O-CG 3.26Å; S134-L138 WeakPolarHBondContact O-CG 3.47Å; S134-L138 PolarHBondContact O-N 2.94Å
135L92.9Very high90.5Very high11 Ų1181.8 Ų81.86%0.05844%0.443CS..Hα-helixtrans-62-37175.7-69.9170.7000112.7T114 F117 L130 S131 E133 D139T114-L135 HydrophobicContact CG2-CB 4.4Å; F117-L135 HydrophobicContact CB-CD2 3.78Å; F117-L135 HydrophobicContact CD2-CD2 3.68Å; F117-L135 HydrophobicContact CG-CD2 4.12Å; L130-L135 HydrophobicContact CB-CD2 4.01Å; L130-L135 HydrophobicContact CB-CG 4.01Å; L130-L135 HydrophobicContact CD1-CD2 3.65Å; L130-L135 HydrophobicContact CD1-CG 4.38Å; S131-L135 WeakPolarHBondContact O-CG 2.99Å; S131-L135 PolarHBondContact O-N 3.27Å; E133-L135 VanDerWaalsContact C-N 3.29Å; E133-L135 PolarHBondContact O-N 3.29Å; L135-D139 VanDerWaalsContact O-CB 3.3Å; L135-D139 WeakPolarHBondContact O-CB 3.37Å; L135-D139 PolarHBondContact O-N 2.81Å
136N91.9Very high91.1Very high94 Ų9480.9 Ų80.950%0.50344%0.437SS..Hα-helixtrans-70.4-38.1177.4-67.8-25.9000112.4Q132 E133 S134 S140Q132-N136 VanDerWaalsContact O-CG 3.25Å; Q132-N136 PolarHBondContact O-N 3.23Å; Q132-N136 PolarHBondContact O-ND2 2.99Å; E133-N136 PolarHBondContact O-N 3.36Å; E133-N136 VanDerWaalsContact O-N 3.1Å; S134-N136 VanDerWaalsContact C-N 3.32Å; S134-N136 PolarHBondContact O-N 3.42Å; N136-S140 PolarHBondContact O-N 3.21Å; N136-S140 VanDerWaalsContact O-N 3.09Å; N136-S140 PolarHBondContact O-OG 3.35Å
137I94.4Very high91.7Very high111 Ų11179.6 Ų79.657%0.56943%0.429SS*.Hα-helixtrans-63.7-47174.7-64.5167.2000109.4E133 S134 S140 F141E133-I137 HydrophobicContact CG-CD1 4.45Å; E133-I137 WeakPolarHBondContact O-CG1 3.43Å; E133-I137 PolarHBondContact O-N 3.26Å; E133-I137 VanDerWaalsContact O-N 3.07Å; S134-I137 PolarHBondContact O-N 3.48Å; I137-S140 PolarHBondContact O-N 3.41Å; I137-F141 WeakPolarHBondContact O-CB 3.4Å; I137-F141 PolarHBondContact O-N 3.43Å
138L94.9Very high92.5Very high61 Ų6181.8 Ų81.832%0.31941%0.413SS..Hα-helixtrans-64.5-40.2178.2-69.2170.7000112.7F117 L130 S134 S140 F141 V142F117-L138 HydrophobicContact CD1-CB 4.34Å; F117-L138 HydrophobicContact CD1-CD1 4.42Å; F117-L138 HydrophobicContact CD2-CB 4.45Å; F117-L138 HydrophobicContact CE1-CB 3.91Å; F117-L138 HydrophobicContact CE2-CB 4.03Å; F117-L138 HydrophobicContact CG-CD1 4.48Å; F117-L138 HydrophobicContact CZ-CB 3.74Å; L130-L138 HydrophobicContact CD1-CD1 3.5Å; S134-L138 WeakPolarHBondContact O-CB 3.26Å; S134-L138 VanDerWaalsContact O-CG 3.26Å; S134-L138 WeakPolarHBondContact O-CG 3.47Å; S134-L138 PolarHBondContact O-N 2.94Å; L138-S140 VanDerWaalsContact C-N 3.31Å; L138-S140 PolarHBondContact O-N 3.29Å; L138-F141 PolarHBondContact O-N 2.98Å; L138-V142 WeakPolarHBondContact O-CG2 3.45Å; L138-V142 PolarHBondContact O-N 2.91Å
139D92.9Very high93.1Very high16 Ų1677.8 Ų77.89%0.08640%0.397CS..Hα-helixtrans-60.3-41.5175.2-174.563.1000111.8S112 F113 T114 F117 L135 K143S112-D139 WeakPolarHBondContact CA-OD1 3.42Å; F113-D139 PolarHBondContact N-OD1 3.28Å; T114-D139 HydrophobicContact CG2-CB 4.29Å; F117-D139 HydrophobicContact CE2-CB 4.4Å; L135-D139 VanDerWaalsContact O-CB 3.3Å; L135-D139 WeakPolarHBondContact O-CB 3.37Å; L135-D139 PolarHBondContact O-N 2.81Å; D139-K143 WeakPolarHBondContact O-CD 3.28Å; D139-K143 VanDerWaalsContact O-CG 3.28Å; D139-K143 WeakPolarHBondContact O-CG 3.44Å; D139-K143 PolarHBondContact O-N 3.46Å; D139-K143 IonicContact OD1-NZ 3.44Å; D139-K143 WeakPolarHBondContact OD2-CE 3.36Å; D139-K143 IonicContact OD2-NZ 3.38Å; D139-K143 PolarHBondContact OD2-NZ 3.09Å
140S93.3Very high93.5Very high72 Ų7274.4 Ų74.450%0.50338%0.382SS..Hα-helixtrans-72.3-39.5178.5-53.80000111.9N136 I137 L138 K143 D144N136-S140 PolarHBondContact O-N 3.21Å; N136-S140 VanDerWaalsContact O-N 3.09Å; N136-S140 PolarHBondContact O-OG 3.35Å; I137-S140 PolarHBondContact O-N 3.41Å; L138-S140 VanDerWaalsContact C-N 3.31Å; L138-S140 PolarHBondContact O-N 3.29Å; S140-K143 PolarHBondContact O-N 2.73Å; S140-D144 PolarHBondContact O-N 3.29Å
141F94.5Very high93.8Very high117 Ų11776.1 Ų76.151%0.51339%0.394SS..Hα-helixtrans-59.3-48.7175.6172.2-103.6000111.7I137 L138 K143 D144 M145I137-F141 WeakPolarHBondContact O-CB 3.4Å; I137-F141 PolarHBondContact O-N 3.43Å; L138-F141 PolarHBondContact O-N 2.98Å; F141-K143 VanDerWaalsContact C-N 3.28Å; F141-K143 PolarHBondContact O-N 2.8Å; F141-D144 PolarHBondContact O-N 3.28Å; F141-M145 HydrophobicContact CD2-CG 4.4Å; F141-M145 HydrophobicContact CE1-CG 4.06Å; F141-M145 HydrophobicContact CE2-CE 4.28Å; F141-M145 HydrophobicContact CE2-CG 3.93Å; F141-M145 HydrophobicContact CE2-SD 4.21Å; F141-M145 HydrophobicContact CZ-CG 3.74Å; F141-M145 HydrophobicContact CZ-SD 4.25Å; F141-M145 WeakPolarHBondContact O-CG 3.3Å; F141-M145 PolarHBondContact O-N 3.49Å
