A0A096N743_PAPAN Loading...

Cysteine rich hydrophobic domain 1

AlphaFold DB , UniProt , Accession A0A096N743, Species PAPAN (Papio anubis, Olive baboon), Gene CHIC1, Length 225 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
1M39.5Very low40.5Very low238 Ų238157.2 Ų157.2100%1.17284%0.842SS**  093.30-69.2176.2-177.600106.3
2S37.2Very low39.9Very low122 Ų122156.7 Ų156.785%0.85384%0.84SS**  trans-105.4112.6179.9-55.60000106.5L4S2-L4 PolarHBondContact O-N 3.44Å
3I39.6Very low40.1Very low161 Ų161152 Ų15283%0.82682%0.82SS**  trans-83.1115.7-174.2-44.9171000106.6
4L41.3Very low40.3Very low162 Ų162152.3 Ų152.385%0.84882%0.819SS**PPolyproline II helixtrans-66.9126.6166.6-86.6138000108.6S2S2-L4 PolarHBondContact O-N 3.44Å
5L42.3Very low40.1Very low164 Ų164150.5 Ų150.586%0.85982%0.823SS**PPolyproline II helixtrans-102.9125160.5-82.4168.2000108.7
6P44.3Very low40.2Very low115 Ų115151.6 Ų151.675%0.74782%0.821SS**PPolyproline II helixtrans-72.5150.5176.9-15.830000113.6
7N38.4Very low40.1Very low153 Ų153151.6 Ų151.682%0.81882%0.819SS**PPolyproline II helixtrans-59.5126.6166.8-160.111.1000110.4
8M41.1Very low40.1Very low191 Ų191153.3 Ų153.394%0.94182%0.821SS**  trans-112.485.8168.2-101.6-172.9111.100108.2
9A45.7Very low40.1Very low76 Ų76155.5 Ų155.563%0.62883%0.826SS**  trans-107.2140.2150.400000106.6
10E42.6Very low40Very low184 Ų184157.1 Ų157.186%0.8683%0.828SS**  trans101.7128.9166.8-60.9-176.9154.600118.8
11F33Very low39.9Very low163 Ų163158.2 Ų158.272%0.71583%0.829SS**  trans83.8105157.3-110.6-102.3000118.7
12D33.8Very low39.9Very low151 Ų151156.6 Ų156.681%0.80782%0.818SS**  -164.3106.9100.2-93.2-35.3000111.2
13T42.3Very low40Very low96 Ų96158.9 Ų158.959%0.58982%0.816SS**  trans-73151.5149.841.20000109.2
14I42.9Very low39.7Very low156 Ų156155.3 Ų155.380%0.881%0.81SS**  trans101.4101.5167.8-51.8156.2000113.7
15S38Very low39.5Very low126 Ų126152 Ų15288%0.88181%0.806SS**  trans-159.192.5134.4-96.60000108.1
16E40.5Very low39Very low168 Ų168150.4 Ų150.479%0.78580%0.803SS**  trans-73.8151.2160.3-95.7-176.7136.700110.6
17L38.8Very low38.7Very low151 Ų151150.1 Ų150.179%0.79180%0.804SS**  trans83.8148.1147.7-69.8161.9000121.2
18E39.6Very low38.7Very low182 Ų182147.8 Ų147.885%0.8580%0.799SS**  trans83116.6173.5-55.5176.7159.400112.4
19E40.2Very low38.4Very low196 Ų196144.1 Ų144.192%0.91679%0.793SS**  -150.4129.863.8-75.4164.216200112.8
20E38.1Very low38Very low187 Ų187146 Ų14687%0.87480%0.802SS**  trans-95.7159.4156.2-86.6-175.4144.300110
21E38.4Very low39Very low181 Ų181143 Ų14385%0.84680%0.798SS**  trans74.5113.7164.3-77.3-171.713600120.5
22E39.8Very low39.1Very low204 Ų204140.8 Ų140.895%0.95380%0.803SS**  -150.2131.6121.2-125.9-176.6-175.500112.5
23E38.7Very low39.3Very low170 Ų170139 Ų13979%0.79480%0.802SS**  trans-93.9159.1-175.4-91.7-114.6170.700113.6
24A34.3Very low39.1Very low85 Ų85139.5 Ų139.570%0.70281%0.81SS**  trans86122.2141.900000123.5
25A36Very low39Very low93 Ų93137.2 Ų137.277%0.76981%0.807SS**  trans67.4130.4143.300000118.5
26T32.2Very low39Very low130 Ų130136.4 Ų136.480%0.79880%0.802SS**  -155.6149.864.561.70000114.9
27S38.8Very low39Very low109 Ų109135.2 Ų135.276%0.76281%0.805SS**  trans-34.4160.3157.252.10000115.4
28S37.8Very low39Very low104 Ų104133.4 Ų133.473%0.72781%0.806SS**  cis-170.6147.221.940.10000105.8
29S35Very low38.8Very low115 Ų115128.4 Ų128.480%0.80480%0.803SS**  156142.291.947.10000108.9
30S36.7Very low39.5Very low116 Ų116123.8 Ų123.881%0.81179%0.79SS**  trans-117.9-178.5166.4-48.20000108.3
31P64.6Low39.7Very low119 Ų119120.8 Ų120.877%0.77378%0.78SS**  cis-134.1173.9-17.823.40.2000113.1
32S33.8Very low40.2Very low118 Ų118118.2 Ų118.283%0.82577%0.772SS**  trans-165.2111137.213.50000113.3
33S39.8Very low40.7Very low113 Ų113114.9 Ų114.979%0.7976%0.76SS**  trans-5.4134.5148.953.70000120.6
34S38.1Very low41Very low107 Ų107113.3 Ų113.375%0.74875%0.753SS**  -173.1116104.558.40000113.4
35S40.3Very low41.5Very low107 Ų107115.8 Ų115.875%0.74875%0.75SS**  trans33.1125.4141.759.80000120.7
36S37.3Very low42.2Very low110 Ų110115.9 Ų115.977%0.76974%0.738SS**  -172.5123.7104.2-74.10000112.6
37V41.2Very low43.2Very low142 Ų142116.4 Ų116.486%0.86173%0.731SS**  trans57.7103.2151.2-178.20000118.3
38S39Very low43.8Very low114 Ų114117.4 Ų117.480%0.79772%0.724SS**  trans-62.6135.2158-390000112.1
39G34.8Very low44.5Very low77 Ų77117.3 Ų117.379%0.79471%0.712SS**  trans-130112.4144.100000106.7
40P54.3Low45.5Very low99 Ų99118 Ų11864%0.64370%0.703SS**  trans-94.3144.1160.243.2-33.6000105.4
41D42.6Very low46.6Very low124 Ų124114 Ų11466%0.66368%0.68SS**  cis-173.7102.348.8-65.8-77.6000104.2
42D49.1Very low46.4Very low127 Ų127114.8 Ų114.868%0.67967%0.673SS**SBendtrans-140.1-24171.8-87.4-49.5000110.8
43D49.5Very low47.4Very low133 Ų133111.9 Ų111.971%0.71165%0.646SS**Hα-helixtrans-77.2-24178.8-66.6-58.6000113.4E47D43-E47 PolarHBondContact O-N 3.13Å
44E45.7Very low48.2Very low137 Ų137112.1 Ų112.164%0.6464%0.635SS**Hα-helixtrans-82-25178.6-63.9-149.3-179.400113.1D46 E48E44-D46 VanDerWaalsContact C-N 3.34Å; E44-E48 WeakPolarHBondContact O-CG 3.39Å; E44-E48 PolarHBondContact O-N 3.26Å; E44-E48 VanDerWaalsContact O-N 3.09Å
45E45.9Very low49.4Very low137 Ų137113.6 Ų113.664%0.6463%0.63SS**Hα-helixtrans-69.4-33.9172-70.7-169.1176.400111.2E49E45-E49 WeakPolarHBondContact O-CB 3.19Å; E45-E49 PolarHBondContact O-N 3.07Å
46D49.4Very low50.4Low96 Ų96114.3 Ų114.351%0.51362%0.622SS.*Hα-helixtrans-70.8-37.7176.1-82.6-20.2000111.6E44 E50E44-D46 VanDerWaalsContact C-N 3.34Å; D46-E50 WeakPolarHBondContact O-CB 3.46Å; D46-E50 VanDerWaalsContact O-CG 3.27Å; D46-E50 WeakPolarHBondContact O-CG 3.34Å; D46-E50 PolarHBondContact O-N 2.96Å
47E52.4Low51.2Low140 Ų140111 Ų11165%0.65459%0.594SS**Hα-helixtrans-72-34.5176.5-71.4-171-179.700112.8D43 G51D43-E47 PolarHBondContact O-N 3.13Å; E47-G51 PolarHBondContact O-N 2.96Å; E47-G51 VanDerWaalsContact O-N 3.08Å
48E52Low52.3Low131 Ų131110.8 Ų110.861%0.61258%0.584SS**Hα-helixtrans-70-39.9173.2-72.7-172.8176.300111.8E44 E50 G51 E52E44-E48 WeakPolarHBondContact O-CG 3.39Å; E44-E48 PolarHBondContact O-N 3.26Å; E44-E48 VanDerWaalsContact O-N 3.09Å; E48-E50 VanDerWaalsContact C-N 3.33Å; E48-G51 PolarHBondContact O-N 3.29Å; E48-E52 WeakPolarHBondContact O-CG 3.2Å; E48-E52 PolarHBondContact O-N 2.99Å
49E53.4Low53.4Low101 Ų101111.7 Ų111.747%0.47258%0.576SS.*Hα-helixtrans-65.7-35.3173.8-161.8-177.9-171.100111.2E45 E53E45-E49 WeakPolarHBondContact O-CB 3.19Å; E45-E49 PolarHBondContact O-N 3.07Å; E49-E53 WeakPolarHBondContact O-CB 3.33Å; E49-E53 WeakPolarHBondContact O-CG 3.35Å; E49-E53 PolarHBondContact O-N 3.25Å
50E54.6Low54.6Low130 Ų130113 Ų11361%0.60756%0.561SS**Hα-helixtrans-66.2-40.5174.1-78.6-175.3179.100112.6D46 E48 E53 E54D46-E50 WeakPolarHBondContact O-CB 3.46Å; D46-E50 VanDerWaalsContact O-CG 3.27Å; D46-E50 WeakPolarHBondContact O-CG 3.34Å; D46-E50 PolarHBondContact O-N 2.96Å; E48-E50 VanDerWaalsContact C-N 3.33Å; E50-E53 PolarHBondContact O-N 3.43Å; E50-E54 WeakPolarHBondContact O-CG 3.5Å; E50-E54 PolarHBondContact O-N 3.21Å; E50-E54 VanDerWaalsContact O-N 3.09Å
51G60.4Low54.8Low33 Ų33114 Ų11434%0.3456%0.557SS.*Hα-helixtrans-68-40.8176.600000113.5E47 E48 E53 E54 E55E47-G51 PolarHBondContact O-N 2.96Å; E47-G51 VanDerWaalsContact O-N 3.08Å; E48-G51 PolarHBondContact O-N 3.29Å; G51-E53 VanDerWaalsContact C-N 3.35Å; G51-E54 PolarHBondContact O-N 3.02Å; G51-E55 PolarHBondContact O-N 3.11Å; G51-E55 VanDerWaalsContact O-N 3.14Å
52E61.3Low55.5Low134 Ų134114.4 Ų114.463%0.62656%0.555SS**Hα-helixtrans-66.1-36.1174.2-70.3-174.517400111.8E48 E56E48-E52 WeakPolarHBondContact O-CG 3.2Å; E48-E52 PolarHBondContact O-N 2.99Å; E52-E56 WeakPolarHBondContact O-CG 3.46Å; E52-E56 PolarHBondContact O-N 3.32Å; E52-E56 VanDerWaalsContact O-N 3.08Å
53E54.2Low55.9Low57 Ų57115.1 Ų115.127%0.26655%0.554SS.*Hα-helixtrans-67.3-32.2173.6-79.4-156.3-153.600112.9E49 E50 G51 E57 R173E49-E53 WeakPolarHBondContact O-CB 3.33Å; E49-E53 WeakPolarHBondContact O-CG 3.35Å; E49-E53 PolarHBondContact O-N 3.25Å; E50-E53 PolarHBondContact O-N 3.43Å; G51-E53 VanDerWaalsContact C-N 3.35Å; E53-E57 WeakPolarHBondContact O-CB 3.41Å; E53-E57 WeakPolarHBondContact O-CG 3.11Å; E53-E57 PolarHBondContact O-N 3.4Å; E53-E57 VanDerWaalsContact O-N 3.15Å; E53-R173 IonicContact OE2-CZ 3.74Å; E53-R173 IonicContact OE2-NH1 2.93Å; E53-R173 PolarHBondContact OE2-NH1 3.47Å; E53-R173 IonicContact OE2-NH2 3.25Å; E53-R173 PolarHBondContact OE2-NH2 3.07Å
54E57Low56.1Low119 Ų119116 Ų11656%0.55655%0.554SS**Hα-helixtrans-71.4-41.8175.7-74.8-173.4173.100112E50 G51 E57 E58E50-E54 WeakPolarHBondContact O-CG 3.5Å; E50-E54 PolarHBondContact O-N 3.21Å; E50-E54 VanDerWaalsContact O-N 3.09Å; G51-E54 PolarHBondContact O-N 3.02Å; E54-E57 WeakPolarHBondContact O-CB 3.26Å; E54-E57 PolarHBondContact O-N 3.21Å; E54-E58 PolarHBondContact O-N 3.2Å
55E62.4Low56.5Low138 Ų138116.6 Ų116.665%0.64556%0.557SS**Hα-helixtrans-65.7-43175.7-69.2-171.8174.100111.9G51 E57 E58 E59G51-E55 PolarHBondContact O-N 3.11Å; G51-E55 VanDerWaalsContact O-N 3.14Å; E55-E57 PolarHBondContact O-N 2.8Å; E55-E58 PolarHBondContact O-N 3.11Å; E55-E59 WeakPolarHBondContact O-CG 3.4Å; E55-E59 PolarHBondContact O-N 2.87Å; E55-E59 VanDerWaalsContact O-N 3.09Å
56E62.6Low56.7Low121 Ų121117.5 Ų117.557%0.56556%0.561SS**Hα-helixtrans-63-29173.2-74.8-167.2170.100112.2E52 E60E52-E56 WeakPolarHBondContact O-CG 3.46Å; E52-E56 PolarHBondContact O-N 3.32Å; E52-E56 VanDerWaalsContact O-N 3.08Å; E56-E60 WeakPolarHBondContact O-CB 3.39Å; E56-E60 WeakPolarHBondContact O-CG 3.31Å; E56-E60 PolarHBondContact O-N 3.33Å
57E53.4Low56.9Low41 Ų41121 Ų12119%0.19257%0.574CS.*Hα-helixtrans-74.4-40.2177.3-82.9-177.6169.500113.3E53 E54 E55 E61 K169 R173E53-E57 WeakPolarHBondContact O-CB 3.41Å; E53-E57 WeakPolarHBondContact O-CG 3.11Å; E53-E57 PolarHBondContact O-N 3.4Å; E53-E57 VanDerWaalsContact O-N 3.15Å; E54-E57 WeakPolarHBondContact O-CB 3.26Å; E54-E57 PolarHBondContact O-N 3.21Å; E55-E57 PolarHBondContact O-N 2.8Å; E57-E61 WeakPolarHBondContact O-CB 3.39Å; E57-E61 WeakPolarHBondContact O-CG 3.33Å; E57-E61 PolarHBondContact O-N 2.73Å; E57-K169 WeakPolarHBondContact OE1-CD 3.48Å; E57-K169 WeakPolarHBondContact OE1-CE 3.42Å; E57-K169 IonicContact OE1-NZ 2.73Å; E57-K169 PolarHBondContact OE1-NZ 2.88Å; E57-K169 IonicContact OE2-NZ 3.69Å; E57-K169 PolarHBondContact OE2-NZ 3.28Å; E57-R173 IonicContact OE1-CZ 3.99Å; E57-R173 IonicContact OE1-NE 3.42Å; E57-R173 IonicContact OE1-NH2 3.68Å; E57-R173 PolarHBondContact OE1-NH2 3.13Å
58E63.5Low56.9Low138 Ų138122.8 Ų122.865%0.64558%0.583SS**Hα-helixtrans-66.1-40.8174.1-69.4-169.5168.300110.6E54 E55 E61 E62E54-E58 PolarHBondContact O-N 3.2Å; E55-E58 PolarHBondContact O-N 3.11Å; E58-E61 PolarHBondContact O-N 2.97Å; E58-E62 WeakPolarHBondContact O-CB 3.37Å; E58-E62 WeakPolarHBondContact O-CG 3.3Å; E58-E62 PolarHBondContact O-N 3.3Å
59E62.8Low56.7Low133 Ų133124.8 Ų124.862%0.62159%0.592SS**Hα-helixtrans-65.5-41.8175.2-70.2-169.9170.300112.6E55 E63E55-E59 WeakPolarHBondContact O-CG 3.4Å; E55-E59 PolarHBondContact O-N 2.87Å; E55-E59 VanDerWaalsContact O-N 3.09Å; E59-E63 WeakPolarHBondContact O-CB 3.09Å; E59-E63 WeakPolarHBondContact O-CG 3.43Å; E59-E63 PolarHBondContact O-N 3.09Å
60E59.9Low56.8Low105 Ų105123.5 Ų123.549%0.49160%0.598SS.*Hα-helixtrans-66.7-37.6176.1-80.6-169.5172.600112.4E56 E64E56-E60 WeakPolarHBondContact O-CB 3.39Å; E56-E60 WeakPolarHBondContact O-CG 3.31Å; E56-E60 PolarHBondContact O-N 3.33Å; E60-E64 PolarHBondContact O-N 3.49Å
61E58.3Low57.1Low120 Ų120122.8 Ų122.856%0.56161%0.605SS**Hα-helixtrans-71.4-39.3176.6-72.7-172-176.900111.7E57 E58 E64 E65E57-E61 WeakPolarHBondContact O-CB 3.39Å; E57-E61 WeakPolarHBondContact O-CG 3.33Å; E57-E61 PolarHBondContact O-N 2.73Å; E58-E61 PolarHBondContact O-N 2.97Å; E61-E64 PolarHBondContact O-N 2.91Å; E61-E65 WeakPolarHBondContact O-CG 3.47Å; E61-E65 PolarHBondContact O-N 3.13Å
