A0A096MI87_POEFO Loading...

Troponin T, slow skeletal muscle

Troponin T is the tropomyosin-binding subunit of troponin, the thin filament regulatory complex which confers calcium-sensitivity to striated muscle actomyosin ATPase activity.

AlphaFold DB , UniProt , Accession A0A096MI87, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 281 aa.

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Site Residue pLDDT pLDDT confidence pLDDT10 pLDDT10 confidence SASA SASA [Ų] SASA10 SASA10 [Ų] RSA RSA unformatted RSA10 RSA10 unformatted Surface Surface10 (not used) Disorder (not used) Disorder Sec. str. Secondary structure Isomer Phi (φ) Psi (ψ) Omega (ω) Chi 1 (χ1) Chi 2 (χ2) Chi 3 (χ3) Chi 4 (χ4) Chi 5 (χ5) Tau (τ) Contacts (colored by PAE) Contact details
1M40.5Very low41.5Very low234 Ų234164.5 Ų164.5100%1.15383%0.831SS**  085.50-65.1-169.9170.500105.5
2S41.8Very low41Very low107 Ų107158.9 Ų158.975%0.74883%0.828SS**  58.295.265.4720000112.5
3D40.7Very low40.5Very low160 Ų160155.8 Ų155.886%0.85682%0.82SS**  trans-172106.8146-101.4-8.6000103.9
4A48.2Very low40.5Very low84 Ų84157.9 Ų157.969%0.69482%0.823SS**  cis69.671.838.200000113.6
5E48.5Very low40.3Very low194 Ų194155.4 Ų155.491%0.90782%0.817SS**  trans-132.3101.2150.8-68-178.9160.600102.7
6E44.4Very low40.3Very low175 Ų175156.9 Ų156.982%0.81882%0.818SS**  cis60.7114.940.4-147.7165.8-144.800114.1
7E39.7Very low40.1Very low146 Ų146158.8 Ų158.868%0.68282%0.822SS**  trans74122.9163.3-112.2176.4-166.700115.9
8Y39.6Very low40.2Very low191 Ų191159.6 Ų159.675%0.74982%0.821SS**  cis-147.4124.645.7-94.1-105.3000111D10Y8-D10 PolarHBondContact O-N 3.1Å
9E40.7Very low40.1Very low197 Ų197157.7 Ų157.792%0.92182%0.82SS**  trans-80.4102.1165.7-158.9163.3-149.800106.6Q11E9-Q11 VanDerWaalsContact C-N 3.27Å; E9-Q11 PolarHBondContact O-N 2.99Å
10D36.9Very low40Very low158 Ų158159.5 Ų159.585%0.84582%0.824SS**  trans-77.485.7-178.7-148.78.7000109.1Y8 A12Y8-D10 PolarHBondContact O-N 3.1Å; D10-A12 PolarHBondContact O-N 3.25Å
11Q35.5Very low39.9Very low164 Ų164156.7 Ų156.777%0.76683%0.825SS**  trans12.996.3149.6-143.216165.100114.9E9 V13E9-Q11 VanDerWaalsContact C-N 3.27Å; E9-Q11 PolarHBondContact O-N 2.99Å; Q11-V13 PolarHBondContact O-N 2.98Å
12A36.2Very low39.9Very low97 Ų97153.7 Ų153.780%0.80281%0.808SS**  trans-57.6106.2157.700000107.7D10 E14D10-A12 PolarHBondContact O-N 3.25Å; A12-E14 PolarHBondContact O-N 2.91Å
13V34.2Very low39.8Very low118 Ų118152.9 Ų152.972%0.71580%0.8SS**  trans-63.6104.4167.4179.10000106.1Q11 V15Q11-V13 PolarHBondContact O-N 2.98Å; V13-V15 VanDerWaalsContact C-N 3.29Å; V13-V15 HydrophobicContact CG1-CG2 4.32Å; V13-V15 PolarHBondContact O-N 3.15Å
14E40.3Very low39.8Very low186 Ų186153.2 Ų153.287%0.86980%0.797SS**  trans-54.8100.4156.1-81.7-177.114400106.6A12 E16A12-E14 PolarHBondContact O-N 2.91Å; E14-E16 PolarHBondContact O-N 2.91Å
15V37.2Very low39.6Very low120 Ų120157.4 Ų157.473%0.72780%0.802SS**  trans-74.5105.1159.1174.60000104.1V13 E17V13-V15 VanDerWaalsContact C-N 3.29Å; V13-V15 HydrophobicContact CG1-CG2 4.32Å; V13-V15 PolarHBondContact O-N 3.15Å; V15-E17 PolarHBondContact O-N 3.22Å
16E40Very low39.1Very low180 Ų180155.3 Ų155.384%0.84179%0.792SS**  trans-48.2107.5160.4-81.2-176.2135.400107.6E14 E18E14-E16 PolarHBondContact O-N 2.91Å; E16-E18 PolarHBondContact O-N 3.44Å
17E38.1Very low38.9Very low188 Ų188154 Ų15488%0.87979%0.786SS**  trans-76.4101.8168.2-145.3174.3-166.600105.5V15V15-E17 PolarHBondContact O-N 3.22Å
18E41.4Very low38.9Very low174 Ų174154.2 Ų154.281%0.81379%0.787SS**  trans-51143.3169.6-79.9-177.9140.600110.1E16 E20E16-E18 PolarHBondContact O-N 3.44Å; E18-E20 PolarHBondContact O-N 2.88Å
19P37.8Very low39.1Very low123 Ų123152.7 Ų152.780%0.79979%0.787SS**  trans-63.1125-179.226.2-32.9000110.6A21P19-A21 PolarHBondContact O-N 2.77Å; P19-A21 VanDerWaalsContact O-N 3.13Å
20E38.5Very low39.2Very low193 Ų193150.5 Ų150.590%0.90278%0.776SS**  trans-53.6110.1168.9-145.4173.4-169.100108.4E18 E22E18-E20 PolarHBondContact O-N 2.88Å; E20-E22 PolarHBondContact O-N 3.48Å
21A37.4Very low39.5Very low101 Ų101149.6 Ų149.684%0.83577%0.767SS**  trans-67115.6174.300000109.1P19P19-A21 PolarHBondContact O-N 2.77Å; P19-A21 VanDerWaalsContact O-N 3.13Å
22E40.8Very low39.9Very low172 Ų172148.8 Ų148.880%0.80476%0.763SS**  trans-58.5160.6167.4-85.1-177.1166.300111.7E20 E24E20-E22 PolarHBondContact O-N 3.48Å; E22-E24 PolarHBondContact O-N 3.5Å
23P40.6Very low40.2Very low90 Ų90151.6 Ų151.658%0.58476%0.76SS**  trans-76.399.1-16831.7-33000111.5E25P23-E25 PolarHBondContact O-N 3.24Å; P23-E25 VanDerWaalsContact O-N 3.13Å
24E40Very low40.4Very low167 Ų167148.7 Ų148.778%0.7875%0.748SS**THydrogen-bonded Turntrans-64.8-6.1170.6-75-177.416100113.6E22E22-E24 PolarHBondContact O-N 3.5Å