142V93.6Very high94Very high32 Ų3276.4 Ų76.419%0.19439%0.388CS..Hα-helixtrans-61.2-38.9178.6169.80000111.1F113 F117 L138 M145 F146F113-V142 HydrophobicContact CD2-CB 4.33Å; F113-V142 HydrophobicContact CD2-CG1 3.74Å; F113-V142 HydrophobicContact CE2-CG1 3.87Å; F113-V142 HydrophobicContact CG-CG1 4.11Å; F113-V142 HydrophobicContact CZ-CG1 4.34Å; F117-V142 HydrophobicContact CE1-CG2 3.97Å; F117-V142 HydrophobicContact CZ-CG2 4.06Å; L138-V142 WeakPolarHBondContact O-CG2 3.45Å; L138-V142 PolarHBondContact O-N 2.91Å; V142-M145 PolarHBondContact O-N 3.03Å; V142-F146 HydrophobicContact CG1-CD2 3.48Å; V142-F146 VanDerWaalsContact CG1-CD2 3.48Å; V142-F146 HydrophobicContact CG1-CE2 3.22Å; V142-F146 HydrophobicContact CG1-CZ 4.32Å; V142-F146 WeakPolarHBondContact O-CD2 3.46Å; V142-F146 PolarHBondContact O-N 3.11Å
143K93.3Very high94.3Very high56 Ų5669.6 Ų69.624%0.24336%0.357CS..Hα-helixtrans-64-45.9175.5-73.5167.8179.8172.70112.7D111 F113 D139 S140 F141 M145 F146 E147D111-K143 WeakPolarHBondContact O-CE 3.38Å; D111-K143 PolarHBondContact O-NZ 3.03Å; F113-K143 HydrophobicContact CD2-CG 4.44Å; F113-K143 HydrophobicContact CE2-CG 4.06Å; D139-K143 WeakPolarHBondContact O-CD 3.28Å; D139-K143 VanDerWaalsContact O-CG 3.28Å; D139-K143 WeakPolarHBondContact O-CG 3.44Å; D139-K143 PolarHBondContact O-N 3.46Å; D139-K143 IonicContact OD1-NZ 3.44Å; D139-K143 WeakPolarHBondContact OD2-CE 3.36Å; D139-K143 IonicContact OD2-NZ 3.38Å; D139-K143 PolarHBondContact OD2-NZ 3.09Å; S140-K143 PolarHBondContact O-N 2.73Å; F141-K143 VanDerWaalsContact C-N 3.28Å; F141-K143 PolarHBondContact O-N 2.8Å; K143-M145 VanDerWaalsContact C-N 3.32Å; K143-M145 PolarHBondContact O-N 2.95Å; K143-F146 PolarHBondContact O-N 3.26Å; K143-E147 WeakPolarHBondContact O-CG 3.36Å; K143-E147 PolarHBondContact O-N 3.44Å
144D93.8Very high94.5Very high60 Ų6065 Ų6532%0.32134%0.341SS..Hα-helixtrans-59.6-43.8175.9-178.831.1000111S140 F141 F146 E147 R148S140-D144 PolarHBondContact O-N 3.29Å; F141-D144 PolarHBondContact O-N 3.28Å; D144-F146 PolarHBondContact O-N 2.73Å; D144-E147 PolarHBondContact O-N 3.23Å; D144-R148 VanDerWaalsContact O-CG 3.31Å; D144-R148 WeakPolarHBondContact O-CG 3.33Å; D144-R148 PolarHBondContact O-N 3Å; D144-R148 IonicContact OD1-CZ 3.02Å; D144-R148 IonicContact OD1-NE 3.51Å; D144-R148 PolarHBondContact OD1-NE 2.88Å; D144-R148 IonicContact OD1-NH2 2.76Å; D144-R148 PolarHBondContact OD1-NH2 3.37Å; D144-R148 IonicContact OD2-CZ 3.67Å; D144-R148 IonicContact OD2-NE 2.94Å; D144-R148 PolarHBondContact OD2-NE 3.12Å; D144-R148 IonicContact OD2-NH2 3.48Å; D144-R148 PolarHBondContact OD2-NH2 3.11Å
145M94.3Very high94.6Very high43 Ų4365 Ų6521%0.21234%0.337CS..Hα-helixtrans-63.4-42.9176.8-67.4-57.799.300112.5F141 V142 K143 R148 I149F141-M145 HydrophobicContact CD2-CG 4.4Å; F141-M145 HydrophobicContact CE1-CG 4.06Å; F141-M145 HydrophobicContact CE2-CE 4.28Å; F141-M145 HydrophobicContact CE2-CG 3.93Å; F141-M145 HydrophobicContact CE2-SD 4.21Å; F141-M145 HydrophobicContact CZ-CG 3.74Å; F141-M145 HydrophobicContact CZ-SD 4.25Å; F141-M145 WeakPolarHBondContact O-CG 3.3Å; F141-M145 PolarHBondContact O-N 3.49Å; V142-M145 PolarHBondContact O-N 3.03Å; K143-M145 VanDerWaalsContact C-N 3.32Å; K143-M145 PolarHBondContact O-N 2.95Å; M145-R148 PolarHBondContact O-N 2.88Å; M145-I149 WeakPolarHBondContact O-CD1 3.37Å; M145-I149 VanDerWaalsContact O-CG1 3.26Å; M145-I149 WeakPolarHBondContact O-CG1 3.45Å; M145-I149 PolarHBondContact O-N 3.14Å
146F94.4Very high94.8Very high113 Ų11366.2 Ų66.250%0.49634%0.344SS..Hα-helixtrans-64.2-40.1176.5-81-56000112.8F113 V142 K143 D144 I149 A150F113-F146 HydrophobicContact CE1-CE2 4.08Å; F113-F146 HydrophobicContact CE2-CD2 4.21Å; F113-F146 HydrophobicContact CE2-CE2 4.19Å; F113-F146 AromaticContact CZ-CD2 3.99Å; F113-F146 HydrophobicContact CZ-CD2 3.99Å; F113-F146 AromaticContact CZ-CE2 3.7Å; F113-F146 HydrophobicContact CZ-CE2 3.7Å; V142-F146 HydrophobicContact CG1-CD2 3.48Å; V142-F146 VanDerWaalsContact CG1-CD2 3.48Å; V142-F146 HydrophobicContact CG1-CE2 3.22Å; V142-F146 HydrophobicContact CG1-CZ 4.32Å; V142-F146 WeakPolarHBondContact O-CD2 3.46Å; V142-F146 PolarHBondContact O-N 3.11Å; K143-F146 PolarHBondContact O-N 3.26Å; D144-F146 PolarHBondContact O-N 2.73Å; F146-I149 PolarHBondContact O-N 3.48Å; F146-A150 VanDerWaalsContact O-CB 3.27Å; F146-A150 WeakPolarHBondContact O-CB 3.24Å; F146-A150 PolarHBondContact O-N 2.95Å