62E57.8Low57.2Low131 Ų131126.9 Ų126.961%0.61263%0.626SS**Hα-helixtrans-65.7-39172.5-74.6-168.1169.800112.3E58 E65 E66E58-E62 WeakPolarHBondContact O-CB 3.37Å; E58-E62 WeakPolarHBondContact O-CG 3.3Å; E58-E62 PolarHBondContact O-N 3.3Å; E62-E65 PolarHBondContact O-N 3.08Å; E62-E66 WeakPolarHBondContact O-CB 3.19Å; E62-E66 PolarHBondContact O-N 3.19Å
63E57.3Low57.2Low143 Ų143126.1 Ų126.167%0.66863%0.632SS**Hα-helixtrans-66.4-38.6174.1-78.9-163.9165.100112.3E59 E65 E67E59-E63 WeakPolarHBondContact O-CB 3.09Å; E59-E63 WeakPolarHBondContact O-CG 3.43Å; E59-E63 PolarHBondContact O-N 3.09Å; E63-E65 VanDerWaalsContact C-N 3.34Å; E63-E67 WeakPolarHBondContact O-CB 3.42Å; E63-E67 PolarHBondContact O-N 3.03Å
64E53.6Low57Low151 Ų151129.2 Ų129.271%0.70666%0.658SS**Hα-helixtrans-65.8-34.7173.7-79.5-163.2167.200111.9E60 E61E60-E64 PolarHBondContact O-N 3.49Å; E61-E64 PolarHBondContact O-N 2.91Å
65E53.5Low57.3Low149 Ų149135.3 Ų135.370%0.69668%0.675SS**Hα-helixtrans-74.3-39.7174.7-72.4-164.7168.900112.7E61 E62 E63 E68E61-E65 WeakPolarHBondContact O-CG 3.47Å; E61-E65 PolarHBondContact O-N 3.13Å; E62-E65 PolarHBondContact O-N 3.08Å; E63-E65 VanDerWaalsContact C-N 3.34Å; E65-E68 WeakPolarHBondContact O-CB 3.36Å; E65-E68 PolarHBondContact O-N 2.78Å
66E50.5Low56.9Low156 Ų156135 Ų13573%0.72968%0.683SS**Hα-helixtrans-70.1-33176.4-84.9-155.8152.400112.9E62 E68 E69E62-E66 WeakPolarHBondContact O-CB 3.19Å; E62-E66 PolarHBondContact O-N 3.19Å; E66-E68 PolarHBondContact O-N 2.85Å; E66-E69 PolarHBondContact O-N 3Å
67E53.9Low56.4Low169 Ų169133.5 Ų133.579%0.7968%0.681SS**THydrogen-bonded Turntrans-63.9-21.3174.1-150.3-172.8-173.100111.5E63E63-E67 WeakPolarHBondContact O-CB 3.42Å; E63-E67 PolarHBondContact O-N 3.03Å
68E53.6Low56.3Low178 Ų178134.2 Ų134.283%0.83269%0.691SS**THydrogen-bonded Turntrans-77.4-18.6174.9-132.7-171.7176.500113.5E65 E66E65-E68 WeakPolarHBondContact O-CB 3.36Å; E65-E68 PolarHBondContact O-N 2.78Å; E66-E68 PolarHBondContact O-N 2.85Å
69E46.3Very low55.9Low174 Ų174133.1 Ų133.181%0.81369%0.686SS**SBendtrans-107.16.1-174.4-138.1-170.5170.100115.5E66 P71E66-E69 PolarHBondContact O-N 3Å; E69-P71 WeakPolarHBondContact O-CD 3.43Å
70A56.7Low55.4Low73 Ų73133.4 Ų133.460%0.60369%0.687SS**PPolyproline II helixtrans-68.3123.6177.700000112.1
71P60.9Low55.2Low115 Ų115132.7 Ų132.775%0.74768%0.684SS**PPolyproline II helixtrans-65.2140.3178.124.9-32.6000111E69E69-P71 WeakPolarHBondContact O-CD 3.43Å
72P61.3Low55Low119 Ų119128.1 Ų128.177%0.77366%0.663SS**PPolyproline II helixtrans-66.5136-17024.5-33.7000112
73P61.6Low54.8Low118 Ų118129.8 Ų129.877%0.76666%0.664SS**PPolyproline II helixtrans-62.7150.6175.524.3-32.3000111.5R75P73-R75 PolarHBondContact O-N 2.98Å; P73-R75 VanDerWaalsContact O-N 3.1Å
74P50.9Low54.8Low123 Ų123130.6 Ų130.680%0.79966%0.661SS**  trans-66.4115.6-170.626.6-34.3000112V76P74-V76 PolarHBondContact O-N 3.3Å
75R62.2Low55Low246 Ų246133 Ų13393%0.92867%0.665SS**  trans-0.299.9165.8-65.1-177.5176.7170.10.3117.3P73P73-R75 PolarHBondContact O-N 2.98Å; P73-R75 VanDerWaalsContact O-N 3.1Å
76V54.5Low55.7Low132 Ų132127.3 Ų127.380%0.864%0.643SS**SBendtrans-128.6107.9144.8-163.60000105.9P74P74-V76 PolarHBondContact O-N 3.3Å
77V51.7Low57.1Low89 Ų89123.5 Ų123.554%0.53963%0.632SS.*SBendtrans3492.6-179-166.30000114.2E79V77-E79 PolarHBondContact O-N 2.99Å
78S51.3Low58.6Low56 Ų56122.4 Ų122.439%0.39263%0.632SS.*  trans-42.5125.4-175.459.10000112.8E80 H81S78-E80 PolarHBondContact O-N 2.81Å; S78-H81 WeakPolarHBondContact O-CB 3.4Å; S78-H81 PolarHBondContact O-N 2.88Å; S78-H81 PolarHBondContact OG-ND1 2.84Å
79E55.3Low60.4Low116 Ų116116.8 Ų116.854%0.54261%0.61SS.*Hα-helixtrans-48.9-30.8177.7-160.3-175.3144.700112.8V77 H81 L82 R83V77-E79 PolarHBondContact O-N 2.99Å; E79-H81 VanDerWaalsContact C-N 3.29Å; E79-H81 PolarHBondContact O-N 3.41Å; E79-L82 WeakPolarHBondContact O-CB 3.32Å; E79-L82 PolarHBondContact O-N 3.09Å; E79-R83 PolarHBondContact O-N 3.32Å; E79-R83 IonicContact OE1-CZ 3.42Å; E79-R83 IonicContact OE1-NE 2.8Å; E79-R83 IonicContact OE1-NH2 3.21Å; E79-R83 PolarHBondContact OE1-NH2 2.79Å
80E52.9Low62.7Low138 Ų138109.1 Ų109.165%0.64558%0.576SS**Hα-helixtrans-58.8-30.8173.6-154.3-176.7-173.700114.5S78S78-E80 PolarHBondContact O-N 2.81Å
81H54.5Low64.5Low90 Ų90108.9 Ų108.942%0.41756%0.564SS.*Hα-helixtrans-75-28.5172.8-83.2114.1000112.1S78 E79 R84 Y85S78-H81 WeakPolarHBondContact O-CB 3.4Å; S78-H81 PolarHBondContact O-N 2.88Å; S78-H81 PolarHBondContact OG-ND1 2.84Å; E79-H81 VanDerWaalsContact C-N 3.29Å; E79-H81 PolarHBondContact O-N 3.41Å; H81-R84 PolarHBondContact CD2-NH1 2.92Å; H81-R84 PolarHBondContact CD2-NH2 3.25Å; H81-R84 PolarHBondContact NE2-NH1 2.81Å; H81-R84 PolarHBondContact NE2-NH2 2.9Å; H81-Y85 WeakPolarHBondContact O-CD2 3.41Å
82L54.3Low66.1Low25 Ų25103.6 Ų103.613%0.13153%0.53CS..Hα-helixtrans-78.7-37.9177.2-68.9171.3000111.6E79 R84 Y85 P217 Y219E79-L82 WeakPolarHBondContact O-CB 3.32Å; E79-L82 PolarHBondContact O-N 3.09Å; L82-R84 PolarHBondContact O-N 3.22Å; L82-Y85 PolarHBondContact O-N 3.03Å; L82-Y85 VanDerWaalsContact O-N 3.11Å; L82-P217 HydrophobicContact CB-CB 3.93Å; L82-P217 HydrophobicContact CB-CG 4.27Å; L82-Y219 HydrophobicContact CD1-CD1 4.14Å; L82-Y219 HydrophobicContact CD1-CE1 3.67Å
83R54.9Low67.7Low165 Ų165101.8 Ų101.862%0.62351%0.507SS*.Hα-helixtrans-61-31.1174.7-69.1-170.3-175.9-178.63.5112.8E79 Y85 A86E79-R83 PolarHBondContact O-N 3.32Å; E79-R83 IonicContact OE1-CZ 3.42Å; E79-R83 IonicContact OE1-NE 2.8Å; E79-R83 IonicContact OE1-NH2 3.21Å; E79-R83 PolarHBondContact OE1-NH2 2.79Å; R83-Y85 PolarHBondContact O-N 2.83Å; R83-A86 WeakPolarHBondContact O-CB 3.47Å; R83-A86 PolarHBondContact O-N 2.88Å; R83-A86 VanDerWaalsContact O-N 3.13Å
84R57.1Low69.2Low160 Ų16097.8 Ų97.860%0.60449%0.487SS*.THydrogen-bonded Turntrans-64.4-16.1174.5-92.1-175-94.7142-4.7115.2H81 L82H81-R84 PolarHBondContact CD2-NH1 2.92Å; H81-R84 PolarHBondContact CD2-NH2 3.25Å; H81-R84 PolarHBondContact NE2-NH1 2.81Å; H81-R84 PolarHBondContact NE2-NH2 2.9Å; L82-R84 PolarHBondContact O-N 3.22Å
85Y57.9Low71.2Confident202 Ų20294.4 Ų94.479%0.79247%0.47SS*.THydrogen-bonded Turntrans-105.5-2.1175.2-66.5-79.7000113.1H81 L82 R83H81-Y85 WeakPolarHBondContact O-CD2 3.41Å; L82-Y85 PolarHBondContact O-N 3.03Å; L82-Y85 VanDerWaalsContact O-N 3.11Å; R83-Y85 PolarHBondContact O-N 2.83Å
86A66.7Low72.5Confident30 Ų3084 Ų8425%0.24844%0.438CS..SBendtrans-73.1134.8175.900000109.4R83R83-A86 WeakPolarHBondContact O-CB 3.47Å; R83-A86 PolarHBondContact O-N 2.88Å; R83-A86 VanDerWaalsContact O-N 3.13Å
87P79.8Confident74.1Confident76 Ų7685.6 Ų85.649%0.49444%0.437SS..PPolyproline II helixtrans-56.9152.6172.5-19.928.5000111.7F215P87-F215 HydrophobicContact CB-CD2 3.71Å; P87-F215 HydrophobicContact CB-CE2 3.94Å; P87-F215 HydrophobicContact CB-CG 4.15Å; P87-F215 HydrophobicContact CG-CB 4.31Å; P87-F215 HydrophobicContact CG-CD1 4.39Å; P87-F215 HydrophobicContact CG-CD2 4.09Å; P87-F215 HydrophobicContact CG-CG 4Å
88D86.1Confident75.8Confident145 Ų14584 Ų8478%0.77543%0.425SS*.PPolyproline II helixtrans-54.7137.6175.2-70.2-28.3000110.8F215D88-F215 WeakPolarHBondContact O-CE2 3.32Å
89P91Very high77.6Confident60 Ų6085.4 Ų85.439%0.3943%0.432SS..PPolyproline II helixtrans-67.3146.7-17728.9-35.7000111.5L212 I213 E214P89-L212 HydrophobicContact CB-CD1 3.66Å; P89-L212 HydrophobicContact CB-CD2 4.13Å; P89-L212 HydrophobicContact CB-CG 3.75Å; P89-L212 HydrophobicContact CG-CD1 3.84Å; P89-L212 HydrophobicContact CG-CD2 4.28Å; P89-L212 HydrophobicContact CG-CG 4.26Å; P89-I213 CarbonylContact C-O 3.55Å; P89-I213 WeakPolarHBondContact CA-O 3.2Å; P89-E214 HydrophobicContact CB-CG 4.05Å
90V94.2Very high78.9Confident14 Ų1481 Ų819%0.08541%0.412CS..EExtended strand (participates in β ladder)trans-84.5129.6178-178.40000109.4P112 V114 L115 I213 F215V90-P112 HydrophobicContact CG1-CB 3.56Å; V90-P112 HydrophobicContact CG1-CG 3.87Å; V90-V114 HydrophobicContact CG2-CB 3.89Å; V90-V114 HydrophobicContact CG2-CG1 3.88Å; V90-L115 HydrophobicContact CG2-CD2 4.07Å; V90-L115 HydrophobicContact CG2-CG 4.34Å; V90-I213 HydrophobicContact CB-CB 4.18Å; V90-I213 PolarHBondContact N-O 2.9Å; V90-I213 PolarHBondContact O-N 3.18Å; V90-F215 HydrophobicContact CG2-CE2 4.06Å; V90-F215 HydrophobicContact CG2-CZ 4.17Å
91L94.4Very high80.4Confident67 Ų6779.1 Ų79.135%0.35140%0.402SS..EExtended strand (participates in β ladder)trans-99.3124.9179.9-158.680.8000110.8R93 V210 L212L91-R93 HydrophobicContact CD2-CG 3.81Å; L91-R93 HydrophobicContact CG-CG 4.32Å; L91-V210 HydrophobicContact CD1-CB 4.1Å; L91-V210 HydrophobicContact CD1-CG2 3.65Å; L91-V210 HydrophobicContact CG-CB 4.36Å; L91-V210 HydrophobicContact CG-CG2 4.42Å; L91-L212 HydrophobicContact CD1-CD1 3.7Å
92V96Very high82Confident5 Ų575.4 Ų75.43%0.0339%0.388CS..EExtended strand (participates in β ladder)trans-111.5110.1172-178.20000108.6F107 D108 P112 F124 I128 I211 I213V92-F107 HydrophobicContact CG1-CB 4.43Å; V92-D108 HydrophobicContact CG1-CB 4.47Å; V92-P112 HydrophobicContact CG2-CG 4.33Å; V92-F124 HydrophobicContact CG2-CE2 4.33Å; V92-F124 HydrophobicContact CG2-CZ 4.2Å; V92-I128 HydrophobicContact CG1-CD1 4.26Å; V92-I211 HydrophobicContact CB-CB 4.15Å; V92-I211 PolarHBondContact N-O 3.44Å; V92-I211 PolarHBondContact O-N 3.49Å; V92-I213 HydrophobicContact CG2-CD1 3.98Å
93R94.2Very high83.7Confident81 Ų8174.7 Ų74.731%0.30638%0.384SS..  trans-90.5164.7-175.6-72.4-167169.2130.717.7113.1L91 D108 E202 E208 V210L91-R93 HydrophobicContact CD2-CG 3.81Å; L91-R93 HydrophobicContact CG-CG 4.32Å; R93-D108 PolarHBondContact O-N 3.28Å; R93-E202 IonicContact CZ-OE1 3.39Å; R93-E202 IonicContact CZ-OE2 3.63Å; R93-E202 IonicContact NH1-OE1 3.91Å; R93-E202 IonicContact NH1-OE2 3.59Å; R93-E202 PolarHBondContact NH1-OE2 2.6Å; R93-E202 IonicContact NH2-OE1 3.85Å; R93-E202 PolarHBondContact NH2-OE1 3.48Å; R93-E202 IonicContact NH2-OE2 2.88Å; R93-E202 PolarHBondContact NH2-OE2 3.2Å; R93-E208 IonicContact NE-OE1 3.63Å; R93-E208 PolarHBondContact NE-OE1 3.42Å; R93-V210 HydrophobicContact CG-CG1 4.13Å
94G93Very high85.5Confident33 Ų3367.1 Ų67.134%0.3436%0.357SS..BIsolated β-bridgetrans-62.8133.7168.900000111.7K106G94-K106 CarbonylContact C-O 3.58Å; G94-K106 WeakPolarHBondContact CA-O 3.4Å
95A93.6Very high87.1Confident53 Ų5360.4 Ų60.444%0.43833%0.333SS..  trans-12018.3172.900000111.4K106 D108A95-K106 PolarHBondContact N-O 3.15Å; A95-D108 HydrophobicContact CB-CB 4.05Å
96G88.4Confident88.9Confident26 Ų2654.4 Ų54.427%0.26831%0.311SS..  trans-84.5163.1179.400000112.7S104 N105 K106G96-S104 WeakPolarHBondContact CA-OG 3.43Å; G96-S104 PolarHBondContact N-OG 3Å; G96-N105 WeakPolarHBondContact CA-OD1 3.35Å; G96-K106 PolarHBondContact N-O 3.07Å
97H88.1Confident90.3Very high166 Ų16653 Ų5377%0.76930%0.299SS*.SBendtrans-98.5-8.7174.560.6-80.8000112.6N105H97-N105 PolarHBondContact N-OD1 3.13Å
98I88.3Confident91.1Very high55 Ų5552.1 Ų52.128%0.28229%0.291SS..  trans-119.4130.1177-57.6169.8000107.3V100 N105I98-V100 HydrophobicContact CG2-CG2 4.12Å; I98-N105 HydrophobicContact CB-CB 4.23Å; I98-N105 PolarHBondContact O-N 2.91Å; I98-N105 PolarHBondContact O-OD1 3.27Å
99T88.1Confident91.6Very high87 Ų8748.1 Ų48.153%0.53427%0.271SS..EExtended strand (participates in β ladder)trans-127.9128.2174-59.50000108.6L103T99-L103 WeakPolarHBondContact CA-O 3.45Å
100V84.4Confident91.8Very high22 Ų2252.2 Ų52.213%0.13329%0.285CS..EExtended strand (participates in β ladder)trans-120.8117.4179-177.30000108I98 G102 L103 N168I98-V100 HydrophobicContact CG2-CG2 4.12Å; V100-G102 PolarHBondContact O-N 2.95Å; V100-G102 VanDerWaalsContact O-N 3.14Å; V100-L103 PolarHBondContact N-O 3.42Å; V100-L103 PolarHBondContact O-N 2.94Å; V100-N168 PolarHBondContact O-ND2 3.29Å