25E43.3Very low40.2Very low172 Ų172147.2 Ų147.280%0.80474%0.741SS**THydrogen-bonded Turntrans-80.7-15.6179.4-69.8-172.4166.900113.9P23P23-E25 PolarHBondContact O-N 3.24Å; P23-E25 VanDerWaalsContact O-N 3.13Å
26E39.1Very low40.2Very low149 Ų149149.5 Ų149.570%0.69674%0.744SS**THydrogen-bonded Turntrans-87.4-25.7176.7-72.8-171.5169.100113.2
27E40.5Very low40Very low147 Ų147146.2 Ų146.269%0.68774%0.737SS**Hα-helixtrans-75.8-30.9177.9-77.2-170.3157.100113.1E30 E31E27-E30 PolarHBondContact O-N 3.42Å; E27-E31 PolarHBondContact O-N 3.45Å
28E39.8Very low40Very low152 Ų152145.4 Ų145.471%0.7173%0.733SS**Hα-helixtrans-70.9-28.2177-78.8-166.5158.700113E32E28-E32 PolarHBondContact O-N 2.79Å
29E43.8Very low39.8Very low159 Ų159146.3 Ų146.374%0.74374%0.737SS**Hα-helixtrans-76.5-30.4174.5-78.9-167.5157.700112.3E33E29-E33 PolarHBondContact O-N 3.1Å
30E42.8Very low39.9Very low150 Ų150148.1 Ų148.170%0.70174%0.74SS**Hα-helixtrans-75.6-33.7177.8-133.4-178.2-175.600112.3E27 A34E27-E30 PolarHBondContact O-N 3.42Å; E30-A34 WeakPolarHBondContact O-CB 3.45Å; E30-A34 PolarHBondContact O-N 2.85Å; E30-A34 VanDerWaalsContact O-N 3.13Å
31E43.2Very low39.6Very low139 Ų139142.1 Ų142.165%0.6573%0.73SS**Hα-helixtrans-71.6-33.2175.3-91-164157.400113.8E27 Q35E27-E31 PolarHBondContact O-N 3.45Å; E31-Q35 PolarHBondContact O-N 3.26Å
32E42.8Very low39.4Very low148 Ų148141 Ų14169%0.69273%0.728SS**Hα-helixtrans-73.8-29.8175-84.6-152.4159.500112.7E28E28-E32 PolarHBondContact O-N 2.79Å
33E41.6Very low38.9Very low155 Ų155141.4 Ų141.472%0.72473%0.73SS**Hα-helixtrans-77.1-34.2176.4-140.2-175-172.100111.9E29 Q35 Q36 T37E29-E33 PolarHBondContact O-N 3.1Å; E33-Q35 PolarHBondContact O-N 2.86Å; E33-Q36 PolarHBondContact O-N 3.41Å; E33-T37 PolarHBondContact O-OG1 3.06Å
34A38.7Very low38.9Very low57 Ų57146.3 Ų146.347%0.47175%0.745SS.*Hα-helixtrans-68.7-28.9176.400000113.8E30 Q36 T37E30-A34 WeakPolarHBondContact O-CB 3.45Å; E30-A34 PolarHBondContact O-N 2.85Å; E30-A34 VanDerWaalsContact O-N 3.13Å; A34-Q36 VanDerWaalsContact C-N 3.32Å; A34-Q36 PolarHBondContact O-N 3.35Å; A34-T37 PolarHBondContact O-OG1 2.84Å
35Q37.7Very low38.4Very low156 Ų156146.5 Ų146.573%0.72975%0.746SS**THydrogen-bonded Turntrans-77.5-13.9177.6-74179.63100113.8E31 E33E31-Q35 PolarHBondContact O-N 3.26Å; E33-Q35 PolarHBondContact O-N 2.86Å
36Q37.4Very low38Very low168 Ų168146.4 Ų146.479%0.78575%0.745SS**THydrogen-bonded Turntrans-91.1-11.7178.7-92.5176.155.200114.6E33 A34E33-Q36 PolarHBondContact O-N 3.41Å; A34-Q36 VanDerWaalsContact C-N 3.32Å; A34-Q36 PolarHBondContact O-N 3.35Å
37T33.9Very low37.6Very low111 Ų111150.6 Ų150.668%0.68176%0.757SS**SBendtrans-100.3-8.2-176.725.30000115.3E33 A34E33-T37 PolarHBondContact O-OG1 3.06Å; A34-T37 PolarHBondContact O-OG1 2.84Å
38E38.1Very low37.1Very low171 Ų171150.8 Ų150.880%0.79976%0.758SS**SBendtrans-95.35.2-175.3-73.5-78149.500115.2
39E37.5Very low37.1Very low192 Ų192151 Ų15190%0.89776%0.764SS**SBendtrans-108.920.1179.3-106.4-16417300115.4
40D41.6Very low36.4Very low162 Ų162151.2 Ų151.287%0.86677%0.765SS**  trans-13064.8170.7-164.139.9000111.4
41G30.7Very low36.2Very low67 Ų67151.9 Ų151.969%0.69177%0.773SS**  trans-130.475178.300000111.3E43G41-E43 PolarHBondContact O-N 2.81Å; G41-E43 VanDerWaalsContact O-N 3.13Å
42G33.1Very low35.6Very low77 Ų77149.9 Ų149.979%0.79478%0.78SS**  trans-61.6110.1175.300000112.3Q44G42-Q44 PolarHBondContact O-N 2.87Å
43E31.4Very low35.2Very low181 Ų181152.1 Ų152.185%0.84679%0.79SS**  trans-68.3119.3169.4-69.8-172.9131.900110.6G41 Q45G41-E43 PolarHBondContact O-N 2.81Å; G41-E43 VanDerWaalsContact O-N 3.13Å; E43-Q45 PolarHBondContact O-N 3.38Å
44Q39.2Very low34.7Very low193 Ų193154 Ų15490%0.90280%0.799SS**  trans-75.9114.5165.3-68.3174.9-1.600108.6G42G42-Q44 PolarHBondContact O-N 2.87Å
45Q31.1Very low34.4Very low170 Ų170160.5 Ų160.579%0.79482%0.82SS**  trans-104.8113.8165.1-97.1179-3.600110.5E43E43-Q45 PolarHBondContact O-N 3.38Å
46E33.7Very low34.2Very low170 Ų170162.3 Ų162.379%0.79483%0.828SS**  trans-60.9129.8165.3-71.8-174.3147.600110.3Q48E46-Q48 PolarHBondContact O-N 2.78Å
47Y30.7Very low34.1Very low238 Ų238163.3 Ų163.393%0.93383%0.833SS**  trans-78.3105.2166.3-76.8-96.1000109
48Q29.9Very low34.5Very low151 Ų151167.4 Ų167.471%0.70684%0.844SS**  trans-95.3123.3159.2-77.3-176.717.300109.3E46E46-Q48 PolarHBondContact O-N 2.78Å
49D40Very low34.8Very low157 Ų157170.3 Ų170.384%0.8485%0.848SS**  trans-63.9126.9170.2-159.918.6000109.6
50Q30.4Very low35.2Very low163 Ų163167.1 Ų167.176%0.76284%0.844SS**  trans-156.2112.4167.7-120.316282.700111
51D38.2Very low35.5Very low164 Ų164169.2 Ų169.288%0.87785%0.845SS**  trans-39.5130.1163.5-74.7-83.7000112.5
52A29.8Very low36.4Very low96 Ų96171.8 Ų171.879%0.79385%0.85SS**  trans-140.4112.4159.800000109.4E54A52-E54 PolarHBondContact O-N 3.44Å