147E94.1Very high95Very high134 Ų13461.9 Ų61.963%0.62632%0.321SS*.Hα-helixtrans-63.7-41.2176.7-74.7-179.4-176.800111.6K143 D144 T151K143-E147 WeakPolarHBondContact O-CG 3.36Å; K143-E147 PolarHBondContact O-N 3.44Å; D144-E147 PolarHBondContact O-N 3.23Å; E147-T151 WeakPolarHBondContact O-CB 3.46Å; E147-T151 PolarHBondContact O-N 3.09Å; E147-T151 PolarHBondContact O-OG1 3.33Å
148R95.4Very high95.1Very high125 Ų12565.2 Ų65.247%0.47233%0.327SS..Hα-helixtrans-63.6-47.8174.1-68.2176.6-167.1-146.78.3112D144 M145 A150 T151 E152 L177D144-R148 VanDerWaalsContact O-CG 3.31Å; D144-R148 WeakPolarHBondContact O-CG 3.33Å; D144-R148 PolarHBondContact O-N 3Å; D144-R148 IonicContact OD1-CZ 3.02Å; D144-R148 IonicContact OD1-NE 3.51Å; D144-R148 PolarHBondContact OD1-NE 2.88Å; D144-R148 IonicContact OD1-NH2 2.76Å; D144-R148 PolarHBondContact OD1-NH2 3.37Å; D144-R148 IonicContact OD2-CZ 3.67Å; D144-R148 IonicContact OD2-NE 2.94Å; D144-R148 PolarHBondContact OD2-NE 3.12Å; D144-R148 IonicContact OD2-NH2 3.48Å; D144-R148 PolarHBondContact OD2-NH2 3.11Å; M145-R148 PolarHBondContact O-N 2.88Å; R148-A150 PolarHBondContact O-N 2.81Å; R148-T151 PolarHBondContact O-N 3.32Å; R148-E152 PolarHBondContact O-N 3.07Å; R148-L177 VanDerWaalsContact C-CD1 3.48Å; R148-L177 HydrophobicContact CB-CD1 3.91Å; R148-L177 HydrophobicContact CB-CD2 4.29Å
149I95.3Very high95.1Very high29 Ų2971.2 Ų71.215%0.14935%0.346CS..Hα-helixtrans-61.1-44.9178.7-67.6162000110.9M145 F146 T151 E152 A153 I170 A173 V174 L177M145-I149 WeakPolarHBondContact O-CD1 3.37Å; M145-I149 VanDerWaalsContact O-CG1 3.26Å; M145-I149 WeakPolarHBondContact O-CG1 3.45Å; M145-I149 PolarHBondContact O-N 3.14Å; F146-I149 PolarHBondContact O-N 3.48Å; I149-T151 VanDerWaalsContact C-N 3.29Å; I149-T151 PolarHBondContact O-N 3.47Å; I149-E152 PolarHBondContact O-N 3.42Å; I149-A153 VanDerWaalsContact O-CB 3.22Å; I149-A153 WeakPolarHBondContact O-CB 3.47Å; I149-A153 PolarHBondContact O-N 3.37Å; I149-I170 HydrophobicContact CG2-CG2 4.29Å; I149-A173 HydrophobicContact CG2-CB 4.29Å; I149-V174 HydrophobicContact CD1-CG2 3.96Å; I149-V174 HydrophobicContact CG1-CG2 4.18Å; I149-V174 HydrophobicContact CG2-CG2 4.01Å; I149-L177 VanDerWaalsContact CA-CD1 3.47Å; I149-L177 HydrophobicContact CB-CD1 4.16Å; I149-L177 HydrophobicContact CG1-CD1 3.61Å
150A95.9Very high95.1Very high56 Ų5673.8 Ų73.846%0.46336%0.363SS..Hα-helixtrans-62.2-38.8178.600000112F146 R148 S154F146-A150 VanDerWaalsContact O-CB 3.27Å; F146-A150 WeakPolarHBondContact O-CB 3.24Å; F146-A150 PolarHBondContact O-N 2.95Å; R148-A150 PolarHBondContact O-N 2.81Å; A150-S154 VanDerWaalsContact O-CB 3.26Å; A150-S154 WeakPolarHBondContact O-CB 3.3Å; A150-S154 PolarHBondContact O-N 3.29Å
151T96.4Very high95.2Very high77 Ų7781.6 Ų81.647%0.47238%0.381SS..Hα-helixtrans-66.1-48.5178.4-59.30000111E147 R148 I149 S154 N155E147-T151 WeakPolarHBondContact O-CB 3.46Å; E147-T151 PolarHBondContact O-N 3.09Å; E147-T151 PolarHBondContact O-OG1 3.33Å; R148-T151 PolarHBondContact O-N 3.32Å; I149-T151 VanDerWaalsContact C-N 3.29Å; I149-T151 PolarHBondContact O-N 3.47Å; T151-S154 WeakPolarHBondContact O-CB 3.44Å; T151-S154 PolarHBondContact O-N 3.38Å; T151-N155 VanDerWaalsContact O-CG 3.26Å; T151-N155 PolarHBondContact O-N 2.83Å; T151-N155 PolarHBondContact O-ND2 3.01Å
152E96.1Very high95.1Very high64 Ų6481.5 Ų81.530%0.29938%0.377SS..Hα-helixtrans-67.7-40178.3-70.7-52.214300112.9R148 I149 S154 N155 L156 A173 L177R148-E152 PolarHBondContact O-N 3.07Å; I149-E152 PolarHBondContact O-N 3.42Å; E152-S154 VanDerWaalsContact C-N 3.29Å; E152-S154 PolarHBondContact O-N 3.1Å; E152-N155 WeakPolarHBondContact O-CB 3.36Å; E152-N155 PolarHBondContact O-N 3.2Å; E152-N155 VanDerWaalsContact O-N 3.15Å; E152-L156 WeakPolarHBondContact O-CG 3.35Å; E152-L156 PolarHBondContact O-N 3.24Å; E152-A173 HydrophobicContact CB-CB 3.79Å; E152-L177 HydrophobicContact CB-CD1 4.31Å; E152-L177 HydrophobicContact CG-CD1 4.06Å; E152-L177 HydrophobicContact CG-CD2 4.03Å; E152-L177 HydrophobicContact CG-CG 4.13Å