101F83.5Confident92Very high100 Ų10053.8 Ų53.844%0.43929%0.291SS..THydrogen-bonded Turntrans42.546.1-172.6-54.8-77.6000114.2L103 V164 I165 N168F101-L103 VanDerWaalsContact C-N 3.3Å; F101-L103 PolarHBondContact O-N 3.25Å; F101-V164 HydrophobicContact CE2-CB 4.05Å; F101-V164 HydrophobicContact CE2-CG1 3.7Å; F101-V164 WeakPolarHBondContact CE2-O 3.37Å; F101-V164 HydrophobicContact CZ-CB 4.38Å; F101-V164 HydrophobicContact CZ-CG1 4.28Å; F101-I165 HydrophobicContact CE1-CG1 4.09Å; F101-I165 HydrophobicContact CE2-CG1 3.94Å; F101-I165 HydrophobicContact CZ-CG1 3.63Å; F101-N168 WeakPolarHBondContact CB-ND2 3.38Å; F101-N168 HydrophobicContact CD2-CB 4.32Å
102G88.3Confident92Very high12 Ų1251.8 Ų51.812%0.12428%0.282CS..THydrogen-bonded Turntrans82.6-7.9179.400000115.5V100 M207 E208 Y209V100-G102 PolarHBondContact O-N 2.95Å; V100-G102 VanDerWaalsContact O-N 3.14Å; G102-M207 WeakPolarHBondContact CA-O 3.48Å; G102-E208 CarbonylContact O-C 3.52Å; G102-E208 WeakPolarHBondContact O-CA 3.27Å; G102-Y209 PolarHBondContact O-N 3.4Å
103L90.4Very high91.9Very high9 Ų956.1 Ų56.15%0.04731%0.312CS..EExtended strand (participates in β ladder)trans-89.3115.6174.4-172.564000110.3T99 V100 F101 F107 L135 N168 T171 I175 Y209T99-L103 WeakPolarHBondContact CA-O 3.45Å; V100-L103 PolarHBondContact N-O 3.42Å; V100-L103 PolarHBondContact O-N 2.94Å; F101-L103 VanDerWaalsContact C-N 3.3Å; F101-L103 PolarHBondContact O-N 3.25Å; L103-F107 HydrophobicContact CD1-CE2 4.47Å; L103-F107 HydrophobicContact CD1-CZ 4.16Å; L103-L135 HydrophobicContact CD1-CD2 4.36Å; L103-L135 HydrophobicContact CD2-CD2 3.88Å; L103-L135 HydrophobicContact CG-CD2 4.05Å; L103-N168 WeakPolarHBondContact CB-OD1 3.46Å; L103-N168 WeakPolarHBondContact CD2-OD1 3.35Å; L103-T171 HydrophobicContact CD2-CG2 3.91Å; L103-I175 HydrophobicContact CD2-CD1 4.32Å; L103-Y209 HydrophobicContact CB-CD2 4.02Å; L103-Y209 HydrophobicContact CD1-CD2 4.41Å; L103-Y209 HydrophobicContact CD1-CG 4.25Å
104S91.9Very high91.8Very high7 Ų756.6 Ų56.65%0.04932%0.324CS..EExtended strand (participates in β ladder)trans-73.2141.1174.3173.90000110.6G96 K106G96-S104 WeakPolarHBondContact CA-OG 3.43Å; G96-S104 PolarHBondContact N-OG 3Å; S104-K106 PolarHBondContact O-N 3.31Å; S104-K106 VanDerWaalsContact O-N 3.14Å; S104-K106 PolarHBondContact OG-N 3.13Å; S104-K106 PolarHBondContact OG-O 2.9Å
105N91.4Very high91.8Very high18 Ų1855 Ų5510%0.09631%0.308CS..SBendtrans-71.4-3.9177.375.2-20.3000115.1G96 H97 I98 L135 L139G96-N105 WeakPolarHBondContact CA-OD1 3.35Å; H97-N105 PolarHBondContact N-OD1 3.13Å; I98-N105 HydrophobicContact CB-CB 4.23Å; I98-N105 PolarHBondContact O-N 2.91Å; I98-N105 PolarHBondContact O-OD1 3.27Å; N105-L135 WeakPolarHBondContact O-CB 3.3Å; N105-L139 HydrophobicContact CB-CD1 3.89Å; N105-L139 HydrophobicContact CB-CD2 3.31Å; N105-L139 HydrophobicContact CB-CG 3.91Å
106K95.1Very high91.8Very high76 Ų7657.1 Ų57.133%0.3332%0.315SS..SBendtrans-154.4136.7174.9179.5178.4-179.5-62.80109.6G94 A95 G96 S104 N132G94-K106 CarbonylContact C-O 3.58Å; G94-K106 WeakPolarHBondContact CA-O 3.4Å; A95-K106 PolarHBondContact N-O 3.15Å; G96-K106 PolarHBondContact N-O 3.07Å; S104-K106 PolarHBondContact O-N 3.31Å; S104-K106 VanDerWaalsContact O-N 3.14Å; S104-K106 PolarHBondContact OG-N 3.13Å; S104-K106 PolarHBondContact OG-O 2.9Å; K106-N132 WeakPolarHBondContact CA-OD1 3.1Å
107F96.6Very high92Very high0 Ų059.7 Ų59.70%034%0.342CS..BIsolated β-bridgetrans-90.9155165.8-71.8-73.8000111.7V92 L103 T109 I128 V131 N132 L135 L196 Y209 I211V92-F107 HydrophobicContact CG1-CB 4.43Å; L103-F107 HydrophobicContact CD1-CE2 4.47Å; L103-F107 HydrophobicContact CD1-CZ 4.16Å; F107-T109 PolarHBondContact O-N 3.24Å; F107-I128 HydrophobicContact CB-CD1 3.8Å; F107-I128 HydrophobicContact CB-CG1 4.22Å; F107-I128 HydrophobicContact CG-CD1 4.44Å; F107-V131 HydrophobicContact CD2-CG1 3.8Å; F107-V131 HydrophobicContact CE2-CG1 4.06Å; F107-N132 PolarHBondContact N-OD1 2.93Å; F107-N132 PolarHBondContact O-ND2 2.75Å; F107-L135 HydrophobicContact CD2-CD1 3.58Å; F107-L135 HydrophobicContact CE2-CD1 3.71Å; F107-L196 HydrophobicContact CZ-CD1 3.93Å; F107-Y209 WeakPolarHBondContact CE1-O 3.41Å; F107-I211 HydrophobicContact CB-CD1 4.46Å; F107-I211 HydrophobicContact CD1-CD1 4.13Å; F107-I211 HydrophobicContact CD1-CG1 4.31Å; F107-I211 HydrophobicContact CD2-CD1 3.68Å; F107-I211 HydrophobicContact CD2-CG1 4.42Å; F107-I211 HydrophobicContact CE1-CD1 4.33Å; F107-I211 HydrophobicContact CE1-CG1 4.12Å; F107-I211 HydrophobicContact CE2-CD1 3.86Å; F107-I211 HydrophobicContact CE2-CG1 4.2Å; F107-I211 HydrophobicContact CG-CD1 3.82Å; F107-I211 HydrophobicContact CG-CG1 4.47Å; F107-I211 HydrophobicContact CZ-CD1 4.2Å; F107-I211 HydrophobicContact CZ-CG1 4.06Å
108D96.3Very high92.3Very high59 Ų5957.4 Ų57.432%0.31633%0.33SS..  trans-59.8138.2174-161.2-4000110.8V92 R93 A95 E110 I128V92-D108 HydrophobicContact CG1-CB 4.47Å; R93-D108 PolarHBondContact O-N 3.28Å; A95-D108 HydrophobicContact CB-CB 4.05Å; D108-E110 PolarHBondContact OD1-N 3.37Å; D108-I128 WeakPolarHBondContact O-CG1 3.4Å
109T95.9Very high92.7Very high61 Ų6155.2 Ų55.237%0.37432%0.319SS..  trans-107.3-4-179.950.50000111.8F107 I128 N132F107-T109 PolarHBondContact O-N 3.24Å; T109-I128 HydrophobicContact CG2-CG2 4.17Å; T109-N132 WeakPolarHBondContact CG2-ND2 3.4Å
110E96.8Very high93Very high146 Ų14653.5 Ų53.568%0.68231%0.314SS*.SBendtrans-61.2134.5171.6-171.5170.4-179.900110.3D108 P112 F124D108-E110 PolarHBondContact OD1-N 3.37Å; E110-P112 WeakPolarHBondContact O-CD 3.41Å; E110-F124 WeakPolarHBondContact O-CE1 3.49Å
111F96.4Very high93.6Very high47 Ų4755.6 Ų55.621%0.20633%0.328CS..PPolyproline II helixtrans-76122.4-178.1-179.9-100000110.4S113 L115 V119 P121 F124F111-S113 PolarHBondContact O-N 2.77Å; F111-L115 HydrophobicContact CE1-CB 4.36Å; F111-L115 HydrophobicContact CE2-CB 4.19Å; F111-L115 HydrophobicContact CZ-CB 3.73Å; F111-V119 HydrophobicContact CE2-CG1 4.09Å; F111-V119 HydrophobicContact CZ-CG1 4.36Å; F111-P121 HydrophobicContact CD1-CG 4.27Å; F111-P121 HydrophobicContact CD2-CB 3.92Å; F111-P121 HydrophobicContact CD2-CG 4.26Å; F111-P121 HydrophobicContact CE1-CG 4.21Å; F111-P121 HydrophobicContact CE2-CB 4.22Å; F111-P121 HydrophobicContact CE2-CG 4.19Å; F111-P121 HydrophobicContact CG-CB 4.08Å; F111-P121 HydrophobicContact CG-CG 4.28Å; F111-P121 HydrophobicContact CZ-CG 4.16Å; F111-F124 HydrophobicContact CD2-CB 3.76Å; F111-F124 AromaticContact CD2-CD1 3.85Å; F111-F124 HydrophobicContact CD2-CD1 3.85Å; F111-F124 AromaticContact CD2-CG 3.8Å; F111-F124 HydrophobicContact CD2-CG 3.8Å; F111-F124 HydrophobicContact CE2-CB 3.84Å; F111-F124 HydrophobicContact CE2-CG 4.17Å
112P94.9Very high94.3Very high24 Ų2457 Ų5716%0.15634%0.336CS..PPolyproline II helixtrans-68120.6178-17.930.7000111.1V90 V92 E110 V114 L115 F124V90-P112 HydrophobicContact CG1-CB 3.56Å; V90-P112 HydrophobicContact CG1-CG 3.87Å; V92-P112 HydrophobicContact CG2-CG 4.33Å; E110-P112 WeakPolarHBondContact O-CD 3.41Å; P112-V114 PolarHBondContact O-N 2.8Å; P112-V114 VanDerWaalsContact O-N 3.13Å; P112-L115 HydrophobicContact CB-CD1 4.16Å; P112-L115 HydrophobicContact CB-CG 4.19Å; P112-L115 HydrophobicContact CG-CD1 3.96Å; P112-L115 WeakPolarHBondContact O-CB 3.46Å; P112-L115 PolarHBondContact O-N 2.88Å; P112-F124 HydrophobicContact CG-CE2 4.1Å; P112-F124 HydrophobicContact CG-CZ 4.01Å
113S93.8Very high94.7Very high96 Ų9659.9 Ų59.967%0.67135%0.346SS*.G310 helixtrans-60.5-25.1-178.558.50000113.8F111 L115 T116F111-S113 PolarHBondContact O-N 2.77Å; S113-L115 PolarHBondContact O-N 2.84Å; S113-T116 WeakPolarHBondContact O-CB 3.46Å; S113-T116 PolarHBondContact O-N 2.87Å; S113-T116 VanDerWaalsContact O-N 3.07Å; S113-T116 PolarHBondContact O-OG1 2.8Å
114V92.9Very high95Very high91 Ų9159.5 Ų59.555%0.55234%0.344SS*.G310 helixtrans-63-24.9175.1-173.20000111.9V90 P112 T116 F215V90-V114 HydrophobicContact CG2-CB 3.89Å; V90-V114 HydrophobicContact CG2-CG1 3.88Å; P112-V114 PolarHBondContact O-N 2.8Å; P112-V114 VanDerWaalsContact O-N 3.13Å; V114-T116 VanDerWaalsContact C-N 3.33Å; V114-F215 HydrophobicContact CG1-CZ 4.14Å
115L93.9Very high95.3Very high0 Ų065.1 Ų65.10%037%0.367CS..G310 helixtrans-86.6-3.1178-62.1-179.2000113.3V90 F111 P112 S113 G117 K118 V119 F124 L192 I213 F215V90-L115 HydrophobicContact CG2-CD2 4.07Å; V90-L115 HydrophobicContact CG2-CG 4.34Å; F111-L115 HydrophobicContact CE1-CB 4.36Å; F111-L115 HydrophobicContact CE2-CB 4.19Å; F111-L115 HydrophobicContact CZ-CB 3.73Å; P112-L115 HydrophobicContact CB-CD1 4.16Å; P112-L115 HydrophobicContact CB-CG 4.19Å; P112-L115 HydrophobicContact CG-CD1 3.96Å; P112-L115 WeakPolarHBondContact O-CB 3.46Å; P112-L115 PolarHBondContact O-N 2.88Å; S113-L115 PolarHBondContact O-N 2.84Å; L115-G117 PolarHBondContact O-N 2.9Å; L115-K118 WeakPolarHBondContact O-CB 3.39Å; L115-K118 PolarHBondContact O-N 3.39Å; L115-V119 HydrophobicContact CB-CG1 3.9Å; L115-V119 HydrophobicContact CD1-CG1 4.17Å; L115-V119 PolarHBondContact O-N 2.92Å; L115-F124 HydrophobicContact CD1-CD2 4.1Å; L115-F124 HydrophobicContact CD1-CE2 4.26Å; L115-L192 HydrophobicContact CD2-CD1 4.33Å; L115-L192 HydrophobicContact CD2-CD2 4.24Å; L115-I213 HydrophobicContact CD1-CD1 3.78Å; L115-I213 HydrophobicContact CD2-CG2 4.23Å; L115-F215 HydrophobicContact CD2-CE1 4.47Å; L115-F215 HydrophobicContact CD2-CZ 4.17Å
116T93.5Very high95.6Very high97 Ų9767.2 Ų67.260%0.59538%0.381SS*.THydrogen-bonded Turntrans-57.6127.6177.8-64.50000110.6S113 V114 K118S113-T116 WeakPolarHBondContact O-CB 3.46Å; S113-T116 PolarHBondContact O-N 2.87Å; S113-T116 VanDerWaalsContact O-N 3.07Å; S113-T116 PolarHBondContact O-OG1 2.8Å; V114-T116 VanDerWaalsContact C-N 3.33Å; T116-K118 VanDerWaalsContact C-N 3.27Å; T116-K118 PolarHBondContact O-N 3.39Å
117G92.6Very high95.7Very high80 Ų8063.6 Ų63.683%0.82537%0.365SS*.THydrogen-bonded Turntrans79.80.4-177.200000114.9L115L115-G117 PolarHBondContact O-N 2.9Å
118K92.9Very high95.8Very high118 Ų11863.6 Ų63.651%0.51337%0.365SS..THydrogen-bonded Turntrans-105.3-47.5174.1-59.4-66.8-173.5170.60112.3L115 T116 L192L115-K118 WeakPolarHBondContact O-CB 3.39Å; L115-K118 PolarHBondContact O-N 3.39Å; T116-K118 VanDerWaalsContact C-N 3.27Å; T116-K118 PolarHBondContact O-N 3.39Å; K118-L192 HydrophobicContact CB-CD1 4.35Å
119V96.4Very high95.9Very high9 Ų962.3 Ų62.36%0.05537%0.366CS..SBendtrans-131147.3175.859.90000109.5F111 L115 E123 Y187 L190 L192F111-V119 HydrophobicContact CE2-CG1 4.09Å; F111-V119 HydrophobicContact CZ-CG1 4.36Å; L115-V119 HydrophobicContact CB-CG1 3.9Å; L115-V119 HydrophobicContact CD1-CG1 4.17Å; L115-V119 PolarHBondContact O-N 2.92Å; V119-E123 HydrophobicContact CG2-CB 4.01Å; V119-Y187 HydrophobicContact CB-CE1 4.44Å; V119-Y187 HydrophobicContact CG2-CE1 3.94Å; V119-L190 HydrophobicContact CB-CD1 3.82Å; V119-L190 HydrophobicContact CG2-CD1 3.87Å; V119-L192 HydrophobicContact CB-CD1 4.33Å; V119-L192 HydrophobicContact CG1-CD1 4.33Å
120A96.1Very high95.9Very high51 Ų5163.4 Ų63.442%0.42136%0.363SS..  trans-70.6138.7175.700000110.4E122 E123 F124A120-E122 PolarHBondContact O-N 2.7Å; A120-E123 HydrophobicContact CB-CB 4.45Å; A120-E123 HydrophobicContact CB-CG 4.09Å; A120-E123 PolarHBondContact O-N 3.34Å; A120-E123 VanDerWaalsContact O-N 3.08Å; A120-F124 PolarHBondContact O-N 3.18Å; A120-F124 VanDerWaalsContact O-N 3.13Å
121P96.9Very high96Very high66 Ų6656.5 Ų56.543%0.42933%0.331SS..Hα-helixtrans-56.1-34.5178.7-27.835.3000114.2F111 F124 K125F111-P121 HydrophobicContact CD1-CG 4.27Å; F111-P121 HydrophobicContact CD2-CB 3.92Å; F111-P121 HydrophobicContact CD2-CG 4.26Å; F111-P121 HydrophobicContact CE1-CG 4.21Å; F111-P121 HydrophobicContact CE2-CB 4.22Å; F111-P121 HydrophobicContact CE2-CG 4.19Å; F111-P121 HydrophobicContact CG-CB 4.08Å; F111-P121 HydrophobicContact CG-CG 4.28Å; F111-P121 HydrophobicContact CZ-CG 4.16Å; P121-F124 PolarHBondContact O-N 3.14Å; P121-K125 VanDerWaalsContact O-CB 3.26Å; P121-K125 WeakPolarHBondContact O-CB 3.35Å; P121-K125 PolarHBondContact O-N 2.82Å