53Q35Very low37.5Very low196 Ų196177.8 Ų177.892%0.91685%0.854SS**PPolyproline II helixtrans-58.8124.4169.1-70.6162.5-50.700109.6
54E31.6Very low38.3Very low195 Ų195174.7 Ų174.791%0.91185%0.85SS**PPolyproline II helixtrans-84120.8164.6-81.9-176.7159.300109.8A52A52-E54 PolarHBondContact O-N 3.44Å
55E32.3Very low38.9Very low192 Ų192173.5 Ų173.590%0.89785%0.849SS**PPolyproline II helixtrans-66.9134.4171.4-73-177138.200111.3E57E55-E57 PolarHBondContact O-N 2.78Å
56E31.7Very low40Very low195 Ų195171.1 Ų171.191%0.91185%0.846SS**PPolyproline II helixtrans-65.9120.1170.5-78.4-176.3128.200111.7
57E35.9Very low40.9Very low189 Ų189168 Ų16888%0.88384%0.84SS**  trans-91.1112.6156.5-84.9-166.9154.900110.9E55 R59E55-E57 PolarHBondContact O-N 2.78Å; E57-R59 PolarHBondContact O-N 2.83Å
58E43.2Very low41.8Very low197 Ų197165.8 Ų165.892%0.92184%0.838SS**  trans-59.3118.3174.2-91-170.3133.900112.9
59R43.8Very low42.9Very low231 Ų231166.2 Ų166.287%0.87284%0.844SS**  trans-105.6143.2158.3-74.5-174.6-178.6-150.61.4110.9E57E57-R59 PolarHBondContact O-N 2.83Å
60P45.6Very low43.6Very low125 Ų125162.7 Ų162.781%0.81284%0.837SS**PPolyproline II helixtrans-73.5133-167.128.7-33.9000112.8P62P60-P62 WeakPolarHBondContact O-CD 3.24Å
61K47.3Very low44.9Very low206 Ų206160.2 Ų160.290%0.89684%0.835SS**PPolyproline II helixtrans-64.8122.6-179.7-68.1170.6-1801680112.9
62P50.5Low45.9Very low122 Ų122158.1 Ų158.179%0.79283%0.83SS**PPolyproline II helixtrans-85134.715720.8-8.6000110.6P60P60-P62 WeakPolarHBondContact O-CD 3.24Å
63K56.7Low46.8Very low202 Ų202162.8 Ų162.888%0.87883%0.833SS**PPolyproline II helixtrans-59.9136.1-177.6-63.2171.2-179.8175.40111.7L65K63-L65 PolarHBondContact O-N 2.59Å
64P47.9Very low47.8Very low117 Ų117160.6 Ų160.676%0.7683%0.826SS**  trans-79.4113.6173.431.1-30000109.6
65L52.6Low49.3Very low168 Ų168157 Ų15788%0.8882%0.819SS**  trans-88.9116.3160-153.276.7000106.1K63 P67K63-L65 PolarHBondContact O-N 2.59Å; L65-P67 VanDerWaalsContact O-CD 3.26Å; L65-P67 WeakPolarHBondContact O-CD 3.27Å
66V53.2Low50.1Low120 Ų120157.2 Ų157.273%0.72782%0.82SS**  trans-93.6111.9-173.3-155.90000109
67P51.8Low51.2Low103 Ų103151.8 Ų151.867%0.66982%0.817SS**  trans-75.1120.9156-13.930.2000108L65 L69L65-P67 VanDerWaalsContact O-CD 3.26Å; L65-P67 WeakPolarHBondContact O-CD 3.27Å; P67-L69 PolarHBondContact O-N 2.69Å
68Q49.8Very low52.3Low193 Ų193151.3 Ų151.390%0.90281%0.814SS**  trans-62.595.2169.2-73173-12.800109.1
69L54.2Low53.2Low159 Ų159153.4 Ų153.483%0.83281%0.814SS**PPolyproline II helixtrans-93117165-113.568.7000108.2P67P67-L69 PolarHBondContact O-N 2.69Å
70A55.1Low54.3Low83 Ų83146.7 Ų146.769%0.68680%0.799SS**PPolyproline II helixtrans-49146.6173.500000111.7
71P56Low55.9Low112 Ų112144.6 Ų144.673%0.72778%0.78SS**PPolyproline II helixtrans-56.5126.3177.622.1-31.5000109.3K73P71-K73 PolarHBondContact O-N 3.25Å; P71-K73 VanDerWaalsContact O-N 3.12Å
72P60.6Low57.4Low119 Ų119141.7 Ų141.777%0.77377%0.768SS**PPolyproline II helixtrans-58.5122.6174.823.1-30.1000107.7I74P72-I74 PolarHBondContact O-N 3.46Å
73K48.1Very low59Low195 Ų195141 Ų14185%0.84876%0.757SS**  trans-55.1112166.6-98.585175.6178.10106.4P71 P75P71-K73 PolarHBondContact O-N 3.25Å; P71-K73 VanDerWaalsContact O-N 3.12Å; K73-P75 VanDerWaalsContact O-CD 3.25Å; K73-P75 WeakPolarHBondContact O-CD 3.47Å
74I56.3Low60.5Low149 Ų149133.9 Ų133.976%0.76473%0.729SS**  trans-68.2117.8164-43.5172.4000104.9P72 E76P72-I74 PolarHBondContact O-N 3.46Å; I74-E76 PolarHBondContact O-N 3.44Å; I74-E76 VanDerWaalsContact O-N 3.09Å
75P63.8Low62.4Low120 Ų120132.3 Ų132.378%0.77971%0.714SS**  trans-65.5110.9167.1-14.330.3000107.3K73 G77K73-P75 VanDerWaalsContact O-CD 3.25Å; K73-P75 WeakPolarHBondContact O-CD 3.47Å; P75-G77 PolarHBondContact O-N 3.23Å
76E48Very low64.2Low196 Ų196129.8 Ų129.892%0.91670%0.697SS**  trans-61.1127.9167.5-75.8177.3144.300109.3I74I74-E76 PolarHBondContact O-N 3.44Å; I74-E76 VanDerWaalsContact O-N 3.09Å
77G54Low66.1Low81 Ų81129.9 Ų129.984%0.83568%0.684SS**  trans116.543.1153.900000118.1P75P75-G77 PolarHBondContact O-N 3.23Å
78E59.7Low68Low179 Ų179130.7 Ų130.784%0.83668%0.677SS**  trans-107.6106146.6-164.1166.3-163.300107V80E78-V80 PolarHBondContact O-N 2.87Å
79R62.6Low70.1Confident242 Ų242129.2 Ų129.291%0.91366%0.663SS**  trans-64101-178.5-153.1178.3-165.5176.82.2106.3D81R79-D81 PolarHBondContact O-N 3.46Å
80V66.9Low71.9Confident90 Ų90127.9 Ų127.955%0.54565%0.654SS.*  trans-57.5104.2176.6-179.80000107.3E78 F82 I85E78-V80 PolarHBondContact O-N 2.87Å; V80-F82 PolarHBondContact O-N 3.2Å; V80-I85 HydrophobicContact CG1-CD1 3.33Å; V80-I85 HydrophobicContact CG1-CG1 4.3Å