153A96.6Very high95.1Very high2 Ų285.8 Ų85.82%0.01741%0.409CS..Hα-helixtrans-62.8-38175.600000111.7I149 L156 A157 I165 I170 A173I149-A153 VanDerWaalsContact O-CB 3.22Å; I149-A153 WeakPolarHBondContact O-CB 3.47Å; I149-A153 PolarHBondContact O-N 3.37Å; A153-L156 PolarHBondContact O-N 2.88Å; A153-A157 PolarHBondContact O-N 3.02Å; A153-I165 HydrophobicContact CB-CG2 3.88Å; A153-I170 HydrophobicContact CB-CG1 4.23Å; A153-A173 HydrophobicContact CB-CB 3.95Å
154S96.7Very high95.2Very high48 Ų4889.3 Ų89.334%0.33643%0.429SS..Hα-helixtrans-64.3-43172.7-176.30000111.7A150 T151 E152 L156 A157 R158A150-S154 VanDerWaalsContact O-CB 3.26Å; A150-S154 WeakPolarHBondContact O-CB 3.3Å; A150-S154 PolarHBondContact O-N 3.29Å; T151-S154 WeakPolarHBondContact O-CB 3.44Å; T151-S154 PolarHBondContact O-N 3.38Å; E152-S154 VanDerWaalsContact C-N 3.29Å; E152-S154 PolarHBondContact O-N 3.1Å; S154-L156 PolarHBondContact O-N 3.04Å; S154-A157 PolarHBondContact O-N 3.27Å; S154-R158 VanDerWaalsContact O-CG 3.27Å; S154-R158 WeakPolarHBondContact O-CG 3.19Å; S154-R158 PolarHBondContact O-N 2.81Å
155N96.3Very high95.3Very high43 Ų4390.1 Ų90.123%0.2343%0.432CS..Hα-helixtrans-60.5-44.1175.6-68.4-24000111.5T151 E152 R158 Y159T151-N155 VanDerWaalsContact O-CG 3.26Å; T151-N155 PolarHBondContact O-N 2.83Å; T151-N155 PolarHBondContact O-ND2 3.01Å; E152-N155 WeakPolarHBondContact O-CB 3.36Å; E152-N155 PolarHBondContact O-N 3.2Å; E152-N155 VanDerWaalsContact O-N 3.15Å; N155-R158 WeakPolarHBondContact O-CB 3.27Å; N155-R158 PolarHBondContact O-N 2.84Å; N155-Y159 HydrophobicContact CB-CD2 4.49Å; N155-Y159 HydrophobicContact CB-CE2 4.07Å; N155-Y159 WeakPolarHBondContact O-CD2 3.28Å; N155-Y159 PolarHBondContact O-N 3.35Å
156L95.9Very high95.3Very high37 Ų3792.1 Ų92.119%0.19444%0.444CS..Hα-helixtrans-62.1-42.7176.6-72.2169.2000113.3E152 A153 S154 R158 Y159 T160 D169 A173 L176E152-L156 WeakPolarHBondContact O-CG 3.35Å; E152-L156 PolarHBondContact O-N 3.24Å; A153-L156 PolarHBondContact O-N 2.88Å; S154-L156 PolarHBondContact O-N 3.04Å; L156-R158 VanDerWaalsContact C-N 3.3Å; L156-R158 PolarHBondContact O-N 3.29Å; L156-Y159 PolarHBondContact O-N 3.43Å; L156-T160 PolarHBondContact O-N 3.49Å; L156-T160 VanDerWaalsContact O-N 3.09Å; L156-T160 PolarHBondContact O-OG1 2.98Å; L156-D169 HydrophobicContact CB-CB 4.22Å; L156-D169 WeakPolarHBondContact CD1-O 3.28Å; L156-A173 HydrophobicContact CD1-CB 4.17Å; L156-L176 HydrophobicContact CD1-CD1 4.36Å
157A96.6Very high95.3Very high4 Ų490 Ų903%0.03344%0.443CS..Hα-helixtrans-60.2-43.3173.600000110.8A153 S154 T160 R161 R162 I165A153-A157 PolarHBondContact O-N 3.02Å; S154-A157 PolarHBondContact O-N 3.27Å; A157-T160 CarbonylContact O-C 3.49Å; A157-T160 PolarHBondContact O-N 2.93Å; A157-R161 PolarHBondContact O-N 3.5Å; A157-R161 VanDerWaalsContact O-N 3.11Å; A157-R162 CarbonylContact C-O 3.59Å; A157-R162 PolarHBondContact O-N 2.93Å; A157-I165 HydrophobicContact CB-CG1 4.21Å
158R95.9Very high95.2Very high181 Ų18191.7 Ų91.768%0.68344%0.444SS*.Hα-helixtrans-64.8-40.6176.7-69.617571.7-1622.4112.9S154 N155 L156 T160 R161S154-R158 VanDerWaalsContact O-CG 3.27Å; S154-R158 WeakPolarHBondContact O-CG 3.19Å; S154-R158 PolarHBondContact O-N 2.81Å; N155-R158 WeakPolarHBondContact O-CB 3.27Å; N155-R158 PolarHBondContact O-N 2.84Å; L156-R158 VanDerWaalsContact C-N 3.3Å; L156-R158 PolarHBondContact O-N 3.29Å; R158-T160 VanDerWaalsContact C-N 3.26Å; R158-T160 PolarHBondContact O-N 3.26Å; R158-R161 PolarHBondContact O-N 3.24Å
159Y95.3Very high95.1Very high186 Ų18686.1 Ų86.173%0.72942%0.423SS*.Hα-helixtrans-60.2-39.4175-73.8-56.9000111.8N155 L156 R161N155-Y159 HydrophobicContact CB-CD2 4.49Å; N155-Y159 HydrophobicContact CB-CE2 4.07Å; N155-Y159 WeakPolarHBondContact O-CD2 3.28Å; N155-Y159 PolarHBondContact O-N 3.35Å; L156-Y159 PolarHBondContact O-N 3.43Å; Y159-R161 PolarHBondContact O-N 3.46Å
160T94.1Very high95.1Very high70 Ų7088.6 Ų88.643%0.42944%0.436SS..THydrogen-bonded Turntrans-83.54.7178.1-420000112.7L156 A157 R158 R162L156-T160 PolarHBondContact O-N 3.49Å; L156-T160 VanDerWaalsContact O-N 3.09Å; L156-T160 PolarHBondContact O-OG1 2.98Å; A157-T160 CarbonylContact O-C 3.49Å; A157-T160 PolarHBondContact O-N 2.93Å; R158-T160 VanDerWaalsContact C-N 3.26Å; R158-T160 PolarHBondContact O-N 3.26Å; T160-R162 HydrophobicContact CG2-CG 4.33Å; T160-R162 VanDerWaalsContact CG2-CZ 3.4Å; T160-R162 PolarHBondContact O-N 3.42Å