122E96.9Very high96Very high130 Ų13055.3 Ų55.361%0.60733%0.327SS*.Hα-helixtrans-69-35.3178.5-57.7-51.6136.400112.8A120 T126A120-E122 PolarHBondContact O-N 2.7Å; E122-T126 WeakPolarHBondContact O-CB 3.37Å; E122-T126 PolarHBondContact O-N 3.32Å; E122-T126 PolarHBondContact O-OG1 3.45Å
123E96.9Very high96.1Very high73 Ų7356.4 Ų56.434%0.34134%0.338SS..Hα-helixtrans-69.4-46.2175.7-65.8-64.2161.800110.1V119 A120 K125 T126 S127 L186V119-E123 HydrophobicContact CG2-CB 4.01Å; A120-E123 HydrophobicContact CB-CB 4.45Å; A120-E123 HydrophobicContact CB-CG 4.09Å; A120-E123 PolarHBondContact O-N 3.34Å; A120-E123 VanDerWaalsContact O-N 3.08Å; E123-K125 VanDerWaalsContact C-N 3.34Å; E123-K125 PolarHBondContact O-N 2.77Å; E123-T126 WeakPolarHBondContact O-CB 3.39Å; E123-T126 PolarHBondContact O-N 2.83Å; E123-T126 VanDerWaalsContact O-N 3.13Å; E123-S127 PolarHBondContact O-N 2.84Å; E123-S127 PolarHBondContact O-OG 3.34Å; E123-S127 VanDerWaalsContact O-OG 3.13Å; E123-L186 HydrophobicContact CB-CD2 3.84Å; E123-L186 HydrophobicContact CG-CD2 4.18Å
124F97.7Very high96.1Very high1 Ų153 Ų530%0.00431%0.314CS..Hα-helixtrans-54.6-50.9173.4175.5-90.8000111.4V92 E110 F111 P112 L115 A120 P121 T126 S127 I128 W194 I213V92-F124 HydrophobicContact CG2-CE2 4.33Å; V92-F124 HydrophobicContact CG2-CZ 4.2Å; E110-F124 WeakPolarHBondContact O-CE1 3.49Å; F111-F124 HydrophobicContact CD2-CB 3.76Å; F111-F124 AromaticContact CD2-CD1 3.85Å; F111-F124 HydrophobicContact CD2-CD1 3.85Å; F111-F124 AromaticContact CD2-CG 3.8Å; F111-F124 HydrophobicContact CD2-CG 3.8Å; F111-F124 HydrophobicContact CE2-CB 3.84Å; F111-F124 HydrophobicContact CE2-CG 4.17Å; P112-F124 HydrophobicContact CG-CE2 4.1Å; P112-F124 HydrophobicContact CG-CZ 4.01Å; L115-F124 HydrophobicContact CD1-CD2 4.1Å; L115-F124 HydrophobicContact CD1-CE2 4.26Å; A120-F124 PolarHBondContact O-N 3.18Å; A120-F124 VanDerWaalsContact O-N 3.13Å; P121-F124 PolarHBondContact O-N 3.14Å; F124-T126 PolarHBondContact O-N 3.25Å; F124-S127 PolarHBondContact O-N 3.35Å; F124-I128 HydrophobicContact CD1-CG2 4.37Å; F124-I128 HydrophobicContact CE1-CB 4.49Å; F124-I128 HydrophobicContact CE1-CG2 4.11Å; F124-I128 WeakPolarHBondContact O-CG2 3.46Å; F124-I128 PolarHBondContact O-N 3.43Å; F124-W194 AromaticContact CD2-CH2 3.77Å; F124-W194 HydrophobicContact CD2-CH2 3.77Å; F124-W194 AromaticContact CD2-CZ2 3.51Å; F124-W194 HydrophobicContact CD2-CZ2 3.51Å; F124-W194 AromaticContact CE2-CH2 3.64Å; F124-W194 HydrophobicContact CE2-CH2 3.64Å; F124-W194 AromaticContact CE2-CZ2 3.63Å; F124-W194 HydrophobicContact CE2-CZ2 3.63Å; F124-W194 HydrophobicContact CZ-CH2 4.46Å; F124-I213 HydrophobicContact CE2-CD1 3.93Å
125K97.5Very high96.1Very high125 Ų12549 Ų4954%0.54329%0.289SS..Hα-helixtrans-61.2-34.4179.7-171.5176.4-179.7-178.40112.2P121 E123 G129P121-K125 VanDerWaalsContact O-CB 3.26Å; P121-K125 WeakPolarHBondContact O-CB 3.35Å; P121-K125 PolarHBondContact O-N 2.82Å; E123-K125 VanDerWaalsContact C-N 3.34Å; E123-K125 PolarHBondContact O-N 2.77Å; K125-G129 WeakPolarHBondContact O-CA 3.5Å; K125-G129 PolarHBondContact O-N 3.13Å
126T97.8Very high96Very high61 Ų6156.6 Ų56.637%0.37432%0.323SS..Hα-helixtrans-69.7-49.6175.6-61.70000111.3E122 E123 F124 G129 R130E122-T126 WeakPolarHBondContact O-CB 3.37Å; E122-T126 PolarHBondContact O-N 3.32Å; E122-T126 PolarHBondContact O-OG1 3.45Å; E123-T126 WeakPolarHBondContact O-CB 3.39Å; E123-T126 PolarHBondContact O-N 2.83Å; E123-T126 VanDerWaalsContact O-N 3.13Å; F124-T126 PolarHBondContact O-N 3.25Å; T126-G129 WeakPolarHBondContact O-CA 3.38Å; T126-G129 PolarHBondContact O-N 3.44Å; T126-R130 PolarHBondContact O-N 3.34Å
127S97.8Very high95.9Very high0 Ų060 Ų600%033%0.329CS..Hα-helixtrans-61.1-51.1179.8-53.50000111.3E123 F124 G129 R130 V131 E182 Y187E123-S127 PolarHBondContact O-N 2.84Å; E123-S127 PolarHBondContact O-OG 3.34Å; E123-S127 VanDerWaalsContact O-OG 3.13Å; F124-S127 PolarHBondContact O-N 3.35Å; S127-G129 PolarHBondContact O-N 2.93Å; S127-R130 PolarHBondContact O-N 3.24Å; S127-R130 VanDerWaalsContact O-N 3.13Å; S127-V131 PolarHBondContact O-N 3.46Å; S127-E182 WeakPolarHBondContact CB-OE2 3.23Å; S127-E182 VanDerWaalsContact OG-CD 3.31Å; S127-E182 PolarHBondContact OG-OE2 2.93Å; S127-Y187 WeakPolarHBondContact CB-OH 3.35Å; S127-Y187 WeakPolarHBondContact OG-CE2 3.33Å; S127-Y187 PolarHBondContact OG-OH 3.26Å
128I97.8Very high95.6Very high0 Ų057 Ų570%030%0.297CS..Hα-helixtrans-65.8-30.3177.2-159.165000111.7V92 F107 D108 T109 F124 V131 N132 W194 I211V92-I128 HydrophobicContact CG1-CD1 4.26Å; F107-I128 HydrophobicContact CB-CD1 3.8Å; F107-I128 HydrophobicContact CB-CG1 4.22Å; F107-I128 HydrophobicContact CG-CD1 4.44Å; D108-I128 WeakPolarHBondContact O-CG1 3.4Å; T109-I128 HydrophobicContact CG2-CG2 4.17Å; F124-I128 HydrophobicContact CD1-CG2 4.37Å; F124-I128 HydrophobicContact CE1-CB 4.49Å; F124-I128 HydrophobicContact CE1-CG2 4.11Å; F124-I128 WeakPolarHBondContact O-CG2 3.46Å; F124-I128 PolarHBondContact O-N 3.43Å; I128-V131 PolarHBondContact O-N 2.89Å; I128-N132 WeakPolarHBondContact O-CB 3.15Å; I128-N132 PolarHBondContact O-N 3.46Å; I128-N132 PolarHBondContact O-ND2 2.9Å; I128-W194 HydrophobicContact CB-CH2 4.34Å; I128-W194 HydrophobicContact CD1-CH2 4.47Å; I128-W194 HydrophobicContact CD1-CZ3 4.05Å; I128-I211 HydrophobicContact CD1-CD1 3.53Å
129G97.8Very high95.3Very high33 Ų3353.1 Ų53.134%0.3428%0.281SS..Hα-helixtrans-62.3-40.8173.100000112.5K125 T126 S127 N132 A133K125-G129 WeakPolarHBondContact O-CA 3.5Å; K125-G129 PolarHBondContact O-N 3.13Å; T126-G129 WeakPolarHBondContact O-CA 3.38Å; T126-G129 PolarHBondContact O-N 3.44Å; S127-G129 PolarHBondContact O-N 2.93Å; G129-N132 PolarHBondContact O-N 2.9Å; G129-A133 WeakPolarHBondContact O-CB 3.43Å; G129-A133 PolarHBondContact O-N 3.07Å
130R97.4Very high94.7Very high84 Ų8456.8 Ų56.832%0.31731%0.305SS..Hα-helixtrans-65.4-43174.4-69.5-177.3-178.4121.39.4111.7T126 S127 N132 A133 C134 L178 E182 R185T126-R130 PolarHBondContact O-N 3.34Å; S127-R130 PolarHBondContact O-N 3.24Å; S127-R130 VanDerWaalsContact O-N 3.13Å; R130-N132 PolarHBondContact O-N 3.5Å; R130-A133 WeakPolarHBondContact O-CB 3.45Å; R130-A133 PolarHBondContact O-N 3.37Å; R130-C134 PolarHBondContact O-N 3.32Å; R130-L178 HydrophobicContact CB-CD1 4.3Å; R130-L178 HydrophobicContact CB-CD2 3.9Å; R130-E182 WeakPolarHBondContact CD-OE1 3.36Å; R130-E182 IonicContact CZ-OE1 3.4Å; R130-E182 IonicContact NE-OE1 2.87Å; R130-E182 IonicContact NH1-OE1 2.6Å; R130-E182 PolarHBondContact NH1-OE1 2.92Å; R130-E182 IonicContact NH1-OE2 2.67Å; R130-R185 VanDerWaalsContact NH2-NH1 3.18Å
131V97.6Very high94.2Very high1 Ų157.6 Ų57.61%0.00631%0.305CS..Hα-helixtrans-59.6-48.7175.2176.50000110.6F107 S127 I128 A133 C134 L135 I175 L178 I179 I211F107-V131 HydrophobicContact CD2-CG1 3.8Å; F107-V131 HydrophobicContact CE2-CG1 4.06Å; S127-V131 PolarHBondContact O-N 3.46Å; I128-V131 PolarHBondContact O-N 2.89Å; V131-A133 VanDerWaalsContact C-N 3.27Å; V131-A133 PolarHBondContact O-N 3.13Å; V131-C134 WeakPolarHBondContact O-CB 3.45Å; V131-C134 PolarHBondContact O-N 3.21Å; V131-C134 VanDerWaalsContact O-N 3.1Å; V131-L135 HydrophobicContact CG1-CD1 4.32Å; V131-L135 PolarHBondContact O-N 2.69Å; V131-I175 HydrophobicContact CG1-CG1 4.4Å; V131-I175 HydrophobicContact CG1-CG2 3.91Å; V131-L178 HydrophobicContact CB-CD2 4.37Å; V131-L178 HydrophobicContact CG2-CD2 3.82Å; V131-I179 HydrophobicContact CG2-CG1 4.39Å; V131-I211 HydrophobicContact CG1-CD1 4.16Å
132N96.9Very high93.6Very high21 Ų2155.3 Ų55.311%0.11229%0.289CS..Hα-helixtrans-63.3-31.7177.5-76.3-33000113K106 F107 T109 I128 G129 R130 K136K106-N132 WeakPolarHBondContact CA-OD1 3.1Å; F107-N132 PolarHBondContact N-OD1 2.93Å; F107-N132 PolarHBondContact O-ND2 2.75Å; T109-N132 WeakPolarHBondContact CG2-ND2 3.4Å; I128-N132 WeakPolarHBondContact O-CB 3.15Å; I128-N132 PolarHBondContact O-N 3.46Å; I128-N132 PolarHBondContact O-ND2 2.9Å; G129-N132 PolarHBondContact O-N 2.9Å; R130-N132 PolarHBondContact O-N 3.5Å; N132-K136 VanDerWaalsContact O-CB 3.32Å; N132-K136 WeakPolarHBondContact O-CB 3.32Å; N132-K136 PolarHBondContact O-N 3.38Å
133A96.3Very high93Very high47 Ų4751.7 Ų51.739%0.38828%0.276SS..Hα-helixtrans-68.3-38173.300000112.1G129 R130 V131 K136 K137G129-A133 WeakPolarHBondContact O-CB 3.43Å; G129-A133 PolarHBondContact O-N 3.07Å; R130-A133 WeakPolarHBondContact O-CB 3.45Å; R130-A133 PolarHBondContact O-N 3.37Å; V131-A133 VanDerWaalsContact C-N 3.27Å; V131-A133 PolarHBondContact O-N 3.13Å; A133-K136 PolarHBondContact O-N 2.89Å; A133-K137 WeakPolarHBondContact O-CG 3.43Å; A133-K137 PolarHBondContact O-N 2.97Å; A133-K137 VanDerWaalsContact O-N 3.17Å
134C94.3Very high92.4Very high25 Ų2555.8 Ų55.817%0.16929%0.292CS..Hα-helixtrans-60.9-52.5172.6-175.50000110.9R130 V131 K136 K137 A138 S174 I175R130-C134 PolarHBondContact O-N 3.32Å; V131-C134 WeakPolarHBondContact O-CB 3.45Å; V131-C134 PolarHBondContact O-N 3.21Å; V131-C134 VanDerWaalsContact O-N 3.1Å; C134-K136 VanDerWaalsContact C-N 3.31Å; C134-K136 PolarHBondContact O-N 3.14Å; C134-K137 PolarHBondContact O-N 3.21Å; C134-K137 VanDerWaalsContact O-N 3.08Å; C134-A138 PolarHBondContact O-N 2.96Å; C134-A138 VanDerWaalsContact O-N 3.13Å; C134-S174 PolarHBondContact SG-OG 3.19Å; C134-S174 VanDerWaalsContact SG-OG 3.38Å; C134-I175 HydrophobicContact CB-CG1 4.5Å
135L93.5Very high91.7Very high7 Ų761.4 Ų61.44%0.03731%0.313CS..Hα-helixtrans-54.8-45.7176.7-72.8167.8000112.3L103 N105 F107 V131 K137 A138 L139 T171 I175L103-L135 HydrophobicContact CD1-CD2 4.36Å; L103-L135 HydrophobicContact CD2-CD2 3.88Å; L103-L135 HydrophobicContact CG-CD2 4.05Å; N105-L135 WeakPolarHBondContact O-CB 3.3Å; F107-L135 HydrophobicContact CD2-CD1 3.58Å; F107-L135 HydrophobicContact CE2-CD1 3.71Å; V131-L135 HydrophobicContact CG1-CD1 4.32Å; V131-L135 PolarHBondContact O-N 2.69Å; L135-K137 VanDerWaalsContact C-N 3.28Å; L135-K137 PolarHBondContact O-N 2.62Å; L135-A138 PolarHBondContact O-N 2.84Å; L135-L139 WeakPolarHBondContact O-CG 3.32Å; L135-L139 PolarHBondContact O-N 3.1Å; L135-L139 VanDerWaalsContact O-N 3.1Å; L135-T171 HydrophobicContact CD2-CG2 4.1Å; L135-I175 HydrophobicContact CD2-CD1 3.48Å; L135-I175 VanDerWaalsContact CD2-CD1 3.48Å; L135-I175 HydrophobicContact CG-CD1 3.8Å
136K92.1Very high90.9Very high160 Ų16059 Ų5970%0.69631%0.306SS*.Hα-helixtrans-62.8-33.3179.9-172.5176.5180-178.50113.1N132 A133 C134N132-K136 VanDerWaalsContact O-CB 3.32Å; N132-K136 WeakPolarHBondContact O-CB 3.32Å; N132-K136 PolarHBondContact O-N 3.38Å; A133-K136 PolarHBondContact O-N 2.89Å; C134-K136 VanDerWaalsContact C-N 3.31Å; C134-K136 PolarHBondContact O-N 3.14Å
137K91.1Very high90.1Very high167 Ų16761.5 Ų61.573%0.72632%0.317SS*.Hα-helixtrans-73.1-34.9176.6-72.5174.4-179.2-1760112.1A133 C134 L135 P140A133-K137 WeakPolarHBondContact O-CG 3.43Å; A133-K137 PolarHBondContact O-N 2.97Å; A133-K137 VanDerWaalsContact O-N 3.17Å; C134-K137 PolarHBondContact O-N 3.21Å; C134-K137 VanDerWaalsContact O-N 3.08Å; L135-K137 VanDerWaalsContact C-N 3.28Å; L135-K137 PolarHBondContact O-N 2.62Å; K137-P140 WeakPolarHBondContact O-CD 3.41Å
138A86.9Confident89.2Confident18 Ų1864.3 Ų64.315%0.14934%0.336CS..Hα-helixtrans-72.8-29.717800000113C134 L135 V141 N142 T171C134-A138 PolarHBondContact O-N 2.96Å; C134-A138 VanDerWaalsContact O-N 3.13Å; L135-A138 PolarHBondContact O-N 2.84Å; A138-V141 PolarHBondContact O-N 3.47Å; A138-N142 VanDerWaalsContact O-CG 3.23Å; A138-N142 PolarHBondContact O-N 3.47Å; A138-N142 PolarHBondContact O-OD1 3.19Å; A138-T171 HydrophobicContact CB-CG2 3.85Å; A138-T171 WeakPolarHBondContact CB-OG1 3.41Å