81D78.2Confident73.8Confident80 Ų80129.9 Ų129.943%0.42865%0.65SS.*  trans-76.7103.2179.6-173.10.8000107.7R79 D83 D84 I85 R87R79-D81 PolarHBondContact O-N 3.46Å; D81-D83 PolarHBondContact O-N 3.42Å; D81-D83 PolarHBondContact OD1-N 2.87Å; D81-D84 HydrophobicContact CB-CB 3.78Å; D81-D84 WeakPolarHBondContact O-CA 3.33Å; D81-D84 WeakPolarHBondContact O-CB 3.11Å; D81-D84 PolarHBondContact O-N 2.86Å; D81-I85 PolarHBondContact O-N 3.32Å; D81-I85 VanDerWaalsContact O-N 3.09Å; D81-R87 IonicContact OD2-NH2 3.7Å
82F79.1Confident75.7Confident146 Ų146129.9 Ų129.964%0.6464%0.638SS**Hα-helixtrans-61-27.6-179.4-71.7-82.2000111.8V80 I85 H86V80-F82 PolarHBondContact O-N 3.2Å; F82-I85 PolarHBondContact O-N 3.41Å; F82-H86 PolarHBondContact O-N 3.23Å; F82-H86 PolarHBondContact O-ND1 3.2Å
83D85.3Confident77.4Confident106 Ų106127 Ų12757%0.56762%0.617SS**Hα-helixtrans-71.3-33.7174.6-69.6-15.1000111.1D81 H86 R87D81-D83 PolarHBondContact O-N 3.42Å; D81-D83 PolarHBondContact OD1-N 2.87Å; D83-H86 PolarHBondContact O-N 3.45Å; D83-R87 WeakPolarHBondContact O-CB 3.48Å; D83-R87 WeakPolarHBondContact O-CG 3.3Å; D83-R87 PolarHBondContact O-N 2.83Å
84D88.5Confident79.6Confident53 Ų53122.4 Ų122.428%0.28360%0.6SS.*Hα-helixtrans-68.4-39.3174.3-170.852.6000112D81 R87 K88D81-D84 HydrophobicContact CB-CB 3.78Å; D81-D84 WeakPolarHBondContact O-CA 3.33Å; D81-D84 WeakPolarHBondContact O-CB 3.11Å; D81-D84 PolarHBondContact O-N 2.86Å; D84-R87 PolarHBondContact O-N 3.09Å; D84-R87 IonicContact OD1-NH2 3.76Å; D84-K88 WeakPolarHBondContact O-CB 3.41Å; D84-K88 VanDerWaalsContact O-CG 3.31Å; D84-K88 WeakPolarHBondContact O-CG 3.33Å; D84-K88 PolarHBondContact O-N 3.18Å; D84-K88 IonicContact OD1-NZ 3.42Å; D84-K88 WeakPolarHBondContact OD2-CE 3.24Å; D84-K88 IonicContact OD2-NZ 3.63Å; D84-K88 PolarHBondContact OD2-NZ 3.3Å
85I86.6Confident81.5Confident85 Ų85120.9 Ų120.944%0.43659%0.593SS.*Hα-helixtrans-62.9-44.7173.3-67.2179.3000110.9V80 D81 F82 K88 R89V80-I85 HydrophobicContact CG1-CD1 3.33Å; V80-I85 HydrophobicContact CG1-CG1 4.3Å; D81-I85 PolarHBondContact O-N 3.32Å; D81-I85 VanDerWaalsContact O-N 3.09Å; F82-I85 PolarHBondContact O-N 3.41Å; I85-K88 PolarHBondContact O-N 2.89Å; I85-R89 WeakPolarHBondContact O-CB 3.14Å; I85-R89 PolarHBondContact O-N 3.05Å
86H89.9Confident83Confident115 Ų115119.6 Ų119.653%0.53258%0.577SS.*Hα-helixtrans-65.6-42.4178.2-78.684.5000112F82 D83 R89 M90F82-H86 PolarHBondContact O-N 3.23Å; F82-H86 PolarHBondContact O-ND1 3.2Å; D83-H86 PolarHBondContact O-N 3.45Å; H86-R89 PolarHBondContact O-N 3.33Å; H86-M90 WeakPolarHBondContact O-CG 3.23Å; H86-M90 PolarHBondContact O-N 2.92Å
87R93.2Very high85.3Confident122 Ų122114.7 Ų114.746%0.4656%0.557SS.*Hα-helixtrans-60.4-49.9174.3-76.2-173.2-62.1-102.1-1.3111.8D81 D83 D84 R89 M90 E91D81-R87 IonicContact OD2-NH2 3.7Å; D83-R87 WeakPolarHBondContact O-CB 3.48Å; D83-R87 WeakPolarHBondContact O-CG 3.3Å; D83-R87 PolarHBondContact O-N 2.83Å; D84-R87 PolarHBondContact O-N 3.09Å; D84-R87 IonicContact OD1-NH2 3.76Å; R87-R89 VanDerWaalsContact C-N 3.27Å; R87-R89 PolarHBondContact O-N 3.13Å; R87-M90 PolarHBondContact O-N 3.26Å; R87-M90 VanDerWaalsContact O-N 3.16Å; R87-E91 WeakPolarHBondContact O-CB 3.39Å; R87-E91 WeakPolarHBondContact O-CG 3.3Å; R87-E91 PolarHBondContact O-N 3.3Å
88K93.1Very high87.2Confident119 Ų119115.8 Ų115.852%0.51754%0.54SS..Hα-helixtrans-61.2-35.9178-75.9172.6175.41660112.6D84 I85 K92D84-K88 WeakPolarHBondContact O-CB 3.41Å; D84-K88 VanDerWaalsContact O-CG 3.31Å; D84-K88 WeakPolarHBondContact O-CG 3.33Å; D84-K88 PolarHBondContact O-N 3.18Å; D84-K88 IonicContact OD1-NZ 3.42Å; D84-K88 WeakPolarHBondContact OD2-CE 3.24Å; D84-K88 IonicContact OD2-NZ 3.63Å; D84-K88 PolarHBondContact OD2-NZ 3.3Å; I85-K88 PolarHBondContact O-N 2.89Å; K88-K92 VanDerWaalsContact O-CB 3.23Å; K88-K92 WeakPolarHBondContact O-CB 3.23Å; K88-K92 PolarHBondContact O-N 3.37Å
89R93.3Very high89Confident162 Ų162111 Ų11161%0.61152%0.523SS*.Hα-helixtrans-64.3-50.5173.4-178179.3179.5174.33.8111.2I85 H86 R87 E91 K92 D93I85-R89 WeakPolarHBondContact O-CB 3.14Å; I85-R89 PolarHBondContact O-N 3.05Å; H86-R89 PolarHBondContact O-N 3.33Å; R87-R89 VanDerWaalsContact C-N 3.27Å; R87-R89 PolarHBondContact O-N 3.13Å; R89-E91 VanDerWaalsContact C-N 3.32Å; R89-E91 PolarHBondContact O-N 3.36Å; R89-K92 PolarHBondContact O-N 2.81Å; R89-D93 IonicContact NE-OD2 3.32Å; R89-D93 WeakPolarHBondContact O-CB 3.23Å; R89-D93 VanDerWaalsContact O-CG 3.23Å; R89-D93 PolarHBondContact O-N 2.82Å
90M92.3Very high90.6Very high131 Ų131104.6 Ų104.665%0.64551%0.506SS*.Hα-helixtrans-61.1-40.7178.3-70.6-61.9-62.200112.1H86 R87 L94H86-M90 WeakPolarHBondContact O-CG 3.23Å; H86-M90 PolarHBondContact O-N 2.92Å; R87-M90 PolarHBondContact O-N 3.26Å; R87-M90 VanDerWaalsContact O-N 3.16Å; M90-L94 WeakPolarHBondContact O-CB 3.35Å; M90-L94 PolarHBondContact O-N 2.99Å