161R94.9Very high95Very high236 Ų23690.1 Ų90.189%0.89143%0.434SS*.THydrogen-bonded Turntrans55.831.5-176.3-53.1-174-173.6-173.22.2114.2A157 R158 Y159A157-R161 PolarHBondContact O-N 3.5Å; A157-R161 VanDerWaalsContact O-N 3.11Å; R158-R161 PolarHBondContact O-N 3.24Å; Y159-R161 PolarHBondContact O-N 3.46Å
162R93.2Very high94.8Very high116 Ų11688.5 Ų88.544%0.43843%0.426SS..  trans-98.1140.6173.9-62.5-176.4-173.5131.93109.7A157 T160A157-R162 CarbonylContact C-O 3.59Å; A157-R162 PolarHBondContact O-N 2.93Å; T160-R162 HydrophobicContact CG2-CG 4.33Å; T160-R162 VanDerWaalsContact CG2-CZ 3.4Å; T160-R162 PolarHBondContact O-N 3.42Å
163S93Very high94.7Very high122 Ų12285.5 Ų85.585%0.85341%0.412SS*.SBendtrans-87.5-12.8173.653.10000113.1
164I95.4Very high94.6Very high130 Ų13087.5 Ų87.567%0.66742%0.424SS*.SBendtrans-111.4129-178.6-55.3173.3000108.4N166I164-N166 PolarHBondContact O-N 3.3Å
165I95.6Very high94.3Very high77 Ų7789.3 Ų89.340%0.39542%0.424SS..  trans-75.9121.2172.7-58.5175.8000108.2A153 A157 D169 I170A153-I165 HydrophobicContact CB-CG2 3.88Å; A157-I165 HydrophobicContact CB-CG1 4.21Å; I165-D169 HydrophobicContact CG2-CB 4.14Å; I165-I170 HydrophobicContact CG2-CD1 4.31Å; I165-I170 HydrophobicContact CG2-CG1 3.85Å
166N93.9Very high94.1Very high84 Ų8492.7 Ų92.745%0.44944%0.441SS..  trans-97.7164.8178.7-160.2-2.7000111.5I164 R168 D169 I170I164-N166 PolarHBondContact O-N 3.3Å; N166-R168 PolarHBondContact O-N 3.34Å; N166-D169 WeakPolarHBondContact CB-OD2 3.41Å; N166-D169 PolarHBondContact N-OD2 2.88Å; N166-D169 WeakPolarHBondContact O-CB 3.46Å; N166-D169 PolarHBondContact O-N 2.79Å; N166-I170 PolarHBondContact O-N 3.28Å
167S93.9Very high93.8Very high70 Ų7093.6 Ų93.649%0.4945%0.446SS..Hα-helixtrans-56-36.8176.158.60000112.6D169 I170 Q171S167-D169 VanDerWaalsContact C-N 3.3Å; S167-D169 PolarHBondContact O-N 2.87Å; S167-I170 PolarHBondContact O-N 3.41Å; S167-Q171 WeakPolarHBondContact O-CB 3.49Å; S167-Q171 VanDerWaalsContact O-CG 3.28Å; S167-Q171 WeakPolarHBondContact O-CG 3.2Å; S167-Q171 PolarHBondContact O-N 3.19Å
168R91.7Very high93.3Very high169 Ų16997.3 Ų97.364%0.63847%0.465SS*.Hα-helixtrans-61-37.4174.3-174.9-179.6-67.1-174.50.5112.4N166 S172N166-R168 PolarHBondContact O-N 3.34Å; R168-S172 VanDerWaalsContact O-CB 3.28Å; R168-S172 WeakPolarHBondContact O-CB 3.49Å; R168-S172 PolarHBondContact O-N 3.1Å; R168-S172 PolarHBondContact O-OG 3.02Å
169D94.3Very high91.9Very high7 Ų792.7 Ų92.74%0.03746%0.458CS..Hα-helixtrans-70.5-41-179.9-53.6-39.7000110.1L156 I165 N166 S167 S172 A173L156-D169 HydrophobicContact CB-CB 4.22Å; L156-D169 WeakPolarHBondContact CD1-O 3.28Å; I165-D169 HydrophobicContact CG2-CB 4.14Å; N166-D169 WeakPolarHBondContact CB-OD2 3.41Å; N166-D169 PolarHBondContact N-OD2 2.88Å; N166-D169 WeakPolarHBondContact O-CB 3.46Å; N166-D169 PolarHBondContact O-N 2.79Å; S167-D169 VanDerWaalsContact C-N 3.3Å; S167-D169 PolarHBondContact O-N 2.87Å; D169-S172 PolarHBondContact O-N 3.44Å; D169-A173 VanDerWaalsContact O-CB 3.27Å; D169-A173 WeakPolarHBondContact O-CB 3.09Å; D169-A173 PolarHBondContact O-N 3.47Å
170I95Very high90Very high81 Ų8191 Ų9142%0.41546%0.457SS..Hα-helixtrans-64.4-47174.4-61.1170.7000110.9I149 A153 I165 N166 S167 S172 A173 V174I149-I170 HydrophobicContact CG2-CG2 4.29Å; A153-I170 HydrophobicContact CB-CG1 4.23Å; I165-I170 HydrophobicContact CG2-CD1 4.31Å; I165-I170 HydrophobicContact CG2-CG1 3.85Å; N166-I170 PolarHBondContact O-N 3.28Å; S167-I170 PolarHBondContact O-N 3.41Å; I170-S172 VanDerWaalsContact C-N 3.33Å; I170-S172 PolarHBondContact O-N 3.11Å; I170-A173 PolarHBondContact O-N 3.41Å; I170-V174 HydrophobicContact CG2-CG2 4.49Å; I170-V174 VanDerWaalsContact O-CG2 3.3Å; I170-V174 WeakPolarHBondContact O-CG2 3.47Å; I170-V174 PolarHBondContact O-N 3.19Å
171Q93.8Very high88Confident88 Ų8889.9 Ų89.941%0.41146%0.455SS..Hα-helixtrans-57.6-48.8177.1-75.6172.32.300110.8S167 A173 V174 Y175S167-Q171 WeakPolarHBondContact O-CB 3.49Å; S167-Q171 VanDerWaalsContact O-CG 3.28Å; S167-Q171 WeakPolarHBondContact O-CG 3.2Å; S167-Q171 PolarHBondContact O-N 3.19Å; Q171-A173 PolarHBondContact O-N 2.84Å; Q171-V174 PolarHBondContact O-N 2.86Å; Q171-Y175 HydrophobicContact CB-CE2 4.24Å; Q171-Y175 WeakPolarHBondContact O-CD2 3.45Å; Q171-Y175 PolarHBondContact O-N 2.96Å