139L85.8Confident88.2Confident37 Ų3764.7 Ų64.719%0.19434%0.339CS..Hα-helixtrans-46.6-55.4-177.1-83.2177.2000116.5N105 L135 V141 N142 V143N105-L139 HydrophobicContact CB-CD1 3.89Å; N105-L139 HydrophobicContact CB-CD2 3.31Å; N105-L139 HydrophobicContact CB-CG 3.91Å; L135-L139 WeakPolarHBondContact O-CG 3.32Å; L135-L139 PolarHBondContact O-N 3.1Å; L135-L139 VanDerWaalsContact O-N 3.1Å; L139-V141 VanDerWaalsContact C-N 3.29Å; L139-V141 PolarHBondContact O-N 2.74Å; L139-N142 PolarHBondContact O-N 3.06Å; L139-V143 WeakPolarHBondContact O-CB 3.43Å; L139-V143 VanDerWaalsContact O-CG2 3.29Å; L139-V143 WeakPolarHBondContact O-CG2 3.47Å; L139-V143 PolarHBondContact O-N 3.33Å
140P84.8Confident87.1Confident85 Ų8566.8 Ų66.855%0.55235%0.348SS*.Hα-helixtrans-63.5-35.1-176.424-34.8000112.9K137 K144K137-P140 WeakPolarHBondContact O-CD 3.41Å; P140-K144 WeakPolarHBondContact O-CB 3.44Å; P140-K144 PolarHBondContact O-N 2.86Å
141V85.6Confident86Confident69 Ų6969 Ų6942%0.41837%0.365SS..Hα-helixtrans-66.8-52.2175.7-179.20000108.8A138 L139 V143 K144 W145 L167A138-V141 PolarHBondContact O-N 3.47Å; L139-V141 VanDerWaalsContact C-N 3.29Å; L139-V141 PolarHBondContact O-N 2.74Å; V141-V143 VanDerWaalsContact C-N 3.31Å; V141-V143 PolarHBondContact O-N 3.1Å; V141-K144 PolarHBondContact O-N 3.14Å; V141-K144 VanDerWaalsContact O-N 3.12Å; V141-W145 PolarHBondContact O-N 2.99Å; V141-L167 HydrophobicContact CG1-CD2 3.82Å
142N82.9Confident84.5Confident18 Ų1871.3 Ų71.310%0.09638%0.381CS..Hα-helixtrans-58-41.6179.5-63.6-3.1000112.2A138 L139 L146A138-N142 VanDerWaalsContact O-CG 3.23Å; A138-N142 PolarHBondContact O-N 3.47Å; A138-N142 PolarHBondContact O-OD1 3.19Å; L139-N142 PolarHBondContact O-N 3.06Å; N142-L146 WeakPolarHBondContact O-CB 3.32Å; N142-L146 PolarHBondContact O-N 3.49Å
143V84.1Confident82.7Confident54 Ų5473.2 Ų73.233%0.32740%0.396SS..Hα-helixtrans-68.4-42177.5171.80000111.4L139 V141 W145 L146 L147L139-V143 WeakPolarHBondContact O-CB 3.43Å; L139-V143 VanDerWaalsContact O-CG2 3.29Å; L139-V143 WeakPolarHBondContact O-CG2 3.47Å; L139-V143 PolarHBondContact O-N 3.33Å; V141-V143 VanDerWaalsContact C-N 3.31Å; V141-V143 PolarHBondContact O-N 3.1Å; V143-W145 VanDerWaalsContact C-N 3.34Å; V143-W145 PolarHBondContact O-N 3.29Å; V143-L146 PolarHBondContact O-N 3.41Å; V143-L147 HydrophobicContact CG1-CD1 3.83Å; V143-L147 HydrophobicContact CG1-CG 4.22Å; V143-L147 WeakPolarHBondContact O-CB 3.47Å; V143-L147 VanDerWaalsContact O-CG 3.24Å; V143-L147 WeakPolarHBondContact O-CG 3.34Å; V143-L147 PolarHBondContact O-N 3.35Å
144K85Confident81Confident159 Ų15976 Ų7669%0.69141%0.411SS*.Hα-helixtrans-59.4-46.8177.7179.7175.8174.1175.40111P140 V141 L147 C148P140-K144 WeakPolarHBondContact O-CB 3.44Å; P140-K144 PolarHBondContact O-N 2.86Å; V141-K144 PolarHBondContact O-N 3.14Å; V141-K144 VanDerWaalsContact O-N 3.12Å; K144-L147 PolarHBondContact O-N 3.07Å; K144-C148 WeakPolarHBondContact O-CB 3.34Å; K144-C148 PolarHBondContact O-N 3.01Å
145W82.3Confident79.2Confident118 Ų11879.8 Ų79.845%0.44744%0.437SS..Hα-helixtrans-70.7-37.5178.8-75.1107.5000113.1V141 V143 L147 C148 G149 P163 L167V141-W145 PolarHBondContact O-N 2.99Å; V143-W145 VanDerWaalsContact C-N 3.34Å; V143-W145 PolarHBondContact O-N 3.29Å; W145-L147 PolarHBondContact O-N 2.84Å; W145-C148 PolarHBondContact O-N 3.3Å; W145-G149 PolarHBondContact O-N 3.22Å; W145-P163 HydrophobicContact CE3-CB 4.02Å; W145-P163 HydrophobicContact CZ3-CB 4.21Å; W145-L167 HydrophobicContact CB-CD1 3.25Å; W145-L167 HydrophobicContact CD2-CD1 4.17Å; W145-L167 HydrophobicContact CG-CD1 3.29Å
146L80.6Confident77.2Confident74 Ų7483.3 Ų83.339%0.38746%0.459SS..Hα-helixtrans-61.6-43.5173.3-177.269.8000111.7N142 V143 C150 V164N142-L146 WeakPolarHBondContact O-CB 3.32Å; N142-L146 PolarHBondContact O-N 3.49Å; V143-L146 PolarHBondContact O-N 3.41Å; L146-C150 VanDerWaalsContact O-CB 3.23Å; L146-C150 WeakPolarHBondContact O-CB 3.46Å; L146-C150 PolarHBondContact O-N 3.3Å; L146-V164 HydrophobicContact CB-CG1 4.37Å; L146-V164 HydrophobicContact CD1-CG1 3.81Å
147L81.8Confident75.4Confident114 Ų11484.7 Ų84.760%0.59747%0.472SS*.Hα-helixtrans-68.3-40.3177.4-70.4174.9000111.6V143 K144 W145 C150 L151V143-L147 HydrophobicContact CG1-CD1 3.83Å; V143-L147 HydrophobicContact CG1-CG 4.22Å; V143-L147 WeakPolarHBondContact O-CB 3.47Å; V143-L147 VanDerWaalsContact O-CG 3.24Å; V143-L147 WeakPolarHBondContact O-CG 3.34Å; V143-L147 PolarHBondContact O-N 3.35Å; K144-L147 PolarHBondContact O-N 3.07Å; W145-L147 PolarHBondContact O-N 2.84Å; L147-C150 PolarHBondContact O-N 3.49Å; L147-L151 VanDerWaalsContact O-CB 3.29Å; L147-L151 WeakPolarHBondContact O-CB 3.14Å; L147-L151 PolarHBondContact O-N 3.1Å
148C78.6Confident73.9Confident60 Ų6079.5 Ų79.541%0.40547%0.467SS..Hα-helixtrans-60.2-52.3173.6-171.30000110.8K144 W145 C150 L151 C152K144-C148 WeakPolarHBondContact O-CB 3.34Å; K144-C148 PolarHBondContact O-N 3.01Å; W145-C148 PolarHBondContact O-N 3.3Å; C148-C150 VanDerWaalsContact C-N 3.33Å; C148-C150 PolarHBondContact O-N 3.03Å; C148-L151 PolarHBondContact O-N 3.01Å; C148-C152 WeakPolarHBondContact O-CB 3.4Å; C148-C152 PolarHBondContact O-N 3.17Å; C148-C152 PolarHBondContact O-SG 3.32Å
149G76.4Confident72.4Confident7 Ų783.2 Ų83.27%0.07249%0.491CS..Hα-helixtrans-60.2-39.3178.200000112.9W145 C153W145-G149 PolarHBondContact O-N 3.22Å; G149-C153 VanDerWaalsContact O-CB 3.26Å; G149-C153 WeakPolarHBondContact O-CB 3.43Å; G149-C153 PolarHBondContact O-N 2.97Å
150C75.8Confident71Confident77 Ų7784.1 Ų84.152%0.5250%0.5SS..Hα-helixtrans-68.7-39.1176.3-171.70000112.5L146 L147 C148 C154L146-C150 VanDerWaalsContact O-CB 3.23Å; L146-C150 WeakPolarHBondContact O-CB 3.46Å; L146-C150 PolarHBondContact O-N 3.3Å; L147-C150 PolarHBondContact O-N 3.49Å; C148-C150 VanDerWaalsContact C-N 3.33Å; C148-C150 PolarHBondContact O-N 3.03Å; C150-C154 PolarHBondContact O-SG 3.23Å
151L75.1Confident69.7Low130 Ų13084.7 Ų84.768%0.68150%0.498SS*.Hα-helixtrans-69.3-38.1177-173.862.6000111.6L147 C148L147-L151 VanDerWaalsContact O-CB 3.29Å; L147-L151 WeakPolarHBondContact O-CB 3.14Å; L147-L151 PolarHBondContact O-N 3.1Å; C148-L151 PolarHBondContact O-N 3.01Å
152C65.1Low68.7Low51 Ų5189.9 Ų89.935%0.34551%0.51SS..Hα-helixtrans-79.6-31.3179.8-65.20000113.2C148 C154 C155 T156C148-C152 WeakPolarHBondContact O-CB 3.4Å; C148-C152 PolarHBondContact O-N 3.17Å; C148-C152 PolarHBondContact O-SG 3.32Å; C152-C154 PolarHBondContact O-N 2.93Å; C152-C155 WeakPolarHBondContact O-CA 3.49Å; C152-C155 WeakPolarHBondContact O-CB 3.46Å; C152-C155 PolarHBondContact O-N 3.21Å; C152-T156 PolarHBondContact O-N 3.21Å; C152-T156 PolarHBondContact O-OG1 2.9Å; C152-T156 VanDerWaalsContact O-OG1 3.1Å
153C59.7Low67.8Low61 Ų6191.3 Ų91.341%0.41252%0.52SS..Hα-helixtrans-65.7-21.5178.196.70000112.7G149 C155G149-C153 VanDerWaalsContact O-CB 3.26Å; G149-C153 WeakPolarHBondContact O-CB 3.43Å; G149-C153 PolarHBondContact O-N 2.97Å; C153-C155 PolarHBondContact O-N 3.19Å
154C60.5Low67Low105 Ų10589 Ų8971%0.70951%0.506SS*.THydrogen-bonded Turntrans-66.7-16.7170.3-57.50000113.2C150 C152C150-C154 PolarHBondContact O-SG 3.23Å; C152-C154 PolarHBondContact O-N 2.93Å
155C56.1Low66.3Low105 Ų10585.1 Ų85.171%0.70949%0.492SS*.THydrogen-bonded Turntrans-117.8-20.3-167.5-60.50000114.1C152 C153C152-C155 WeakPolarHBondContact O-CA 3.49Å; C152-C155 WeakPolarHBondContact O-CB 3.46Å; C152-C155 PolarHBondContact O-N 3.21Å; C153-C155 PolarHBondContact O-N 3.19Å
156T51.5Low65.5Low81 Ų8181.8 Ų81.850%0.49749%0.486SS..SBendtrans-13353.8-173.639.30000114.1C152 G158 C159C152-T156 PolarHBondContact O-N 3.21Å; C152-T156 PolarHBondContact O-OG1 2.9Å; C152-T156 VanDerWaalsContact O-OG1 3.1Å; T156-G158 PolarHBondContact O-N 3.14Å; T156-C159 PolarHBondContact O-N 3.47Å
157L54.3Low65Low188 Ų18879.6 Ų79.698%0.98448%0.475SS*.THydrogen-bonded Turntrans44.127163.4-79.8166.2000117.2
158G58.3Low64.8Low59 Ų5974.7 Ų74.761%0.60845%0.449SS*.THydrogen-bonded Turntrans96.28.4171.100000118T156T156-G158 PolarHBondContact O-N 3.14Å
159C56.5Low65.1Low96 Ų9674 Ų7465%0.64944%0.439SS*.  trans-88.3141.5172.3-60.70000111.1T156T156-C159 PolarHBondContact O-N 3.47Å
160S55.7Low65.6Low56 Ų5681 Ų8139%0.39246%0.464SS..  trans103.828.5170790000120.2W162 P163S160-W162 PolarHBondContact O-N 3.46Å; S160-P163 WeakPolarHBondContact O-CD 3.18Å
161L58.1Low66.3Low97 Ų9777.9 Ų77.951%0.50844%0.442SS..  trans-72-10.2159.3-70178.1000112.9V164 I165L161-V164 WeakPolarHBondContact O-CB 3.23Å; L161-V164 PolarHBondContact O-N 3.37Å; L161-I165 WeakPolarHBondContact O-CG1 3.24Å; L161-I165 PolarHBondContact O-N 2.86Å; L161-I165 VanDerWaalsContact O-N 3.09Å
162W65.1Low67.2Low177 Ų17775.1 Ų75.167%0.6742%0.423SS*.Hα-helixtrans-54.8-52179.9-169.5-97.3000113.5S160 V164 I165 C166S160-W162 PolarHBondContact O-N 3.46Å; W162-V164 PolarHBondContact O-N 3.29Å; W162-I165 WeakPolarHBondContact O-CA 3.36Å; W162-I165 WeakPolarHBondContact O-CB 3.43Å; W162-I165 PolarHBondContact O-N 3.43Å; W162-C166 VanDerWaalsContact CD1-SG 3.6Å; W162-C166 PolarHBondContact NE1-SG 3.31Å; W162-C166 PolarHBondContact O-N 3.1Å; W162-C166 PolarHBondContact O-SG 3.41Å
163P63.5Low68.5Low48 Ų4874.9 Ų74.931%0.31242%0.415SS..Hα-helixtrans-50.6-36.1171.7-29.130.3000114.8W145 S160 L167W145-P163 HydrophobicContact CE3-CB 4.02Å; W145-P163 HydrophobicContact CZ3-CB 4.21Å; S160-P163 WeakPolarHBondContact O-CD 3.18Å; P163-L167 WeakPolarHBondContact O-CD1 3.47Å; P163-L167 VanDerWaalsContact O-CG 3.23Å; P163-L167 WeakPolarHBondContact O-CG 3.46Å; P163-L167 PolarHBondContact O-N 3.04Å
164V66.7Low70.1Confident5 Ų574.8 Ų74.83%0.0341%0.414CS..Hα-helixtrans-75.8-32.3-179.5-1630000111.1F101 L146 L161 W162F101-V164 HydrophobicContact CE2-CB 4.05Å; F101-V164 HydrophobicContact CE2-CG1 3.7Å; F101-V164 WeakPolarHBondContact CE2-O 3.37Å; F101-V164 HydrophobicContact CZ-CB 4.38Å; F101-V164 HydrophobicContact CZ-CG1 4.28Å; L146-V164 HydrophobicContact CB-CG1 4.37Å; L146-V164 HydrophobicContact CD1-CG1 3.81Å; L161-V164 WeakPolarHBondContact O-CB 3.23Å; L161-V164 PolarHBondContact O-N 3.37Å; W162-V164 PolarHBondContact O-N 3.29Å
165I70Confident71.8Confident79 Ų7969.8 Ų69.841%0.40538%0.38SS..Hα-helixtrans-70.6-47175.8-64.5166.7000110F101 L161 W162 L167 N168 K169F101-I165 HydrophobicContact CE1-CG1 4.09Å; F101-I165 HydrophobicContact CE2-CG1 3.94Å; F101-I165 HydrophobicContact CZ-CG1 3.63Å; L161-I165 WeakPolarHBondContact O-CG1 3.24Å; L161-I165 PolarHBondContact O-N 2.86Å; L161-I165 VanDerWaalsContact O-N 3.09Å; W162-I165 WeakPolarHBondContact O-CA 3.36Å; W162-I165 WeakPolarHBondContact O-CB 3.43Å; W162-I165 PolarHBondContact O-N 3.43Å; I165-L167 VanDerWaalsContact C-N 3.35Å; I165-L167 PolarHBondContact O-N 2.92Å; I165-N168 WeakPolarHBondContact O-CB 3.42Å; I165-N168 PolarHBondContact O-N 2.86Å; I165-N168 VanDerWaalsContact O-N 3.08Å; I165-K169 PolarHBondContact O-N 3.47Å
166C66.1Low73.8Confident47 Ų4768.5 Ų68.532%0.31836%0.364SS..Hα-helixtrans-60.8-39.9-179-58.90000112.4W162 N168 K169 R170W162-C166 VanDerWaalsContact CD1-SG 3.6Å; W162-C166 PolarHBondContact NE1-SG 3.31Å; W162-C166 PolarHBondContact O-N 3.1Å; W162-C166 PolarHBondContact O-SG 3.41Å; C166-N168 PolarHBondContact O-N 3.13Å; C166-K169 CarbonylContact O-C 3.44Å; C166-K169 WeakPolarHBondContact O-CA 3.29Å; C166-K169 WeakPolarHBondContact O-CB 3.44Å; C166-K169 PolarHBondContact O-N 3.46Å; C166-R170 PolarHBondContact O-N 3.34Å
167L70.1Confident75.9Confident28 Ų2871.5 Ų71.515%0.14737%0.37CS..Hα-helixtrans-60.9-34.3175.6-72.3166.6000113.5V141 W145 P163 I165 T171V141-L167 HydrophobicContact CG1-CD2 3.82Å; W145-L167 HydrophobicContact CB-CD1 3.25Å; W145-L167 HydrophobicContact CD2-CD1 4.17Å; W145-L167 HydrophobicContact CG-CD1 3.29Å; P163-L167 WeakPolarHBondContact O-CD1 3.47Å; P163-L167 VanDerWaalsContact O-CG 3.23Å; P163-L167 WeakPolarHBondContact O-CG 3.46Å; P163-L167 PolarHBondContact O-N 3.04Å; I165-L167 VanDerWaalsContact C-N 3.35Å; I165-L167 PolarHBondContact O-N 2.92Å; L167-T171 WeakPolarHBondContact O-CB 3.39Å; L167-T171 PolarHBondContact O-N 3.31Å; L167-T171 PolarHBondContact O-OG1 2.89Å