91E94.5Very high92Very high125 Ų125103.5 Ų103.558%0.58450%0.497SS*.Hα-helixtrans-64.9-42.6175.4-73.9172.6-174.300112R87 R89 L94 L95R87-E91 WeakPolarHBondContact O-CB 3.39Å; R87-E91 WeakPolarHBondContact O-CG 3.3Å; R87-E91 PolarHBondContact O-N 3.3Å; R89-E91 VanDerWaalsContact C-N 3.32Å; R89-E91 PolarHBondContact O-N 3.36Å; E91-L94 PolarHBondContact O-N 3.41Å; E91-L95 WeakPolarHBondContact O-CB 3.3Å; E91-L95 PolarHBondContact O-N 3.21Å
92K95.9Very high92.9Very high113 Ų113104.6 Ų104.649%0.49150%0.502SS..Hα-helixtrans-64-47.3176.1-169.7-131.664.9162.10111.1K88 R89 L94 L95 E96K88-K92 VanDerWaalsContact O-CB 3.23Å; K88-K92 WeakPolarHBondContact O-CB 3.23Å; K88-K92 PolarHBondContact O-N 3.37Å; R89-K92 PolarHBondContact O-N 2.81Å; K92-L94 VanDerWaalsContact C-N 3.33Å; K92-L94 PolarHBondContact O-N 2.87Å; K92-L95 PolarHBondContact O-N 3.43Å; K92-E96 VanDerWaalsContact CE-OE2 3.3Å; K92-E96 WeakPolarHBondContact CE-OE2 3.35Å; K92-E96 IonicContact NZ-OE2 3.89Å; K92-E96 PolarHBondContact NZ-OE2 3.26Å; K92-E96 VanDerWaalsContact O-CB 3.24Å; K92-E96 WeakPolarHBondContact O-CB 3.48Å; K92-E96 PolarHBondContact O-N 3.32Å
93D95.1Very high93.8Very high59 Ų59100.4 Ų100.432%0.31650%0.495SS..Hα-helixtrans-65.3-37.1179.5-67.2-15.9000110.9R89 L97R89-D93 IonicContact NE-OD2 3.32Å; R89-D93 WeakPolarHBondContact O-CB 3.23Å; R89-D93 VanDerWaalsContact O-CG 3.23Å; R89-D93 PolarHBondContact O-N 2.82Å; D93-L97 VanDerWaalsContact O-CB 3.28Å; D93-L97 WeakPolarHBondContact O-CB 3.42Å; D93-L97 PolarHBondContact O-N 2.91Å
94L95.7Very high94.4Very high97 Ų97100 Ų10051%0.50849%0.489SS..Hα-helixtrans-67.2-43.1175-17664.9000111.9M90 E91 K92 L97 H98M90-L94 WeakPolarHBondContact O-CB 3.35Å; M90-L94 PolarHBondContact O-N 2.99Å; E91-L94 PolarHBondContact O-N 3.41Å; K92-L94 VanDerWaalsContact C-N 3.33Å; K92-L94 PolarHBondContact O-N 2.87Å; L94-L97 PolarHBondContact O-N 3.45Å; L94-H98 PolarHBondContact O-CD2 2.94Å; L94-H98 PolarHBondContact O-N 3.48Å
95L95.3Very high94.8Very high117 Ų117103.9 Ų103.961%0.61350%0.504SS*.Hα-helixtrans-67.1-41177.4-174.1148.4000111.8E91 K92 H98 T99E91-L95 WeakPolarHBondContact O-CB 3.3Å; E91-L95 PolarHBondContact O-N 3.21Å; K92-L95 PolarHBondContact O-N 3.43Å; L95-H98 PolarHBondContact O-N 3.25Å; L95-T99 WeakPolarHBondContact O-CB 3.33Å; L95-T99 PolarHBondContact O-N 3.4Å; L95-T99 PolarHBondContact O-OG1 2.89Å
96E95.3Very high95.3Very high93 Ų93104.4 Ų104.444%0.43551%0.505SS..Hα-helixtrans-61.3-44.7174-174.3171.1-178.700110.7K92 T99 L100K92-E96 VanDerWaalsContact CE-OE2 3.3Å; K92-E96 WeakPolarHBondContact CE-OE2 3.35Å; K92-E96 IonicContact NZ-OE2 3.89Å; K92-E96 PolarHBondContact NZ-OE2 3.26Å; K92-E96 VanDerWaalsContact O-CB 3.24Å; K92-E96 WeakPolarHBondContact O-CB 3.48Å; K92-E96 PolarHBondContact O-N 3.32Å; E96-T99 PolarHBondContact O-N 3.3Å; E96-L100 HydrophobicContact CG-CD1 4.29Å; E96-L100 WeakPolarHBondContact O-CB 3.21Å; E96-L100 WeakPolarHBondContact O-CG 3.31Å; E96-L100 PolarHBondContact O-N 3.5Å
97L96.3Very high95.7Very high94 Ų94104 Ų10449%0.49250%0.503SS..Hα-helixtrans-61.1-46.6175.3-178.562.5000112.2D93 L94 T99 L100 I101D93-L97 VanDerWaalsContact O-CB 3.28Å; D93-L97 WeakPolarHBondContact O-CB 3.42Å; D93-L97 PolarHBondContact O-N 2.91Å; L94-L97 PolarHBondContact O-N 3.45Å; L97-T99 VanDerWaalsContact C-N 3.32Å; L97-T99 PolarHBondContact O-N 2.87Å; L97-L100 PolarHBondContact O-N 2.79Å; L97-I101 HydrophobicContact CD1-CD1 4.14Å; L97-I101 HydrophobicContact CD1-CG1 4.37Å; L97-I101 HydrophobicContact CG-CD1 3.91Å; L97-I101 WeakPolarHBondContact O-CB 3.35Å; L97-I101 VanDerWaalsContact O-CG1 3.23Å; L97-I101 WeakPolarHBondContact O-CG1 3.37Å; L97-I101 PolarHBondContact O-N 3.28Å
98H95.3Very high95.9Very high103 Ų103104.5 Ų104.548%0.47751%0.505SS..Hα-helixtrans-59.5-43.5175.4-84-66.9000112L94 L95 L100 I101 D102L94-H98 PolarHBondContact O-CD2 2.94Å; L94-H98 PolarHBondContact O-N 3.48Å; L95-H98 PolarHBondContact O-N 3.25Å; H98-L100 PolarHBondContact O-N 2.9Å; H98-I101 PolarHBondContact O-N 3.41Å; H98-D102 PolarHBondContact O-N 3.2Å
99T96.2Very high96.1Very high80 Ų80103.8 Ų103.849%0.49150%0.502SS..Hα-helixtrans-63.8-41.3178.7-540000111.5L95 E96 L97 A103L95-T99 WeakPolarHBondContact O-CB 3.33Å; L95-T99 PolarHBondContact O-N 3.4Å; L95-T99 PolarHBondContact O-OG1 2.89Å; E96-T99 PolarHBondContact O-N 3.3Å; L97-T99 VanDerWaalsContact C-N 3.32Å; L97-T99 PolarHBondContact O-N 2.87Å; T99-A103 WeakPolarHBondContact O-CB 3.31Å; T99-A103 PolarHBondContact O-N 2.93Å
100L97.2Very high96.3Very high107 Ų107101.3 Ų101.356%0.5650%0.495SS*.Hα-helixtrans-65.5-40.7176-75.8168.8000112.1E96 L97 H98 H104E96-L100 HydrophobicContact CG-CD1 4.29Å; E96-L100 WeakPolarHBondContact O-CB 3.21Å; E96-L100 WeakPolarHBondContact O-CG 3.31Å; E96-L100 PolarHBondContact O-N 3.5Å; L97-L100 PolarHBondContact O-N 2.79Å; H98-L100 PolarHBondContact O-N 2.9Å; L100-H104 WeakPolarHBondContact O-CB 3.47Å; L100-H104 PolarHBondContact O-N 3.24Å