172S92.6Very high85.7Confident44 Ų4482 Ų8231%0.30844%0.436SS..Hα-helixtrans-63.9-41.8-179.9-56.10000111.6R168 D169 I170 V174 Y175 L176R168-S172 VanDerWaalsContact O-CB 3.28Å; R168-S172 WeakPolarHBondContact O-CB 3.49Å; R168-S172 PolarHBondContact O-N 3.1Å; R168-S172 PolarHBondContact O-OG 3.02Å; D169-S172 PolarHBondContact O-N 3.44Å; I170-S172 VanDerWaalsContact C-N 3.33Å; I170-S172 PolarHBondContact O-N 3.11Å; S172-V174 VanDerWaalsContact C-N 3.34Å; S172-V174 PolarHBondContact O-N 3.33Å; S172-Y175 PolarHBondContact O-N 2.99Å; S172-L176 WeakPolarHBondContact O-CG 3.38Å; S172-L176 PolarHBondContact O-N 3.29Å
173A94.3Very high83.5Confident0 Ų083 Ų830%045%0.446CS..Hα-helixtrans-59.6-43.117400000112.3I149 E152 A153 L156 D169 I170 Q171 L176 L177I149-A173 HydrophobicContact CG2-CB 4.29Å; E152-A173 HydrophobicContact CB-CB 3.79Å; A153-A173 HydrophobicContact CB-CB 3.95Å; L156-A173 HydrophobicContact CD1-CB 4.17Å; D169-A173 VanDerWaalsContact O-CB 3.27Å; D169-A173 WeakPolarHBondContact O-CB 3.09Å; D169-A173 PolarHBondContact O-N 3.47Å; I170-A173 PolarHBondContact O-N 3.41Å; Q171-A173 PolarHBondContact O-N 2.84Å; A173-L176 PolarHBondContact O-N 3.19Å; A173-L177 WeakPolarHBondContact O-CB 3.46Å; A173-L177 WeakPolarHBondContact O-CG 3.39Å; A173-L177 PolarHBondContact O-N 3.2Å
174V94.1Very high81.3Confident45 Ų4585 Ų8527%0.27344%0.439SS..Hα-helixtrans-61.6-43.6175.5170.70000111I149 I170 Q171 S172 L176 L177 L178I149-V174 HydrophobicContact CD1-CG2 3.96Å; I149-V174 HydrophobicContact CG1-CG2 4.18Å; I149-V174 HydrophobicContact CG2-CG2 4.01Å; I170-V174 HydrophobicContact CG2-CG2 4.49Å; I170-V174 VanDerWaalsContact O-CG2 3.3Å; I170-V174 WeakPolarHBondContact O-CG2 3.47Å; I170-V174 PolarHBondContact O-N 3.19Å; Q171-V174 PolarHBondContact O-N 2.86Å; S172-V174 VanDerWaalsContact C-N 3.34Å; S172-V174 PolarHBondContact O-N 3.33Å; V174-L176 VanDerWaalsContact C-N 3.33Å; V174-L176 PolarHBondContact O-N 3.42Å; V174-L177 PolarHBondContact O-N 3.15Å; V174-L178 HydrophobicContact CG1-CD1 4.3Å; V174-L178 WeakPolarHBondContact O-CB 3.4Å; V174-L178 PolarHBondContact O-N 2.97Å
175Y90.8Very high78.8Confident85 Ų8583.1 Ų83.133%0.33343%0.428SS..Hα-helixtrans-63.4-36.6176.7-73.1-61000113.5Q171 S172 Q185Q171-Y175 HydrophobicContact CB-CE2 4.24Å; Q171-Y175 WeakPolarHBondContact O-CD2 3.45Å; Q171-Y175 PolarHBondContact O-N 2.96Å; S172-Y175 PolarHBondContact O-N 2.99Å; Y175-Q185 VanDerWaalsContact CE1-CD 3.45Å; Y175-Q185 VanDerWaalsContact OH-CD 3.29Å; Y175-Q185 PolarHBondContact OH-NE2 3.24Å; Y175-Q185 PolarHBondContact OH-OE1 2.97Å
176L90.8Very high76.4Confident115 Ų11589.2 Ų89.260%0.60245%0.451SS*.Hα-helixtrans-70-37.5177.8-69.9171.6000112.2L156 S172 A173 V174L156-L176 HydrophobicContact CD1-CD1 4.36Å; S172-L176 WeakPolarHBondContact O-CG 3.38Å; S172-L176 PolarHBondContact O-N 3.29Å; A173-L176 PolarHBondContact O-N 3.19Å; V174-L176 VanDerWaalsContact C-N 3.33Å; V174-L176 PolarHBondContact O-N 3.42Å
177L90.6Very high74Confident56 Ų5690.5 Ų90.529%0.29346%0.462SS..Hα-helixtrans-86-28.7-175.6-68.9169.6000113.7R148 I149 E152 A173 V174 P179R148-L177 VanDerWaalsContact C-CD1 3.48Å; R148-L177 HydrophobicContact CB-CD1 3.91Å; R148-L177 HydrophobicContact CB-CD2 4.29Å; I149-L177 VanDerWaalsContact CA-CD1 3.47Å; I149-L177 HydrophobicContact CB-CD1 4.16Å; I149-L177 HydrophobicContact CG1-CD1 3.61Å; E152-L177 HydrophobicContact CB-CD1 4.31Å; E152-L177 HydrophobicContact CG-CD1 4.06Å; E152-L177 HydrophobicContact CG-CD2 4.03Å; E152-L177 HydrophobicContact CG-CG 4.13Å; A173-L177 WeakPolarHBondContact O-CB 3.46Å; A173-L177 WeakPolarHBondContact O-CG 3.39Å; A173-L177 PolarHBondContact O-N 3.2Å; V174-L177 PolarHBondContact O-N 3.15Å; L177-P179 VanDerWaalsContact C-CD 3.43Å; L177-P179 VanDerWaalsContact O-CD 3.26Å; L177-P179 WeakPolarHBondContact O-CD 3.46Å
178L85.3Confident71.6Confident82 Ų8291.7 Ų91.743%0.42947%0.468SS..  trans-118.674.5-178.5-63.8174.5000110.5V174 E180 A181V174-L178 HydrophobicContact CG1-CD1 4.3Å; V174-L178 WeakPolarHBondContact O-CB 3.4Å; V174-L178 PolarHBondContact O-N 2.97Å; L178-E180 PolarHBondContact O-N 3.24Å; L178-A181 PolarHBondContact O-N 2.93Å