168N77.9Confident78Confident12 Ų1264.3 Ų64.36%0.06433%0.333CS..Hα-helixtrans-73.8-35.9175-15831.2000111.2V100 F101 L103 I165 C166 T171 R172V100-N168 PolarHBondContact O-ND2 3.29Å; F101-N168 WeakPolarHBondContact CB-ND2 3.38Å; F101-N168 HydrophobicContact CD2-CB 4.32Å; L103-N168 WeakPolarHBondContact CB-OD1 3.46Å; L103-N168 WeakPolarHBondContact CD2-OD1 3.35Å; I165-N168 WeakPolarHBondContact O-CB 3.42Å; I165-N168 PolarHBondContact O-N 2.86Å; I165-N168 VanDerWaalsContact O-N 3.08Å; C166-N168 PolarHBondContact O-N 3.13Å; N168-T171 PolarHBondContact O-N 3.31Å; N168-R172 VanDerWaalsContact O-CB 3.23Å; N168-R172 WeakPolarHBondContact O-CB 3.26Å; N168-R172 PolarHBondContact O-N 3.03Å
169K84.1Confident79.9Confident45 Ų4561.7 Ų61.720%0.19631%0.305CS..Hα-helixtrans-61.1-48.7172-162.1173.6179.3178.70110.3E57 I165 C166 T171 R172 R173E57-K169 WeakPolarHBondContact OE1-CD 3.48Å; E57-K169 WeakPolarHBondContact OE1-CE 3.42Å; E57-K169 IonicContact OE1-NZ 2.73Å; E57-K169 PolarHBondContact OE1-NZ 2.88Å; E57-K169 IonicContact OE2-NZ 3.69Å; E57-K169 PolarHBondContact OE2-NZ 3.28Å; I165-K169 PolarHBondContact O-N 3.47Å; C166-K169 CarbonylContact O-C 3.44Å; C166-K169 WeakPolarHBondContact O-CA 3.29Å; C166-K169 WeakPolarHBondContact O-CB 3.44Å; C166-K169 PolarHBondContact O-N 3.46Å; K169-T171 PolarHBondContact O-N 2.95Å; K169-R172 WeakPolarHBondContact O-CB 3.43Å; K169-R172 PolarHBondContact O-N 3.41Å; K169-R172 VanDerWaalsContact O-N 3.14Å; K169-R173 WeakPolarHBondContact O-CG 3.46Å; K169-R173 PolarHBondContact O-N 3.13Å
170R88Confident81.9Confident155 Ų15561 Ų6159%0.58529%0.292SS*.Hα-helixtrans-57.2-47.2175-172.9172.3-174.1150.54.7113C166 R172 R173 S174C166-R170 PolarHBondContact O-N 3.34Å; R170-R172 VanDerWaalsContact C-N 3.33Å; R170-R172 PolarHBondContact O-N 3.38Å; R170-R173 PolarHBondContact O-N 3.08Å; R170-S174 PolarHBondContact O-N 2.98Å
171T90.6Very high83.9Confident10 Ų1064.6 Ų64.66%0.06130%0.297CS..Hα-helixtrans-63-41.5177.4-55.40000111.1L103 L135 A138 L167 N168 K169 S174 I175L103-T171 HydrophobicContact CD2-CG2 3.91Å; L135-T171 HydrophobicContact CD2-CG2 4.1Å; A138-T171 HydrophobicContact CB-CG2 3.85Å; A138-T171 WeakPolarHBondContact CB-OG1 3.41Å; L167-T171 WeakPolarHBondContact O-CB 3.39Å; L167-T171 PolarHBondContact O-N 3.31Å; L167-T171 PolarHBondContact O-OG1 2.89Å; N168-T171 PolarHBondContact O-N 3.31Å; K169-T171 PolarHBondContact O-N 2.95Å; T171-S174 PolarHBondContact O-N 3.37Å; T171-I175 HydrophobicContact CG2-CD1 3.99Å; T171-I175 VanDerWaalsContact O-CG1 3.32Å; T171-I175 WeakPolarHBondContact O-CG1 3.46Å; T171-I175 PolarHBondContact O-N 3.2Å
172R92.7Very high85.8Confident73 Ų7360 Ų6028%0.27527%0.273SS..Hα-helixtrans-61.8-51.2177-172.6-171.670.7-178.63.1111.5N168 K169 R170 S174 I175 Q176 L196 Y209N168-R172 VanDerWaalsContact O-CB 3.23Å; N168-R172 WeakPolarHBondContact O-CB 3.26Å; N168-R172 PolarHBondContact O-N 3.03Å; K169-R172 WeakPolarHBondContact O-CB 3.43Å; K169-R172 PolarHBondContact O-N 3.41Å; K169-R172 VanDerWaalsContact O-N 3.14Å; R170-R172 VanDerWaalsContact C-N 3.33Å; R170-R172 PolarHBondContact O-N 3.38Å; R172-S174 VanDerWaalsContact C-N 3.28Å; R172-S174 PolarHBondContact O-N 3.05Å; R172-I175 PolarHBondContact O-N 3.05Å; R172-I175 VanDerWaalsContact O-N 3.1Å; R172-Q176 WeakPolarHBondContact O-CG 3.48Å; R172-Q176 PolarHBondContact O-N 3.21Å; R172-Q176 PolarHBondContact O-OE1 3.05Å; R172-L196 HydrophobicContact CG-CD2 3.75Å; R172-Y209 HydrophobicContact CG-CE1 4.37Å; R172-Y209 PolarHBondContact NH1-OH 2.93Å
173R92.5Very high87.3Confident46 Ų4651.6 Ų51.617%0.17424%0.241CC..Hα-helixtrans-55.1-45.1176.6-67.5-168.9-135.3139.813110.6E53 E57 K169 R170 I175 Q176 K177E53-R173 IonicContact OE2-CZ 3.74Å; E53-R173 IonicContact OE2-NH1 2.93Å; E53-R173 PolarHBondContact OE2-NH1 3.47Å; E53-R173 IonicContact OE2-NH2 3.25Å; E53-R173 PolarHBondContact OE2-NH2 3.07Å; E57-R173 IonicContact OE1-CZ 3.99Å; E57-R173 IonicContact OE1-NE 3.42Å; E57-R173 IonicContact OE1-NH2 3.68Å; E57-R173 PolarHBondContact OE1-NH2 3.13Å; K169-R173 WeakPolarHBondContact O-CG 3.46Å; K169-R173 PolarHBondContact O-N 3.13Å; R170-R173 PolarHBondContact O-N 3.08Å; R173-I175 PolarHBondContact O-N 3.01Å; R173-Q176 PolarHBondContact O-N 3.18Å; R173-K177 WeakPolarHBondContact O-CG 3.45Å; R173-K177 PolarHBondContact O-N 3.33Å
174S94.5Very high88.9Confident58 Ų5853.6 Ų53.641%0.40625%0.249SC..Hα-helixtrans-61.6-41.7177.2-173.60000113.3C134 R170 T171 R172 L178C134-S174 PolarHBondContact SG-OG 3.19Å; C134-S174 VanDerWaalsContact SG-OG 3.38Å; R170-S174 PolarHBondContact O-N 2.98Å; T171-S174 PolarHBondContact O-N 3.37Å; R172-S174 VanDerWaalsContact C-N 3.28Å; R172-S174 PolarHBondContact O-N 3.05Å; S174-L178 WeakPolarHBondContact O-CB 3.05Å; S174-L178 PolarHBondContact O-N 2.84Å
175I96.1Very high90.3Very high0 Ų057.9 Ų57.90%027%0.265CS..Hα-helixtrans-68.4-41.2176.4-67.2166.1000111.1L103 V131 C134 L135 T171 R172 R173 L178 I179 L196L103-I175 HydrophobicContact CD2-CD1 4.32Å; V131-I175 HydrophobicContact CG1-CG1 4.4Å; V131-I175 HydrophobicContact CG1-CG2 3.91Å; C134-I175 HydrophobicContact CB-CG1 4.5Å; L135-I175 HydrophobicContact CD2-CD1 3.48Å; L135-I175 VanDerWaalsContact CD2-CD1 3.48Å; L135-I175 HydrophobicContact CG-CD1 3.8Å; T171-I175 HydrophobicContact CG2-CD1 3.99Å; T171-I175 VanDerWaalsContact O-CG1 3.32Å; T171-I175 WeakPolarHBondContact O-CG1 3.46Å; T171-I175 PolarHBondContact O-N 3.2Å; R172-I175 PolarHBondContact O-N 3.05Å; R172-I175 VanDerWaalsContact O-N 3.1Å; R173-I175 PolarHBondContact O-N 3.01Å; I175-L178 PolarHBondContact O-N 3.4Å; I175-I179 HydrophobicContact CG2-CD1 3.72Å; I175-I179 HydrophobicContact CG2-CG1 4.28Å; I175-I179 WeakPolarHBondContact O-CB 3.46Å; I175-I179 WeakPolarHBondContact O-CG1 3.29Å; I175-I179 PolarHBondContact O-N 3.03Å; I175-L196 HydrophobicContact CB-CD2 4.27Å; I175-L196 HydrophobicContact CG2-CD2 3.94Å
176Q96.6Very high91.6Very high78 Ų7855.7 Ų55.736%0.36425%0.254SS..Hα-helixtrans-60-50.2176.2-74.4167.7-61.900110.9R172 R173 L178 I179 E180 L196R172-Q176 WeakPolarHBondContact O-CG 3.48Å; R172-Q176 PolarHBondContact O-N 3.21Å; R172-Q176 PolarHBondContact O-OE1 3.05Å; R173-Q176 PolarHBondContact O-N 3.18Å; Q176-L178 VanDerWaalsContact C-N 3.29Å; Q176-L178 PolarHBondContact O-N 2.84Å; Q176-I179 PolarHBondContact O-N 3.09Å; Q176-I179 VanDerWaalsContact O-N 3.13Å; Q176-E180 PolarHBondContact O-N 2.93Å; Q176-L196 HydrophobicContact CG-CB 4.27Å; Q176-L196 HydrophobicContact CG-CD2 4.26Å
177K97.3Very high93.1Very high144 Ų14453.5 Ų53.563%0.62624%0.239SC*.Hα-helixtrans-57.4-40.5175.6-71.3-178.7179.5-179.40112R173 W181R173-K177 WeakPolarHBondContact O-CG 3.45Å; R173-K177 PolarHBondContact O-N 3.33Å; K177-W181 PolarHBondContact O-N 3.08Å; K177-W181 VanDerWaalsContact O-N 3.07Å
178L97.7Very high94.3Very high37 Ų3755.3 Ų55.319%0.19425%0.246CC..Hα-helixtrans-66.3-43.5175.9178.268.1000112.6R130 V131 S174 I175 Q176 E180 W181 E182R130-L178 HydrophobicContact CB-CD1 4.3Å; R130-L178 HydrophobicContact CB-CD2 3.9Å; V131-L178 HydrophobicContact CB-CD2 4.37Å; V131-L178 HydrophobicContact CG2-CD2 3.82Å; S174-L178 WeakPolarHBondContact O-CB 3.05Å; S174-L178 PolarHBondContact O-N 2.84Å; I175-L178 PolarHBondContact O-N 3.4Å; Q176-L178 VanDerWaalsContact C-N 3.29Å; Q176-L178 PolarHBondContact O-N 2.84Å; L178-E180 VanDerWaalsContact C-N 3.33Å; L178-W181 PolarHBondContact O-N 3.38Å; L178-E182 WeakPolarHBondContact O-CG 3.37Å; L178-E182 PolarHBondContact O-N 2.87Å
179I98Very high95Very high5 Ų562.3 Ų62.33%0.02628%0.276CS..Hα-helixtrans-62-44.2177.5-77.2171.7000110.1V131 I175 Q176 W181 E182 N183 W194 L196 I211V131-I179 HydrophobicContact CG2-CG1 4.39Å; I175-I179 HydrophobicContact CG2-CD1 3.72Å; I175-I179 HydrophobicContact CG2-CG1 4.28Å; I175-I179 WeakPolarHBondContact O-CB 3.46Å; I175-I179 WeakPolarHBondContact O-CG1 3.29Å; I175-I179 PolarHBondContact O-N 3.03Å; Q176-I179 PolarHBondContact O-N 3.09Å; Q176-I179 VanDerWaalsContact O-N 3.13Å; I179-W181 VanDerWaalsContact C-N 3.3Å; I179-W181 PolarHBondContact O-N 2.67Å; I179-E182 WeakPolarHBondContact O-CB 3.23Å; I179-E182 PolarHBondContact O-N 2.93Å; I179-E182 VanDerWaalsContact O-N 3.14Å; I179-N183 WeakPolarHBondContact O-CB 3.4Å; I179-N183 PolarHBondContact O-N 3.07Å; I179-W194 HydrophobicContact CG2-CB 3.61Å; I179-W194 WeakPolarHBondContact CG2-O 3.11Å; I179-L196 HydrophobicContact CD1-CB 3.95Å; I179-I211 HydrophobicContact CD1-CG1 4.33Å
180E97.8Very high95.5Very high82 Ų8262.7 Ų62.738%0.38328%0.28SS..Hα-helixtrans-62.1-40.8178.3-173.551-140.900111.8Q176 L178 E182 N183 N184Q176-E180 PolarHBondContact O-N 2.93Å; L178-E180 VanDerWaalsContact C-N 3.33Å; E180-E182 PolarHBondContact O-N 3.19Å; E180-N183 WeakPolarHBondContact O-CB 3.47Å; E180-N183 PolarHBondContact O-N 3.37Å; E180-N184 PolarHBondContact O-N 2.91Å; E180-N184 PolarHBondContact O-ND2 2.95Å; E180-N184 PolarHBondContact OE1-ND2 3.06Å
181W97.7Very high95.7Very high130 Ų13056 Ų5649%0.49226%0.258SS..Hα-helixtrans-62.5-42.7173.1-178.888.4000112.9K177 L178 I179 N183 R185K177-W181 PolarHBondContact O-N 3.08Å; K177-W181 VanDerWaalsContact O-N 3.07Å; L178-W181 PolarHBondContact O-N 3.38Å; I179-W181 VanDerWaalsContact C-N 3.3Å; I179-W181 PolarHBondContact O-N 2.67Å; W181-N183 VanDerWaalsContact C-N 3.35Å; W181-R185 WeakPolarHBondContact O-CB 3.44Å; W181-R185 PolarHBondContact O-N 3.38Å
182E97.9Very high96Very high2 Ų255.6 Ų55.61%0.00926%0.256CS..Hα-helixtrans-63-40.3174.8-74.1-72.6165.200112S127 R130 L178 I179 E180 R185 L186 Y187S127-E182 WeakPolarHBondContact CB-OE2 3.23Å; S127-E182 VanDerWaalsContact OG-CD 3.31Å; S127-E182 PolarHBondContact OG-OE2 2.93Å; R130-E182 WeakPolarHBondContact CD-OE1 3.36Å; R130-E182 IonicContact CZ-OE1 3.4Å; R130-E182 IonicContact NE-OE1 2.87Å; R130-E182 IonicContact NH1-OE1 2.6Å; R130-E182 PolarHBondContact NH1-OE1 2.92Å; R130-E182 IonicContact NH1-OE2 2.67Å; L178-E182 WeakPolarHBondContact O-CG 3.37Å; L178-E182 PolarHBondContact O-N 2.87Å; I179-E182 WeakPolarHBondContact O-CB 3.23Å; I179-E182 PolarHBondContact O-N 2.93Å; I179-E182 VanDerWaalsContact O-N 3.14Å; E180-E182 PolarHBondContact O-N 3.19Å; E182-R185 PolarHBondContact O-N 3.47Å; E182-L186 PolarHBondContact O-N 3.36Å; E182-Y187 HydrophobicContact CB-CD2 4.16Å; E182-Y187 HydrophobicContact CB-CE2 4.16Å; E182-Y187 PolarHBondContact O-N 2.9Å
183N97.6Very high96.1Very high0 Ų054 Ų540%025%0.251CS..Hα-helixtrans-58.1-54.3176.6-79.4-21.7000111.3I179 E180 W181 R185 L186 Y187 H188 H193 W194I179-N183 WeakPolarHBondContact O-CB 3.4Å; I179-N183 PolarHBondContact O-N 3.07Å; E180-N183 WeakPolarHBondContact O-CB 3.47Å; E180-N183 PolarHBondContact O-N 3.37Å; W181-N183 VanDerWaalsContact C-N 3.35Å; N183-R185 VanDerWaalsContact C-N 3.35Å; N183-R185 PolarHBondContact O-N 2.81Å; N183-L186 PolarHBondContact O-N 3.49Å; N183-Y187 PolarHBondContact O-N 3.29Å; N183-Y187 VanDerWaalsContact O-N 3.13Å; N183-H188 WeakPolarHBondContact O-CB 3.45Å; N183-H188 PolarHBondContact O-N 3.46Å; N183-H193 PolarHBondContact ND2-CD2 2.91Å; N183-H193 VanDerWaalsContact ND2-CD2 3.25Å; N183-H193 PolarHBondContact ND2-NE2 2.9Å; N183-W194 PolarHBondContact ND2-O 2.87Å; N183-W194 WeakPolarHBondContact OD1-CB 3.42Å; N183-W194 PolarHBondContact OD1-N 3.09Å
184N97.5Very high96.4Very high90 Ų9051.9 Ų51.948%0.48124%0.243SC..Hα-helixtrans-66.8-36.1-180-71.2-36.6000112.9E180 H188E180-N184 PolarHBondContact O-N 2.91Å; E180-N184 PolarHBondContact O-ND2 2.95Å; E180-N184 PolarHBondContact OE1-ND2 3.06Å; N184-H188 PolarHBondContact OD1-CE1 3.02Å; N184-H188 PolarHBondContact OD1-ND1 2.84Å
185R96.7Very high96.5Very high94 Ų9454.4 Ų54.436%0.35525%0.247SC..Hα-helixtrans-66.3-46.8177.6176.6-175.7158.5175.1-2.6112.1R130 W181 E182 N183 K189R130-R185 VanDerWaalsContact NH2-NH1 3.18Å; W181-R185 WeakPolarHBondContact O-CB 3.44Å; W181-R185 PolarHBondContact O-N 3.38Å; E182-R185 PolarHBondContact O-N 3.47Å; N183-R185 VanDerWaalsContact C-N 3.35Å; N183-R185 PolarHBondContact O-N 2.81Å; R185-K189 WeakPolarHBondContact O-CE 3.38Å; R185-K189 PolarHBondContact O-NZ 3.12Å