101I96.3Very high96.5Very high67 Ų6798.7 Ų98.734%0.34448%0.484SS..Hα-helixtrans-60.9-51.7175.9-72.6167.9000110L97 H98 A103 H104 F105L97-I101 HydrophobicContact CD1-CD1 4.14Å; L97-I101 HydrophobicContact CD1-CG1 4.37Å; L97-I101 HydrophobicContact CG-CD1 3.91Å; L97-I101 WeakPolarHBondContact O-CB 3.35Å; L97-I101 VanDerWaalsContact O-CG1 3.23Å; L97-I101 WeakPolarHBondContact O-CG1 3.37Å; L97-I101 PolarHBondContact O-N 3.28Å; H98-I101 PolarHBondContact O-N 3.41Å; I101-A103 PolarHBondContact O-N 3.46Å; I101-H104 PolarHBondContact O-N 2.81Å; I101-F105 HydrophobicContact CG2-CD2 3.69Å; I101-F105 HydrophobicContact CG2-CE2 3.64Å; I101-F105 VanDerWaalsContact O-CD2 3.22Å; I101-F105 WeakPolarHBondContact O-CD2 3.33Å; I101-F105 PolarHBondContact O-N 2.68Å
102D96.9Very high96.6Very high102 Ų10297.8 Ų97.855%0.54548%0.479SS..Hα-helixtrans-63.9-42.8-178.9-69.6-17.7000111.3H98 H104 F105 E106H98-D102 PolarHBondContact O-N 3.2Å; D102-H104 VanDerWaalsContact C-N 3.33Å; D102-H104 PolarHBondContact O-N 3.48Å; D102-F105 PolarHBondContact O-N 3.32Å; D102-E106 WeakPolarHBondContact O-CB 3.11Å; D102-E106 WeakPolarHBondContact O-CG 3.12Å; D102-E106 PolarHBondContact O-N 3.19Å
103A97.3Very high96.7Very high58 Ų5897.9 Ų97.948%0.47948%0.482SS..Hα-helixtrans-61.3-40.6175.300000112.1T99 I101 Q107T99-A103 WeakPolarHBondContact O-CB 3.31Å; T99-A103 PolarHBondContact O-N 2.93Å; I101-A103 PolarHBondContact O-N 3.46Å; A103-Q107 VanDerWaalsContact O-CB 3.22Å; A103-Q107 WeakPolarHBondContact O-CB 3.43Å; A103-Q107 PolarHBondContact O-N 3.41Å
104H97.9Very high96.8Very high99 Ų99101.7 Ų101.746%0.45850%0.498SS..Hα-helixtrans-63.7-47.9177.1-175.777.2000111.6L100 I101 D102 Q107 R108L100-H104 WeakPolarHBondContact O-CB 3.47Å; L100-H104 PolarHBondContact O-N 3.24Å; I101-H104 PolarHBondContact O-N 2.81Å; D102-H104 VanDerWaalsContact C-N 3.33Å; D102-H104 PolarHBondContact O-N 3.48Å; H104-Q107 PolarHBondContact O-N 2.86Å; H104-R108 PolarHBondContact CE1-NH1 2.84Å; H104-R108 VanDerWaalsContact CE1-NH1 3.32Å; H104-R108 PolarHBondContact NE2-NH1 3.5Å; H104-R108 VanDerWaalsContact O-CB 3.3Å; H104-R108 WeakPolarHBondContact O-CB 3.28Å; H104-R108 PolarHBondContact O-N 3.5Å
105F98Very high96.9Very high133 Ų133101.2 Ų101.258%0.58350%0.495SS*.Hα-helixtrans-66.2-42.7179.9-79.6-66.3000112.5I101 D102 R108 K109I101-F105 HydrophobicContact CG2-CD2 3.69Å; I101-F105 HydrophobicContact CG2-CE2 3.64Å; I101-F105 VanDerWaalsContact O-CD2 3.22Å; I101-F105 WeakPolarHBondContact O-CD2 3.33Å; I101-F105 PolarHBondContact O-N 2.68Å; D102-F105 PolarHBondContact O-N 3.32Å; F105-R108 PolarHBondContact O-N 2.9Å; F105-K109 WeakPolarHBondContact O-CB 3.38Å; F105-K109 PolarHBondContact O-N 3.3Å
106E97.1Very high96.9Very high97 Ų97100.2 Ų100.245%0.45349%0.49SS..Hα-helixtrans-66-38.6177.4-75.7-64.1142.600112.1D102 K110D102-E106 WeakPolarHBondContact O-CB 3.11Å; D102-E106 WeakPolarHBondContact O-CG 3.12Å; D102-E106 PolarHBondContact O-N 3.19Å; E106-K110 VanDerWaalsContact O-CG 3.29Å; E106-K110 WeakPolarHBondContact O-CG 3.31Å; E106-K110 PolarHBondContact O-N 3.39Å; E106-K110 VanDerWaalsContact O-N 3.12Å
107Q97.5Very high97.1Very high105 Ų10596.9 Ų96.949%0.49148%0.48SS..Hα-helixtrans-63.8-51.7174.1-174.760.345.100110.7A103 H104 K109 K110 D111A103-Q107 VanDerWaalsContact O-CB 3.22Å; A103-Q107 WeakPolarHBondContact O-CB 3.43Å; A103-Q107 PolarHBondContact O-N 3.41Å; H104-Q107 PolarHBondContact O-N 2.86Å; Q107-K109 VanDerWaalsContact C-N 3.28Å; Q107-K109 PolarHBondContact O-N 3.04Å; Q107-K110 PolarHBondContact O-N 3.48Å; Q107-K110 VanDerWaalsContact O-N 3.14Å; Q107-D111 PolarHBondContact NE2-OD1 3.23Å; Q107-D111 PolarHBondContact NE2-OD2 3.47Å; Q107-D111 PolarHBondContact O-N 3.47Å
108R97.5Very high97.1Very high134 Ų13495.9 Ų95.951%0.50648%0.475SS..Hα-helixtrans-60.7-39.6-178.2-147.4-176.3-170.6101.99.1112.1H104 F105 D111 E112H104-R108 PolarHBondContact CE1-NH1 2.84Å; H104-R108 VanDerWaalsContact CE1-NH1 3.32Å; H104-R108 PolarHBondContact NE2-NH1 3.5Å; H104-R108 VanDerWaalsContact O-CB 3.3Å; H104-R108 WeakPolarHBondContact O-CB 3.28Å; H104-R108 PolarHBondContact O-N 3.5Å; F105-R108 PolarHBondContact O-N 2.9Å; R108-D111 PolarHBondContact O-N 3.32Å; R108-E112 WeakPolarHBondContact O-CB 3.35Å; R108-E112 VanDerWaalsContact O-CG 3.28Å; R108-E112 WeakPolarHBondContact O-CG 3.12Å; R108-E112 PolarHBondContact O-N 3.08Å