179P67.3Low69.2Low83 Ų8392.4 Ų92.454%0.53948%0.476SS..G310 helixtrans-61.8-27.2-178.123.2-32.7000112.8L177 A181 S182L177-P179 VanDerWaalsContact C-CD 3.43Å; L177-P179 VanDerWaalsContact O-CD 3.26Å; L177-P179 WeakPolarHBondContact O-CD 3.46Å; P179-A181 PolarHBondContact O-N 2.99Å; P179-S182 WeakPolarHBondContact O-CB 3.45Å; P179-S182 PolarHBondContact O-N 3.41Å; P179-S182 PolarHBondContact O-OG 3.38Å
180E55.5Low66.8Low150 Ų15097.3 Ų97.370%0.70150%0.501SS*.G310 helixtrans-70.7-13.1-179.3-60.7-150.8162.500114.6L178 Q183L178-E180 PolarHBondContact O-N 3.24Å; E180-Q183 WeakPolarHBondContact O-CG 3.34Å
181A52.5Low64.2Low47 Ų47100.7 Ų100.739%0.38852%0.52SS..G310 helixtrans-81.8-21.4170.800000112.4L178 P179 Q183 F184 Q185L178-A181 PolarHBondContact O-N 2.93Å; P179-A181 PolarHBondContact O-N 2.99Å; A181-Q183 VanDerWaalsContact C-N 3.28Å; A181-Q183 PolarHBondContact O-N 2.98Å; A181-F184 CarbonylContact O-C 3.5Å; A181-F184 PolarHBondContact O-N 2.97Å; A181-F184 VanDerWaalsContact O-N 3.12Å; A181-Q185 PolarHBondContact O-N 3.28Å
182S46.7Very low61.4Low71 Ų71100.1 Ų100.150%0.49753%0.525SS..THydrogen-bonded Turntrans-72.1-20.9-178.971.70000113.5P179 Q185P179-S182 WeakPolarHBondContact O-CB 3.45Å; P179-S182 PolarHBondContact O-N 3.41Å; P179-S182 PolarHBondContact O-OG 3.38Å; S182-Q185 WeakPolarHBondContact O-CB 3.47Å; S182-Q185 PolarHBondContact O-N 3.42Å
183Q46Very low59Low138 Ų138109.5 Ų109.565%0.64555%0.554SS**THydrogen-bonded Turntrans-81-16.4171.150.7-17410.500113.5E180 A181E180-Q183 WeakPolarHBondContact O-CG 3.34Å; A181-Q183 VanDerWaalsContact C-N 3.28Å; A181-Q183 PolarHBondContact O-N 2.98Å
184F47.6Very low56.5Low163 Ų163114.3 Ų114.372%0.71559%0.587SS**SBendtrans-96.70.4168.9-76.2-81.9000112.9A181 K186 V187A181-F184 CarbonylContact O-C 3.5Å; A181-F184 PolarHBondContact O-N 2.97Å; A181-F184 VanDerWaalsContact O-N 3.12Å; F184-K186 PolarHBondContact O-N 3.2Å; F184-V187 WeakPolarHBondContact O-CG2 3.28Å; F184-V187 PolarHBondContact O-N 3.5Å
185Q43.5Very low54.2Low91 Ų91120.7 Ų120.743%0.42561%0.614SS.*THydrogen-bonded Turntrans-81.556.1177.4-166.4113.6-23.700112.7Y175 A181 S182Y175-Q185 VanDerWaalsContact CE1-CD 3.45Å; Y175-Q185 VanDerWaalsContact OH-CD 3.29Å; Y175-Q185 PolarHBondContact OH-NE2 3.24Å; Y175-Q185 PolarHBondContact OH-OE1 2.97Å; A181-Q185 PolarHBondContact O-N 3.28Å; S182-Q185 WeakPolarHBondContact O-CB 3.47Å; S182-Q185 PolarHBondContact O-N 3.42Å
186K45Very low51.9Low204 Ų204122.4 Ų122.489%0.88764%0.637SS**THydrogen-bonded Turntrans-119.621.4148.1-80.1-170.7-177.3172.20111.4F184 P188F184-K186 PolarHBondContact O-N 3.2Å; K186-P188 VanDerWaalsContact O-CD 3.27Å; K186-P188 WeakPolarHBondContact O-CD 3.5Å
187V42.7Very low49.8Very low111 Ų111123.3 Ų123.367%0.67364%0.642SS**SBendtrans-85.2107.7156.6-84.50000107.8F184 F189F184-V187 WeakPolarHBondContact O-CG2 3.28Å; F184-V187 PolarHBondContact O-N 3.5Å; V187-F189 PolarHBondContact O-N 2.76Å
188P42.9Very low47.6Very low96 Ų96125.2 Ų125.262%0.62366%0.659SS**  trans-60.8128.5178.326.3-33.4000108.4K186 I190K186-P188 VanDerWaalsContact O-CD 3.27Å; K186-P188 WeakPolarHBondContact O-CD 3.5Å; P188-I190 HydrophobicContact CB-CD1 4.5Å; P188-I190 HydrophobicContact CB-CG1 4.05Å; P188-I190 HydrophobicContact CG-CD1 3.93Å; P188-I190 HydrophobicContact CG-CG1 4.02Å; P188-I190 PolarHBondContact O-N 3.44Å
189F42Very low45.7Very low183 Ų183131 Ų13180%0.80368%0.676SS**  trans-67.673.9166.3-148.7-93.7000107.2V187 N191V187-F189 PolarHBondContact O-N 2.76Å; F189-N191 PolarHBondContact O-N 3.35Å; F189-N191 VanDerWaalsContact O-N 3.15Å
190I43.6Very low44.5Very low111 Ų111137.1 Ų137.157%0.56969%0.689SS**  trans-67.7113.7173.7-69.2164.6000105.5P188 C192P188-I190 HydrophobicContact CB-CD1 4.5Å; P188-I190 HydrophobicContact CB-CG1 4.05Å; P188-I190 HydrophobicContact CG-CD1 3.93Å; P188-I190 HydrophobicContact CG-CG1 4.02Å; P188-I190 PolarHBondContact O-N 3.44Å; I190-C192 HydrophobicContact CG2-CB 4.27Å; I190-C192 PolarHBondContact O-N 3.19Å
191N41.3Very low43.9Very low151 Ų151134.2 Ų134.281%0.80768%0.684SS**  trans-64.483.9168.3-148.2-13000107.3F189 R193F189-N191 PolarHBondContact O-N 3.35Å; F189-N191 VanDerWaalsContact O-N 3.15Å; N191-R193 PolarHBondContact O-N 3.03Å; N191-R193 VanDerWaalsContact O-N 3.14Å
192C34.1Very low43.6Very low77 Ų77141.2 Ų141.252%0.5270%0.702SS.*  trans-86.384.3-175.4-148.80000108I190 S194I190-C192 HydrophobicContact CG2-CB 4.27Å; I190-C192 PolarHBondContact O-N 3.19Å; C192-S194 PolarHBondContact O-N 2.97Å; C192-S194 PolarHBondContact SG-O 3.07Å; C192-S194 VanDerWaalsContact SG-O 3.39Å