186L96.2Very high96.5Very high34 Ų3455 Ų5518%0.17825%0.25CC..THydrogen-bonded Turntrans-135.1-58.3-166178.663.5000113.8E123 E182 N183 H188 K189 L190E123-L186 HydrophobicContact CB-CD2 3.84Å; E123-L186 HydrophobicContact CG-CD2 4.18Å; E182-L186 PolarHBondContact O-N 3.36Å; N183-L186 PolarHBondContact O-N 3.49Å; L186-H188 PolarHBondContact O-N 2.83Å; L186-K189 WeakPolarHBondContact O-CB 3.47Å; L186-K189 PolarHBondContact O-N 3Å; L186-K189 VanDerWaalsContact O-N 3.07Å; L186-L190 HydrophobicContact CD1-CD1 3.94Å; L186-L190 HydrophobicContact CD1-CG 4.3Å; L186-L190 HydrophobicContact CG-CD1 3.97Å; L186-L190 PolarHBondContact O-N 3.24Å
187Y96.7Very high96.4Very high0 Ų052.6 Ų52.60%024%0.241CC..G310 helixtrans-67.6-34.5-162.3-68.5-81.7000113.5V119 S127 E182 N183 K189 L190 A191 L192 W194V119-Y187 HydrophobicContact CB-CE1 4.44Å; V119-Y187 HydrophobicContact CG2-CE1 3.94Å; S127-Y187 WeakPolarHBondContact CB-OH 3.35Å; S127-Y187 WeakPolarHBondContact OG-CE2 3.33Å; S127-Y187 PolarHBondContact OG-OH 3.26Å; E182-Y187 HydrophobicContact CB-CD2 4.16Å; E182-Y187 HydrophobicContact CB-CE2 4.16Å; E182-Y187 PolarHBondContact O-N 2.9Å; N183-Y187 PolarHBondContact O-N 3.29Å; N183-Y187 VanDerWaalsContact O-N 3.13Å; Y187-K189 VanDerWaalsContact C-N 3.26Å; Y187-K189 PolarHBondContact O-N 3.02Å; Y187-L190 CarbonylContact O-C 3.5Å; Y187-L190 WeakPolarHBondContact O-CA 3.42Å; Y187-L190 WeakPolarHBondContact O-CB 3.5Å; Y187-L190 PolarHBondContact O-N 3.31Å; Y187-A191 PolarHBondContact O-N 2.74Å; Y187-A191 VanDerWaalsContact O-N 3.15Å; Y187-L192 CarbonylContact C-O 3.52Å; Y187-L192 WeakPolarHBondContact CB-O 3.5Å; Y187-L192 HydrophobicContact CD1-CB 3.99Å; Y187-L192 HydrophobicContact CD1-CD1 3.95Å; Y187-L192 HydrophobicContact CG-CB 4.48Å; Y187-L192 PolarHBondContact O-N 3.38Å; Y187-W194 AromaticContact CD1-CD1 3.76Å; Y187-W194 AromaticContact CD1-NE1 3.23Å; Y187-W194 HydrophobicContact CD2-CG 4.49Å; Y187-W194 AromaticContact CD2-NE1 3.9Å; Y187-W194 AromaticContact CE1-CE2 3.61Å; Y187-W194 AromaticContact CE1-CZ2 3.74Å; Y187-W194 HydrophobicContact CE1-CZ2 3.74Å; Y187-W194 AromaticContact CE1-NE1 3.13Å; Y187-W194 HydrophobicContact CE2-CD2 4.35Å; Y187-W194 AromaticContact CE2-CE2 3.83Å; Y187-W194 HydrophobicContact CE2-CZ2 4.03Å; Y187-W194 AromaticContact CE2-NE1 3.83Å; Y187-W194 AromaticContact CG-CD1 3.74Å; Y187-W194 AromaticContact CG-NE1 3.63Å; Y187-W194 AromaticContact CZ-CE2 3.47Å; Y187-W194 VanDerWaalsContact CZ-CE2 3.47Å; Y187-W194 AromaticContact CZ-CZ2 3.37Å; Y187-W194 AromaticContact CZ-NE1 3.47Å; Y187-W194 WeakPolarHBondContact OH-CZ2 3.42Å
188H95.4Very high96.1Very high66 Ų6651 Ų5131%0.30623%0.234SC..G310 helixtrans-60.1-36.3173.9-71.9169000112.4N183 N184 L186 L190 A191 L192 H193N183-H188 WeakPolarHBondContact O-CB 3.45Å; N183-H188 PolarHBondContact O-N 3.46Å; N184-H188 PolarHBondContact OD1-CE1 3.02Å; N184-H188 PolarHBondContact OD1-ND1 2.84Å; L186-H188 PolarHBondContact O-N 2.83Å; H188-L190 PolarHBondContact O-N 3.25Å; H188-A191 PolarHBondContact O-N 3.02Å; H188-L192 PolarHBondContact N-O 3.02Å; H188-H193 AromaticContact NE2-CD2 3.34Å; H188-H193 PolarHBondContact NE2-CD2 3.44Å; H188-H193 VanDerWaalsContact NE2-CD2 3.34Å
189K93.8Very high95.8Very high159 Ų15955.1 Ų55.169%0.69125%0.247SC*.G310 helixtrans-67.1-23.2175.3-58170.5-176.6163.40112.2R185 L186 Y187R185-K189 WeakPolarHBondContact O-CE 3.38Å; R185-K189 PolarHBondContact O-NZ 3.12Å; L186-K189 WeakPolarHBondContact O-CB 3.47Å; L186-K189 PolarHBondContact O-N 3Å; L186-K189 VanDerWaalsContact O-N 3.07Å; Y187-K189 VanDerWaalsContact C-N 3.26Å; Y187-K189 PolarHBondContact O-N 3.02Å
190L94Very high95.4Very high53 Ų5360.8 Ų60.828%0.27727%0.271SS..G310 helixtrans-92.80.1176.4-56.2179.1000112.9V119 L186 Y187 H188 L192V119-L190 HydrophobicContact CB-CD1 3.82Å; V119-L190 HydrophobicContact CG2-CD1 3.87Å; L186-L190 HydrophobicContact CD1-CD1 3.94Å; L186-L190 HydrophobicContact CD1-CG 4.3Å; L186-L190 HydrophobicContact CG-CD1 3.97Å; L186-L190 PolarHBondContact O-N 3.24Å; Y187-L190 CarbonylContact O-C 3.5Å; Y187-L190 WeakPolarHBondContact O-CA 3.42Å; Y187-L190 WeakPolarHBondContact O-CB 3.5Å; Y187-L190 PolarHBondContact O-N 3.31Å; H188-L190 PolarHBondContact O-N 3.25Å; L190-L192 VanDerWaalsContact C-N 3.29Å; L190-L192 HydrophobicContact CB-CD1 4.18Å; L190-L192 HydrophobicContact CB-CG 4.28Å
191A93.5Very high94.8Very high15 Ų1557.8 Ų57.812%0.12426%0.259CS..THydrogen-bonded Turntrans56.942.3-168.900000112.9Y187 H188 L216 K218Y187-A191 PolarHBondContact O-N 2.74Å; Y187-A191 VanDerWaalsContact O-N 3.15Å; H188-A191 PolarHBondContact O-N 3.02Å; A191-L216 HydrophobicContact CB-CB 4.15Å; A191-L216 PolarHBondContact O-N 3.36Å; A191-K218 HydrophobicContact CB-CD 4.33Å; A191-K218 HydrophobicContact CB-CG 4.1Å
192L95.1Very high94Very high1 Ų158.6 Ų58.61%0.00527%0.269CS..EExtended strand (participates in β ladder)trans-120.9148.3172.1-64173.3000108.5L115 K118 V119 Y187 H188 L190 I213 E214 F215L115-L192 HydrophobicContact CD2-CD1 4.33Å; L115-L192 HydrophobicContact CD2-CD2 4.24Å; K118-L192 HydrophobicContact CB-CD1 4.35Å; V119-L192 HydrophobicContact CB-CD1 4.33Å; V119-L192 HydrophobicContact CG1-CD1 4.33Å; Y187-L192 CarbonylContact C-O 3.52Å; Y187-L192 WeakPolarHBondContact CB-O 3.5Å; Y187-L192 HydrophobicContact CD1-CB 3.99Å; Y187-L192 HydrophobicContact CD1-CD1 3.95Å; Y187-L192 HydrophobicContact CG-CB 4.48Å; Y187-L192 PolarHBondContact O-N 3.38Å; H188-L192 PolarHBondContact N-O 3.02Å; L190-L192 VanDerWaalsContact C-N 3.29Å; L190-L192 HydrophobicContact CB-CD1 4.18Å; L190-L192 HydrophobicContact CB-CG 4.28Å; L192-I213 HydrophobicContact CB-CG2 4.33Å; L192-I213 HydrophobicContact CD2-CG2 4.19Å; L192-E214 CarbonylContact C-O 3.49Å; L192-E214 VanDerWaalsContact CA-O 3.3Å; L192-E214 WeakPolarHBondContact CA-O 3.47Å; L192-F215 HydrophobicContact CD2-CD1 3.55Å; L192-F215 HydrophobicContact CD2-CE1 3.6Å; L192-F215 HydrophobicContact CD2-CG 4.31Å; L192-F215 HydrophobicContact CD2-CZ 4.38Å
193H96Very high93.1Very high40 Ų4064.9 Ų64.919%0.18531%0.307CS..EExtended strand (participates in β ladder)trans-135.5120.3176.4175.6-112.5000109.3N183 H188 I213 E214 L216N183-H193 PolarHBondContact ND2-CD2 2.91Å; N183-H193 VanDerWaalsContact ND2-CD2 3.25Å; N183-H193 PolarHBondContact ND2-NE2 2.9Å; H188-H193 AromaticContact NE2-CD2 3.34Å; H188-H193 PolarHBondContact NE2-CD2 3.44Å; H188-H193 VanDerWaalsContact NE2-CD2 3.34Å; H193-I213 CarbonylContact O-C 3.56Å; H193-I213 WeakPolarHBondContact O-CA 3.41Å; H193-E214 HydrophobicContact CB-CB 4.43Å; H193-E214 PolarHBondContact N-O 3.04Å; H193-E214 IonicContact ND1-OE2 2.62Å; H193-E214 PolarHBondContact ND1-OE2 3.36Å; H193-E214 PolarHBondContact O-N 3.01Å; H193-L216 HydrophobicContact CB-CD1 4.32Å; H193-L216 HydrophobicContact CB-CD2 3.92Å; H193-L216 HydrophobicContact CB-CG 4.05Å
194W97.7Very high92.1Very high2 Ų266.8 Ų66.81%0.00832%0.321CS..EExtended strand (participates in β ladder)trans-90.8137.3175.5-74.440.1000109.4F124 I128 I179 N183 Y187 I211 L212 I213F124-W194 AromaticContact CD2-CH2 3.77Å; F124-W194 HydrophobicContact CD2-CH2 3.77Å; F124-W194 AromaticContact CD2-CZ2 3.51Å; F124-W194 HydrophobicContact CD2-CZ2 3.51Å; F124-W194 AromaticContact CE2-CH2 3.64Å; F124-W194 HydrophobicContact CE2-CH2 3.64Å; F124-W194 AromaticContact CE2-CZ2 3.63Å; F124-W194 HydrophobicContact CE2-CZ2 3.63Å; F124-W194 HydrophobicContact CZ-CH2 4.46Å; I128-W194 HydrophobicContact CB-CH2 4.34Å; I128-W194 HydrophobicContact CD1-CH2 4.47Å; I128-W194 HydrophobicContact CD1-CZ3 4.05Å; I179-W194 HydrophobicContact CG2-CB 3.61Å; I179-W194 WeakPolarHBondContact CG2-O 3.11Å; N183-W194 PolarHBondContact ND2-O 2.87Å; N183-W194 WeakPolarHBondContact OD1-CB 3.42Å; N183-W194 PolarHBondContact OD1-N 3.09Å; Y187-W194 AromaticContact CD1-CD1 3.76Å; Y187-W194 AromaticContact CD1-NE1 3.23Å; Y187-W194 HydrophobicContact CD2-CG 4.49Å; Y187-W194 AromaticContact CD2-NE1 3.9Å; Y187-W194 AromaticContact CE1-CE2 3.61Å; Y187-W194 AromaticContact CE1-CZ2 3.74Å; Y187-W194 HydrophobicContact CE1-CZ2 3.74Å; Y187-W194 AromaticContact CE1-NE1 3.13Å; Y187-W194 HydrophobicContact CE2-CD2 4.35Å; Y187-W194 AromaticContact CE2-CE2 3.83Å; Y187-W194 HydrophobicContact CE2-CZ2 4.03Å; Y187-W194 AromaticContact CE2-NE1 3.83Å; Y187-W194 AromaticContact CG-CD1 3.74Å; Y187-W194 AromaticContact CG-NE1 3.63Å; Y187-W194 AromaticContact CZ-CE2 3.47Å; Y187-W194 VanDerWaalsContact CZ-CE2 3.47Å; Y187-W194 AromaticContact CZ-CZ2 3.37Å; Y187-W194 AromaticContact CZ-NE1 3.47Å; Y187-W194 WeakPolarHBondContact OH-CZ2 3.42Å; W194-I211 HydrophobicContact CD2-CG2 4.14Å; W194-I211 HydrophobicContact CE3-CG2 3.64Å; W194-I211 HydrophobicContact CZ3-CG2 4.2Å; W194-L212 CarbonylContact C-O 3.54Å; W194-L212 VanDerWaalsContact CA-O 3.3Å; W194-L212 WeakPolarHBondContact CA-O 3.47Å; W194-I213 HydrophobicContact CD2-CD1 4.2Å; W194-I213 HydrophobicContact CD2-CG1 4.03Å; W194-I213 HydrophobicContact CG-CG1 4Å; W194-I213 HydrophobicContact CH2-CD1 4.48Å; W194-I213 HydrophobicContact CZ2-CD1 3.72Å; W194-I213 HydrophobicContact CZ2-CG1 4.45Å
195K96.4Very high91.3Very high110 Ų11069.2 Ų69.248%0.47833%0.333SS..EExtended strand (participates in β ladder)trans-139.1134.9175-177.3169-178168.20110I211 L212K195-I211 WeakPolarHBondContact O-CA 3.34Å; K195-L212 PolarHBondContact N-O 3.14Å; K195-L212 PolarHBondContact O-N 3.08Å
196L96.6Very high90.7Very high12 Ų1271.5 Ų71.56%0.06335%0.35CS..EExtended strand (participates in β ladder)trans-81121.7165.6-173.667.5000108.1F107 R172 I175 Q176 I179 Y209 I211F107-L196 HydrophobicContact CZ-CD1 3.93Å; R172-L196 HydrophobicContact CG-CD2 3.75Å; I175-L196 HydrophobicContact CB-CD2 4.27Å; I175-L196 HydrophobicContact CG2-CD2 3.94Å; Q176-L196 HydrophobicContact CG-CB 4.27Å; Q176-L196 HydrophobicContact CG-CD2 4.26Å; I179-L196 HydrophobicContact CD1-CB 3.95Å; L196-Y209 HydrophobicContact CD2-CD1 4.43Å; L196-Y209 HydrophobicContact CG-CD1 4.16Å; L196-I211 HydrophobicContact CD1-CG1 4.09Å
197T94.1Very high90.4Very high29 Ų2973.9 Ų73.918%0.17836%0.361CS..EExtended strand (participates in β ladder)trans-133.7147.6-176.7-175.30000111.2R199 Y209 V210 L212T197-R199 HydrophobicContact CG2-CG 3.96Å; T197-Y209 WeakPolarHBondContact O-CA 3.43Å; T197-V210 HydrophobicContact CG2-CG2 3.62Å; T197-V210 PolarHBondContact N-O 3.29Å; T197-V210 PolarHBondContact O-N 3.09Å; T197-L212 HydrophobicContact CG2-CB 3.94Å
198K92.5Very high90.2Very high109 Ų10975.5 Ų75.547%0.47437%0.369SS..EExtended strand (participates in β ladder)trans-90.8121.4174.6-161-177.1-177.4178.80108.6M207 E208 Y209K198-M207 HydrophobicContact CD-CB 4.37Å; K198-M207 HydrophobicContact CD-CE 4.25Å; K198-M207 HydrophobicContact CG-CB 4.12Å; K198-M207 HydrophobicContact CG-CE 3.9Å; K198-E208 CarbonylContact C-O 3.58Å; K198-E208 WeakPolarHBondContact CA-O 3.42Å; K198-Y209 HydrophobicContact CB-CD1 4.13Å; K198-Y209 HydrophobicContact CB-CE1 3.89Å; K198-Y209 HydrophobicContact CG-CD1 4.48Å; K198-Y209 HydrophobicContact CG-CE1 4.21Å; K198-Y209 HydrophobicContact CG-CE2 4.46Å
199R91.3Very high90.2Very high125 Ų12573.5 Ų73.547%0.47236%0.359SS..EExtended strand (participates in β ladder)trans-129.3157.3-178.6-71.4-81.1-176151.6-0.3109.9T197 M207 E208 V210T197-R199 HydrophobicContact CG2-CG 3.96Å; R199-M207 CarbonylContact O-C 3Å; R199-M207 WeakPolarHBondContact O-CA 3.47Å; R199-E208 PolarHBondContact N-O 3.1Å; R199-E208 PolarHBondContact O-N 2.87Å; R199-E208 VanDerWaalsContact O-O 3.13Å; R199-V210 HydrophobicContact CB-CG2 4.01Å; R199-V210 HydrophobicContact CG-CG2 3.68Å
200K89.5Confident90.2Very high123 Ų12366 Ų6654%0.53533%0.326SS..EExtended strand (participates in β ladder)trans-74.3130.4170.5-169.2175.5179.5179.90108.9N205 M207K200-N205 WeakPolarHBondContact CE-OD1 3.35Å; K200-N205 PolarHBondContact NZ-OD1 3.27Å; K200-M207 HydrophobicContact CB-SD 4.02Å; K200-M207 HydrophobicContact CG-SD 4.47Å