109K97.6Very high97.2Very high104 Ų10496.9 Ų96.945%0.45248%0.478SS..Hα-helixtrans-63.6-43.9176.6-176.3-177.2174.8-168.60111.9F105 Q107 E112 E113F105-K109 WeakPolarHBondContact O-CB 3.38Å; F105-K109 PolarHBondContact O-N 3.3Å; Q107-K109 VanDerWaalsContact C-N 3.28Å; Q107-K109 PolarHBondContact O-N 3.04Å; K109-E112 PolarHBondContact O-N 2.85Å; K109-E113 WeakPolarHBondContact CE-OE1 3.32Å; K109-E113 WeakPolarHBondContact O-CB 3.36Å; K109-E113 VanDerWaalsContact O-CG 3.31Å; K109-E113 WeakPolarHBondContact O-CG 3.49Å; K109-E113 PolarHBondContact O-N 3.5Å
110K97.8Very high97.3Very high110 Ų11097.4 Ų97.448%0.47848%0.477SS..Hα-helixtrans-63.1-45.3175.3-72.7171.4-172.8172.40111.3E106 Q107 E112 E113 E114E106-K110 VanDerWaalsContact O-CG 3.29Å; E106-K110 WeakPolarHBondContact O-CG 3.31Å; E106-K110 PolarHBondContact O-N 3.39Å; E106-K110 VanDerWaalsContact O-N 3.12Å; Q107-K110 PolarHBondContact O-N 3.48Å; Q107-K110 VanDerWaalsContact O-N 3.14Å; K110-E112 VanDerWaalsContact C-N 3.33Å; K110-E112 PolarHBondContact O-N 2.78Å; K110-E113 PolarHBondContact O-N 3.25Å; K110-E114 WeakPolarHBondContact O-CG 3.34Å; K110-E114 PolarHBondContact O-N 2.88Å
111D96.6Very high97.3Very high76 Ų7699.2 Ų99.241%0.40648%0.477SS..Hα-helixtrans-62.3-41.3178.3-62.1-18.7000111.3Q107 R108 E114 L115Q107-D111 PolarHBondContact NE2-OD1 3.23Å; Q107-D111 PolarHBondContact NE2-OD2 3.47Å; Q107-D111 PolarHBondContact O-N 3.47Å; R108-D111 PolarHBondContact O-N 3.32Å; D111-E114 PolarHBondContact O-N 3.07Å; D111-L115 VanDerWaalsContact O-CB 3.23Å; D111-L115 WeakPolarHBondContact O-CB 3.31Å; D111-L115 PolarHBondContact O-N 2.92Å
112E96.8Very high97.4Very high105 Ų10598.9 Ų98.949%0.49148%0.475SS..Hα-helixtrans-65-44.1175.5-77.9176.3-167.100112.1R108 K109 K110 E114 L115 I116R108-E112 WeakPolarHBondContact O-CB 3.35Å; R108-E112 VanDerWaalsContact O-CG 3.28Å; R108-E112 WeakPolarHBondContact O-CG 3.12Å; R108-E112 PolarHBondContact O-N 3.08Å; K109-E112 PolarHBondContact O-N 2.85Å; K110-E112 VanDerWaalsContact C-N 3.33Å; K110-E112 PolarHBondContact O-N 2.78Å; E112-E114 PolarHBondContact O-N 3.46Å; E112-L115 PolarHBondContact O-N 2.84Å; E112-I116 WeakPolarHBondContact O-CB 3.39Å; E112-I116 WeakPolarHBondContact O-CD1 3.24Å; E112-I116 WeakPolarHBondContact O-CG1 3.35Å; E112-I116 PolarHBondContact O-N 2.88Å
113E97.3Very high97.4Very high115 Ų115100.2 Ų100.254%0.53748%0.478SS..Hα-helixtrans-62.1-41.7176.3-75.8175.7-170.700111.7K109 K110 G117K109-E113 WeakPolarHBondContact CE-OE1 3.32Å; K109-E113 WeakPolarHBondContact O-CB 3.36Å; K109-E113 VanDerWaalsContact O-CG 3.31Å; K109-E113 WeakPolarHBondContact O-CG 3.49Å; K109-E113 PolarHBondContact O-N 3.5Å; K110-E113 PolarHBondContact O-N 3.25Å; E113-G117 PolarHBondContact O-N 2.88Å
114E96.9Very high97.4Very high139 Ų139103 Ų10365%0.6548%0.481SS*.Hα-helixtrans-66.6-42.6175.7-73.3-176.4-170.100112.1K110 D111 E112 G117 L118K110-E114 WeakPolarHBondContact O-CG 3.34Å; K110-E114 PolarHBondContact O-N 2.88Å; D111-E114 PolarHBondContact O-N 3.07Å; E112-E114 PolarHBondContact O-N 3.46Å; E114-G117 PolarHBondContact O-N 3.39Å; E114-L118 WeakPolarHBondContact O-CB 3.42Å; E114-L118 PolarHBondContact O-N 3.49Å
115L97.3Very high97.4Very high88 Ų88104.2 Ų104.246%0.46148%0.481SS..Hα-helixtrans-64.9-44.2178.1-177.162.7000111.5D111 E112 L118 K119D111-L115 VanDerWaalsContact O-CB 3.23Å; D111-L115 WeakPolarHBondContact O-CB 3.31Å; D111-L115 PolarHBondContact O-N 2.92Å; E112-L115 PolarHBondContact O-N 2.84Å; L115-L118 PolarHBondContact O-N 3.23Å; L115-K119 HydrophobicContact CG-CD 4.39Å; L115-K119 WeakPolarHBondContact O-CB 3.35Å; L115-K119 WeakPolarHBondContact O-CG 3.27Å; L115-K119 PolarHBondContact O-N 3.13Å
116I96.7Very high97.4Very high96 Ų96106.1 Ų106.149%0.49249%0.485SS..Hα-helixtrans-60.4-50174.4-69.8164.8000109.4E112 L118 K119 D120E112-I116 WeakPolarHBondContact O-CB 3.39Å; E112-I116 WeakPolarHBondContact O-CD1 3.24Å; E112-I116 WeakPolarHBondContact O-CG1 3.35Å; E112-I116 PolarHBondContact O-N 2.88Å; I116-L118 VanDerWaalsContact C-N 3.26Å; I116-L118 PolarHBondContact O-N 2.94Å; I116-K119 PolarHBondContact O-N 3.37Å; I116-K119 VanDerWaalsContact O-N 3.11Å; I116-D120 VanDerWaalsContact O-CG 3.31Å; I116-D120 PolarHBondContact O-N 3.07Å
117G97.9Very high97.3Very high22 Ų22104.1 Ų104.123%0.22749%0.485CS..Hα-helixtrans-60.5-33.717900000113.4E113 E114 R121E113-G117 PolarHBondContact O-N 2.88Å; E114-G117 PolarHBondContact O-N 3.39Å; G117-R121 WeakPolarHBondContact O-CG 3.32Å; G117-R121 PolarHBondContact O-N 3.43Å; G117-R121 PolarHBondContact O-NH1 3.49Å; G117-R121 VanDerWaalsContact O-NH1 3.11Å
118L97.8Very high97.3Very high74 Ų74103.9 Ų103.939%0.38748%0.484SS..Hα-helixtrans-70.5-45.3174-178.262.6000111.8E114 L115 I116 D120 R121 I122E114-L118 WeakPolarHBondContact O-CB 3.42Å; E114-L118 PolarHBondContact O-N 3.49Å; L115-L118 PolarHBondContact O-N 3.23Å; I116-L118 VanDerWaalsContact C-N 3.26Å; I116-L118 PolarHBondContact O-N 2.94Å; L118-D120 PolarHBondContact O-N 3.29Å; L118-R121 PolarHBondContact O-N 2.98Å; L118-I122 HydrophobicContact CD1-CD1 4.34Å; L118-I122 HydrophobicContact CG-CD1 4.08Å; L118-I122 WeakPolarHBondContact O-CG1 3.22Å; L118-I122 PolarHBondContact O-N 2.9Å