193R42.9Very low43.5Very low241 Ų241142 Ų14291%0.90970%0.704SS**SBendtrans-77.78.4170.3-152.6171.1-170.9-170.81.3112.6N191N191-R193 PolarHBondContact O-N 3.03Å; N191-R193 VanDerWaalsContact O-N 3.14Å
194S40.8Very low43.3Very low100 Ų100142.7 Ų142.770%0.69971%0.707SS**SBendtrans-147.289.1174.9-49.10000109.3C192 C196C192-S194 PolarHBondContact O-N 2.97Å; C192-S194 PolarHBondContact SG-O 3.07Å; C192-S194 VanDerWaalsContact SG-O 3.39Å; S194-C196 PolarHBondContact O-N 3.04Å
195Q47.2Very low42.9Very low179 Ų179142.4 Ų142.484%0.83671%0.708SS**  trans-50.3122.7159.8-72.4160.7-12.400107.9
196C41.7Very low42.9Very low122 Ų122141.9 Ų141.982%0.82472%0.719SS**SBendtrans173.7-14.4142.7-93.50000115.6S194S194-C196 PolarHBondContact O-N 3.04Å
197L47.3Very low43Very low134 Ų134137.7 Ų137.770%0.70271%0.71SS**SBendtrans-122.7-5.4-168.7-75.5166.8000118.4C201L197-C201 PolarHBondContact O-N 3Å
198C43.7Very low43.2Very low96 Ų96137.2 Ų137.265%0.64971%0.712SS**Hα-helixtrans-81.4-19.8-175.9-84.90000115.8
199Y46Very low42.9Very low202 Ų202138 Ų13879%0.79272%0.719SS**Hα-helixtrans-85.2-21.6178.8-151.7-100.8000113.4
200W42Very low43.2Very low212 Ų212135.2 Ų135.280%0.80372%0.716SS**Hα-helixtrans-83.6-27.2171.5-108.624000113.2Y202 V203W200-Y202 VanDerWaalsContact C-N 3.27Å; W200-Y202 PolarHBondContact O-N 3.25Å; W200-V203 PolarHBondContact O-N 3.36Å
201C42.2Very low43.1Very low89 Ų89137.1 Ų137.160%0.60173%0.728SS**Hα-helixtrans-66.2-28.6173.3-122.50000112.8L197L197-C201 PolarHBondContact O-N 3Å
202Y45.6Very low43.3Very low194 Ų194137.4 Ų137.476%0.76173%0.728SS**Hα-helixtrans-78-17.4-179-156.1-100.3000114.1W200W200-Y202 VanDerWaalsContact C-N 3.27Å; W200-Y202 PolarHBondContact O-N 3.25Å
203V46.4Very low43.5Very low89 Ų89143.5 Ų143.554%0.53975%0.746SS.*Hα-helixtrans-101.3-17.2-177.7-1780000112.6W200W200-V203 PolarHBondContact O-N 3.36Å
204Q40.8Very low43.3Very low152 Ų152142 Ų14271%0.7175%0.747SS**Hα-helixtrans-82.8-21.7178.1-152.883.9-4.300113.3A206Q204-A206 PolarHBondContact O-N 3.29Å
205E40.1Very low43.2Very low157 Ų157140.4 Ų140.473%0.73475%0.746SS**THydrogen-bonded Turntrans-77.7-5.3178.2-115.4160.1-175.500113.7
206A43.1Very low43.1Very low79 Ų79137.2 Ų137.265%0.65375%0.75SS**THydrogen-bonded Turntrans-89.8-6.5177.700000114.8Q204Q204-A206 PolarHBondContact O-N 3.29Å
207V46.8Very low43.2Very low117 Ų117134.9 Ų134.971%0.70974%0.739SS**SBendtrans-97.4-6.8-178.9-170.20000113.4
208S46Very low42.9Very low101 Ų101139.2 Ų139.271%0.70675%0.748SS**SBendtrans-99.54.9177-77.80000115.6
209C37.6Very low42.8Very low113 Ų113142 Ų14276%0.76476%0.756SS**SBendtrans-103.813.6-172.6-79.40000116.5
210T47.7Very low42.5Very low123 Ų123139.8 Ų139.876%0.75576%0.757SS**SBendtrans-111.3-1.6172.349.90000115.6
211N41.9Very low42.3Very low152 Ų152143.3 Ų143.381%0.81378%0.778SS**SBendtrans-122.413.1-179.4-75.3-50.7000116.2
212L45.6Very low42.3Very low156 Ų156146 Ų14682%0.81779%0.787SS**SBendtrans-112.730.5175.3-154.368.3000113.6
213F37.1Very low42.1Very low205 Ų205143.5 Ų143.590%0.89979%0.788SS**  trans-139.944.8171.4-108.6-86.8000112.7
214K40.5Very low41.9Very low211 Ų211146.5 Ų146.592%0.91780%0.802SS**SBendtrans-124.779.5148.6-78.1179.3178.8173.50105.2
215G37.4Very low42Very low66 Ų66146.2 Ų146.268%0.6881%0.807SS**  88.667.668.600000107.8A217G215-A217 VanDerWaalsContact C-N 3.31Å; G215-A217 PolarHBondContact O-N 3.03Å; G215-A217 VanDerWaalsContact O-N 3.11Å
216A45Very low42.1Very low112 Ų112145.5 Ų145.593%0.92681%0.812SS**  trans-67.595.2157.900000107.3
217A43.6Very low42Very low72 Ų72149.9 Ų149.960%0.59582%0.823SS**  trans-157.5142.4163.100000106.9G215G215-A217 VanDerWaalsContact C-N 3.31Å; G215-A217 PolarHBondContact O-N 3.03Å; G215-A217 VanDerWaalsContact O-N 3.11Å
218Y41.1Very low41.7Very low226 Ų226152.3 Ų152.389%0.88683%0.831SS**  trans77.988.3-165.2-46-72.8000112
219L42.3Very low41.3Very low154 Ų154156.2 Ų156.281%0.80684%0.84SS**  cis48.7106.934.1-90.9174000114.5
220L39.5Very low41.6Very low156 Ų156159.8 Ų159.882%0.81785%0.847SS**  trans64.582.2155.5-64.3164.5000117.5
221F38Very low41.1Very low285 Ų285163.2 Ų163.2100%1.2586%0.855SS**  -178.50114.7-116.9-90.4000109.8

Retrieved 221 of 221 residues in 75.3 ms (Link to these results)