201C84.5Confident90.4Very high19 Ų1963.4 Ų63.413%0.12831%0.313CS..  trans-63.2143.4175.5-168.80000109.8T203 S204 M206 E208C201-T203 PolarHBondContact SG-OG1 3.15Å; C201-T203 VanDerWaalsContact SG-OG1 3.4Å; C201-S204 CarbonylContact C-O 3.58Å; C201-S204 WeakPolarHBondContact CB-OG 3.35Å; C201-M206 VanDerWaalsContact CB-O 3.31Å; C201-M206 WeakPolarHBondContact CB-O 3.44Å; C201-M206 PolarHBondContact N-O 3.39Å; C201-E208 HydrophobicContact CB-CG 4.04Å; C201-E208 PolarHBondContact SG-OE2 3.25Å; C201-E208 VanDerWaalsContact SG-OE2 3.32Å
202E80.6Confident90.5Very high148 Ų14863 Ų6369%0.69231%0.308SS*.SBendtrans-74.1-32.2179.4-76.5171-173.100112.3R93R93-E202 IonicContact CZ-OE1 3.39Å; R93-E202 IonicContact CZ-OE2 3.63Å; R93-E202 IonicContact NH1-OE1 3.91Å; R93-E202 IonicContact NH1-OE2 3.59Å; R93-E202 PolarHBondContact NH1-OE2 2.6Å; R93-E202 IonicContact NH2-OE1 3.85Å; R93-E202 PolarHBondContact NH2-OE1 3.48Å; R93-E202 IonicContact NH2-OE2 2.88Å; R93-E202 PolarHBondContact NH2-OE2 3.2Å
203T79.6Confident90.6Very high133 Ų13363 Ų6382%0.81631%0.308SS*.SBendtrans-95-11.3-17455.90000113.2C201C201-T203 PolarHBondContact SG-OG1 3.15Å; C201-T203 VanDerWaalsContact SG-OG1 3.4Å
204S77.6Confident90.5Very high41 Ų4164.4 Ų64.429%0.28732%0.315SS..SBendtrans-143.2155.9178.873.30000110.6C201 M206C201-S204 CarbonylContact C-O 3.58Å; C201-S204 WeakPolarHBondContact CB-OG 3.35Å; S204-M206 PolarHBondContact O-N 3.32Å; S204-M206 VanDerWaalsContact O-N 3.09Å; S204-M206 PolarHBondContact OG-N 3.02Å
205N78.9Confident90.3Very high140 Ų14065.6 Ų65.675%0.74932%0.32SS*.SBendtrans-747.6173.6-74.2-52.3000113.5K200K200-N205 WeakPolarHBondContact CE-OD1 3.35Å; K200-N205 PolarHBondContact NZ-OD1 3.27Å
206M85.3Confident89.9Confident142 Ų14263.5 Ų63.570%0.731%0.314SS*.SBendtrans-80.6152.1-179.3-56.6-175.8-169.300110.9C201 S204C201-M206 VanDerWaalsContact CB-O 3.31Å; C201-M206 WeakPolarHBondContact CB-O 3.44Å; C201-M206 PolarHBondContact N-O 3.39Å; S204-M206 PolarHBondContact O-N 3.32Å; S204-M206 VanDerWaalsContact O-N 3.09Å; S204-M206 PolarHBondContact OG-N 3.02Å
207M89.4Confident89Confident84 Ų8465.2 Ų65.241%0.41433%0.326SS..EExtended strand (participates in β ladder)trans-83.9138.6170.5-62-63.2-72.100109.7G102 K198 R199 K200G102-M207 WeakPolarHBondContact CA-O 3.48Å; K198-M207 HydrophobicContact CD-CB 4.37Å; K198-M207 HydrophobicContact CD-CE 4.25Å; K198-M207 HydrophobicContact CG-CB 4.12Å; K198-M207 HydrophobicContact CG-CE 3.9Å; R199-M207 CarbonylContact O-C 3Å; R199-M207 WeakPolarHBondContact O-CA 3.47Å; K200-M207 HydrophobicContact CB-SD 4.02Å; K200-M207 HydrophobicContact CG-SD 4.47Å
208E92.9Very high87.6Confident34 Ų3471 Ų7116%0.15935%0.349CS..EExtended strand (participates in β ladder)trans-127.1145.3176.659.4175.1-161.900111R93 G102 K198 R199 C201 V210R93-E208 IonicContact NE-OE1 3.63Å; R93-E208 PolarHBondContact NE-OE1 3.42Å; G102-E208 CarbonylContact O-C 3.52Å; G102-E208 WeakPolarHBondContact O-CA 3.27Å; K198-E208 CarbonylContact C-O 3.58Å; K198-E208 WeakPolarHBondContact CA-O 3.42Å; R199-E208 PolarHBondContact N-O 3.1Å; R199-E208 PolarHBondContact O-N 2.87Å; R199-E208 VanDerWaalsContact O-O 3.13Å; C201-E208 HydrophobicContact CB-CG 4.04Å; C201-E208 PolarHBondContact SG-OE2 3.25Å; C201-E208 VanDerWaalsContact SG-OE2 3.32Å; E208-V210 HydrophobicContact CG-CG1 3.91Å
209Y94.4Very high86Confident25 Ų2574.1 Ų74.110%0.09836%0.358CS..EExtended strand (participates in β ladder)trans-85.8128.5167.6-75.3-82.9000109.4G102 L103 F107 R172 L196 T197 K198G102-Y209 PolarHBondContact O-N 3.4Å; L103-Y209 HydrophobicContact CB-CD2 4.02Å; L103-Y209 HydrophobicContact CD1-CD2 4.41Å; L103-Y209 HydrophobicContact CD1-CG 4.25Å; F107-Y209 WeakPolarHBondContact CE1-O 3.41Å; R172-Y209 HydrophobicContact CG-CE1 4.37Å; R172-Y209 PolarHBondContact NH1-OH 2.93Å; L196-Y209 HydrophobicContact CD2-CD1 4.43Å; L196-Y209 HydrophobicContact CG-CD1 4.16Å; T197-Y209 WeakPolarHBondContact O-CA 3.43Å; K198-Y209 HydrophobicContact CB-CD1 4.13Å; K198-Y209 HydrophobicContact CB-CE1 3.89Å; K198-Y209 HydrophobicContact CG-CD1 4.48Å; K198-Y209 HydrophobicContact CG-CE1 4.21Å; K198-Y209 HydrophobicContact CG-CE2 4.46Å
210V95.4Very high84.5Confident0 Ų073 Ų730%037%0.368CS..EExtended strand (participates in β ladder)trans-130.2150.4-179.1-63.80000109.4L91 R93 T197 R199 E208L91-V210 HydrophobicContact CD1-CB 4.1Å; L91-V210 HydrophobicContact CD1-CG2 3.65Å; L91-V210 HydrophobicContact CG-CB 4.36Å; L91-V210 HydrophobicContact CG-CG2 4.42Å; R93-V210 HydrophobicContact CG-CG1 4.13Å; T197-V210 HydrophobicContact CG2-CG2 3.62Å; T197-V210 PolarHBondContact N-O 3.29Å; T197-V210 PolarHBondContact O-N 3.09Å; R199-V210 HydrophobicContact CB-CG2 4.01Å; R199-V210 HydrophobicContact CG-CG2 3.68Å; E208-V210 HydrophobicContact CG-CG1 3.91Å
211I97.2Very high83Confident0 Ų074.8 Ų74.80%038%0.381CS..EExtended strand (participates in β ladder)trans-91120.6171.8-64.2167.9000107.2V92 F107 I128 V131 I179 W194 K195 L196 I213V92-I211 HydrophobicContact CB-CB 4.15Å; V92-I211 PolarHBondContact N-O 3.44Å; V92-I211 PolarHBondContact O-N 3.49Å; F107-I211 HydrophobicContact CB-CD1 4.46Å; F107-I211 HydrophobicContact CD1-CD1 4.13Å; F107-I211 HydrophobicContact CD1-CG1 4.31Å; F107-I211 HydrophobicContact CD2-CD1 3.68Å; F107-I211 HydrophobicContact CD2-CG1 4.42Å; F107-I211 HydrophobicContact CE1-CD1 4.33Å; F107-I211 HydrophobicContact CE1-CG1 4.12Å; F107-I211 HydrophobicContact CE2-CD1 3.86Å; F107-I211 HydrophobicContact CE2-CG1 4.2Å; F107-I211 HydrophobicContact CG-CD1 3.82Å; F107-I211 HydrophobicContact CG-CG1 4.47Å; F107-I211 HydrophobicContact CZ-CD1 4.2Å; F107-I211 HydrophobicContact CZ-CG1 4.06Å; I128-I211 HydrophobicContact CD1-CD1 3.53Å; V131-I211 HydrophobicContact CG1-CD1 4.16Å; I179-I211 HydrophobicContact CD1-CG1 4.33Å; W194-I211 HydrophobicContact CD2-CG2 4.14Å; W194-I211 HydrophobicContact CE3-CG2 3.64Å; W194-I211 HydrophobicContact CZ3-CG2 4.2Å; K195-I211 WeakPolarHBondContact O-CA 3.34Å; L196-I211 HydrophobicContact CD1-CG1 4.09Å; I211-I213 HydrophobicContact CG2-CG1 4.42Å
212L96.3Very high81.5Confident6 Ų683 Ų833%0.03142%0.415CS..EExtended strand (participates in β ladder)trans-99.9133.2176-163.471.4000108.8P89 L91 W194 K195 T197 E214P89-L212 HydrophobicContact CB-CD1 3.66Å; P89-L212 HydrophobicContact CB-CD2 4.13Å; P89-L212 HydrophobicContact CB-CG 3.75Å; P89-L212 HydrophobicContact CG-CD1 3.84Å; P89-L212 HydrophobicContact CG-CD2 4.28Å; P89-L212 HydrophobicContact CG-CG 4.26Å; L91-L212 HydrophobicContact CD1-CD1 3.7Å; W194-L212 CarbonylContact C-O 3.54Å; W194-L212 VanDerWaalsContact CA-O 3.3Å; W194-L212 WeakPolarHBondContact CA-O 3.47Å; K195-L212 PolarHBondContact N-O 3.14Å; K195-L212 PolarHBondContact O-N 3.08Å; T197-L212 HydrophobicContact CG2-CB 3.94Å; L212-E214 HydrophobicContact CD2-CG 3.87Å; L212-E214 WeakPolarHBondContact CD2-OE1 3.5Å; L212-E214 HydrophobicContact CG-CG 4.12Å
213I96.6Very high79.9Confident0 Ų086.5 Ų86.50%042%0.422CS..EExtended strand (participates in β ladder)trans-115.5105.4175.4-52.9172.5000107.6P89 V90 V92 L115 F124 L192 H193 W194 I211P89-I213 CarbonylContact C-O 3.55Å; P89-I213 WeakPolarHBondContact CA-O 3.2Å; V90-I213 HydrophobicContact CB-CB 4.18Å; V90-I213 PolarHBondContact N-O 2.9Å; V90-I213 PolarHBondContact O-N 3.18Å; V92-I213 HydrophobicContact CG2-CD1 3.98Å; L115-I213 HydrophobicContact CD1-CD1 3.78Å; L115-I213 HydrophobicContact CD2-CG2 4.23Å; F124-I213 HydrophobicContact CE2-CD1 3.93Å; L192-I213 HydrophobicContact CB-CG2 4.33Å; L192-I213 HydrophobicContact CD2-CG2 4.19Å; H193-I213 CarbonylContact O-C 3.56Å; H193-I213 WeakPolarHBondContact O-CA 3.41Å; W194-I213 HydrophobicContact CD2-CD1 4.2Å; W194-I213 HydrophobicContact CD2-CG1 4.03Å; W194-I213 HydrophobicContact CG-CG1 4Å; W194-I213 HydrophobicContact CH2-CD1 4.48Å; W194-I213 HydrophobicContact CZ2-CD1 3.72Å; W194-I213 HydrophobicContact CZ2-CG1 4.45Å; I211-I213 HydrophobicContact CG2-CG1 4.42Å
214E94.6Very high79Confident71 Ų7185.8 Ų85.833%0.33242%0.42SS..EExtended strand (participates in β ladder)trans-93.3148.9-177.9-62.4177.9152.600110.8P89 L192 H193 L212P89-E214 HydrophobicContact CB-CG 4.05Å; L192-E214 CarbonylContact C-O 3.49Å; L192-E214 VanDerWaalsContact CA-O 3.3Å; L192-E214 WeakPolarHBondContact CA-O 3.47Å; H193-E214 HydrophobicContact CB-CB 4.43Å; H193-E214 PolarHBondContact N-O 3.04Å; H193-E214 IonicContact ND1-OE2 2.62Å; H193-E214 PolarHBondContact ND1-OE2 3.36Å; H193-E214 PolarHBondContact O-N 3.01Å; L212-E214 HydrophobicContact CD2-CG 3.87Å; L212-E214 WeakPolarHBondContact CD2-OE1 3.5Å; L212-E214 HydrophobicContact CG-CG 4.12Å
215F92Very high77.8Confident26 Ų2695.1 Ų95.111%0.11447%0.466CS..EExtended strand (participates in β ladder)trans-93.8115.9174.6-65.6-88.4000109.2P87 D88 V90 V114 L115 L192P87-F215 HydrophobicContact CB-CD2 3.71Å; P87-F215 HydrophobicContact CB-CE2 3.94Å; P87-F215 HydrophobicContact CB-CG 4.15Å; P87-F215 HydrophobicContact CG-CB 4.31Å; P87-F215 HydrophobicContact CG-CD1 4.39Å; P87-F215 HydrophobicContact CG-CD2 4.09Å; P87-F215 HydrophobicContact CG-CG 4Å; D88-F215 WeakPolarHBondContact O-CE2 3.32Å; V90-F215 HydrophobicContact CG2-CE2 4.06Å; V90-F215 HydrophobicContact CG2-CZ 4.17Å; V114-F215 HydrophobicContact CG1-CZ 4.14Å; L115-F215 HydrophobicContact CD2-CE1 4.47Å; L115-F215 HydrophobicContact CD2-CZ 4.17Å; L192-F215 HydrophobicContact CD2-CD1 3.55Å; L192-F215 HydrophobicContact CD2-CE1 3.6Å; L192-F215 HydrophobicContact CD2-CG 4.31Å; L192-F215 HydrophobicContact CD2-CZ 4.38Å
216L88.6Confident77.7Confident66 Ų6692.9 Ų92.935%0.34645%0.452SS..PPolyproline II helixtrans-71.4128.3176.7-64.6175.5000109.3A191 H193 K218A191-L216 HydrophobicContact CB-CB 4.15Å; A191-L216 PolarHBondContact O-N 3.36Å; H193-L216 HydrophobicContact CB-CD1 4.32Å; H193-L216 HydrophobicContact CB-CD2 3.92Å; H193-L216 HydrophobicContact CB-CG 4.05Å; L216-K218 PolarHBondContact O-N 3.08Å
217P77.1Confident77.3Confident49 Ų4990.3 Ų90.332%0.31844%0.439SS..PPolyproline II helixtrans-63.4123.1-178.123.6-31.3000110.1L82L82-P217 HydrophobicContact CB-CB 3.93Å; L82-P217 HydrophobicContact CB-CG 4.27Å
218K65.6Low76.7Confident151 Ų15190.7 Ų90.766%0.65744%0.441SS*.PPolyproline II helixtrans-86.3124168.9-65.6-171.4-178.8-174.40108.2A191 L216 P220A191-K218 HydrophobicContact CB-CD 4.33Å; A191-K218 HydrophobicContact CB-CG 4.1Å; L216-K218 PolarHBondContact O-N 3.08Å; K218-P220 WeakPolarHBondContact O-CD 3.42Å; K218-P220 VanDerWaalsContact O-N 3.15Å
219Y59.7Low75.7Confident174 Ų17494 Ų9468%0.68246%0.457SS*.PPolyproline II helixtrans-53.3120.6171.5-74.9-85.5000109.6L82 I221L82-Y219 HydrophobicContact CD1-CD1 4.14Å; L82-Y219 HydrophobicContact CD1-CE1 3.67Å; Y219-I221 PolarHBondContact O-N 3.06Å; Y219-I221 VanDerWaalsContact O-N 3.09Å
220P57.8Low74.5Confident102 Ų10298.3 Ų98.366%0.66248%0.48SS*.  trans-69.4109.9173.626.4-30.4000108.4K218 F222K218-P220 WeakPolarHBondContact O-CD 3.42Å; K218-P220 VanDerWaalsContact O-N 3.15Å; P220-F222 PolarHBondContact O-N 3.05Å
221I58.5Low73.1Confident160 Ų160104.9 Ų104.982%0.82151%0.512SS*.  trans-74.1-10.7-178.8-47.4177.3000111.4Y219 R223Y219-I221 PolarHBondContact O-N 3.06Å; Y219-I221 VanDerWaalsContact O-N 3.09Å; I221-R223 PolarHBondContact O-N 3.09Å
222F52.7Low71.4Confident192 Ų192112.4 Ų112.484%0.84255%0.548SS*.  trans-10083.8-178.6-76.6-83.9000112.1P220P220-F222 PolarHBondContact O-N 3.05Å
223R47.6Very low69.5Low220 Ų220120.5 Ų120.583%0.8359%0.588SS**  trans-95.9112.9145.7-102.3-173.9178.1139.60.3107.2I221I221-R223 PolarHBondContact O-N 3.09Å
224P60.2Low67.2Low119 Ų119130.6 Ų130.677%0.77364%0.637SS**  trans-70.2132.4158.928.6-28000108.2
225D52.6Low64.8Low237 Ų237136 Ų136100%1.26767%0.665SS**  trans-58.20174.5-62.9-35.7000112.8

Retrieved 225 of 225 residues in 152.4 ms (Link to these results)