119K97.4Very high97.3Very high124 Ų124105 Ų10554%0.53949%0.488SS..Hα-helixtrans-59.1-46176.5-76.4178.3177.8-179.20111.3L115 I116 R121 I122 E123L115-K119 HydrophobicContact CG-CD 4.39Å; L115-K119 WeakPolarHBondContact O-CB 3.35Å; L115-K119 WeakPolarHBondContact O-CG 3.27Å; L115-K119 PolarHBondContact O-N 3.13Å; I116-K119 PolarHBondContact O-N 3.37Å; I116-K119 VanDerWaalsContact O-N 3.11Å; K119-R121 VanDerWaalsContact C-N 3.31Å; K119-R121 PolarHBondContact O-N 3.43Å; K119-I122 PolarHBondContact O-N 3.37Å; K119-E123 WeakPolarHBondContact O-CB 3.22Å; K119-E123 PolarHBondContact O-N 3.44Å
120D97.8Very high97.2Very high91 Ų91102.7 Ų102.749%0.48749%0.488SS..Hα-helixtrans-59.2-41.3177.8-69.8-6.6000111.7I116 L118 E123 H124I116-D120 VanDerWaalsContact O-CG 3.31Å; I116-D120 PolarHBondContact O-N 3.07Å; L118-D120 PolarHBondContact O-N 3.29Å; D120-E123 PolarHBondContact O-N 3.3Å; D120-H124 VanDerWaalsContact O-CB 3.27Å; D120-H124 WeakPolarHBondContact O-CB 3.32Å; D120-H124 PolarHBondContact O-N 2.81Å
121R98.1Very high97.2Very high145 Ų145101.5 Ų101.555%0.54748%0.484SS..Hα-helixtrans-67.2-36.2175.5-72.6-170.7-57.3-89.45.3112.7G117 L118 K119 R125G117-R121 WeakPolarHBondContact O-CG 3.32Å; G117-R121 PolarHBondContact O-N 3.43Å; G117-R121 PolarHBondContact O-NH1 3.49Å; G117-R121 VanDerWaalsContact O-NH1 3.11Å; L118-R121 PolarHBondContact O-N 2.98Å; K119-R121 VanDerWaalsContact C-N 3.31Å; K119-R121 PolarHBondContact O-N 3.43Å; R121-R125 WeakPolarHBondContact O-CG 3.27Å; R121-R125 PolarHBondContact O-N 2.84Å; R121-R125 PolarHBondContact O-NE 3.23Å
122I97.4Very high97.2Very high60 Ų60102 Ų10231%0.30849%0.486SS..Hα-helixtrans-68.7-47.1176-69.8169.8000109.8L118 K119 H124 R125 R126L118-I122 HydrophobicContact CD1-CD1 4.34Å; L118-I122 HydrophobicContact CG-CD1 4.08Å; L118-I122 WeakPolarHBondContact O-CG1 3.22Å; L118-I122 PolarHBondContact O-N 2.9Å; K119-I122 PolarHBondContact O-N 3.37Å; I122-H124 VanDerWaalsContact C-N 3.35Å; I122-H124 PolarHBondContact O-N 3.24Å; I122-R125 PolarHBondContact O-N 3.28Å; I122-R126 HydrophobicContact CG2-CG 4.47Å; I122-R126 WeakPolarHBondContact O-CG 3.43Å; I122-R126 PolarHBondContact O-N 3.27Å
123E97.4Very high97Very high130 Ų130103.2 Ų103.261%0.60749%0.492SS*.Hα-helixtrans-60.8-44.4178.3-174.4171.4-166.300111.1K119 D120 R125 R126 A127K119-E123 WeakPolarHBondContact O-CB 3.22Å; K119-E123 PolarHBondContact O-N 3.44Å; D120-E123 PolarHBondContact O-N 3.3Å; E123-R125 PolarHBondContact O-N 3.46Å; E123-R126 PolarHBondContact O-N 2.99Å; E123-A127 WeakPolarHBondContact O-CB 3.36Å; E123-A127 PolarHBondContact O-N 3.08Å
124H97.7Very high96.9Very high117 Ų117103.9 Ų103.954%0.54249%0.489SS..Hα-helixtrans-58.1-47.7175.4-169.465.5000112D120 I122 R126 A127 E128D120-H124 VanDerWaalsContact O-CB 3.27Å; D120-H124 WeakPolarHBondContact O-CB 3.32Å; D120-H124 PolarHBondContact O-N 2.81Å; I122-H124 VanDerWaalsContact C-N 3.35Å; I122-H124 PolarHBondContact O-N 3.24Å; H124-R126 VanDerWaalsContact C-N 3.34Å; H124-R126 PolarHBondContact O-N 2.89Å; H124-A127 PolarHBondContact O-N 2.86Å; H124-E128 IonicContact CD2-OE1 3.27Å; H124-E128 IonicContact NE2-OE1 2.68Å; H124-E128 PolarHBondContact NE2-OE1 2.88Å; H124-E128 WeakPolarHBondContact O-CG 3.34Å; H124-E128 PolarHBondContact O-N 3.39Å
125R97.8Very high96.9Very high123 Ų12399.6 Ų99.646%0.46447%0.472SS..Hα-helixtrans-64.3-37.1177-73.9-175.7-65.9-162.73.6112.8R121 I122 E123 R129R121-R125 WeakPolarHBondContact O-CG 3.27Å; R121-R125 PolarHBondContact O-N 2.84Å; R121-R125 PolarHBondContact O-NE 3.23Å; I122-R125 PolarHBondContact O-N 3.28Å; E123-R125 PolarHBondContact O-N 3.46Å; R125-R129 VanDerWaalsContact O-CG 3.29Å; R125-R129 WeakPolarHBondContact O-CG 3.25Å; R125-R129 PolarHBondContact O-N 3.37Å
126R97.4Very high96.8Very high173 Ų173103.9 Ų103.965%0.65348%0.482SS*.Hα-helixtrans-64.3-45.4174.6-76.5179.8175.2-177.3-2.5110.8I122 E123 H124 E128 R129 A130I122-R126 HydrophobicContact CG2-CG 4.47Å; I122-R126 WeakPolarHBondContact O-CG 3.43Å; I122-R126 PolarHBondContact O-N 3.27Å; E123-R126 PolarHBondContact O-N 2.99Å; H124-R126 VanDerWaalsContact C-N 3.34Å; H124-R126 PolarHBondContact O-N 2.89Å; R126-E128 PolarHBondContact O-N 2.92Å; R126-R129 PolarHBondContact O-N 3.02Å; R126-A130 WeakPolarHBondContact O-CB 3.46Å; R126-A130 PolarHBondContact O-N 2.91Å
127A95.6Very high96.7Very high55 Ų55102.3 Ų102.346%0.45548%0.484SS..Hα-helixtrans-62.1-42.1176.300000112E123 H124 A130 E131E123-A127 WeakPolarHBondContact O-CB 3.36Å; E123-A127 PolarHBondContact O-N 3.08Å; H124-A127 PolarHBondContact O-N 2.86Å; A127-A130 PolarHBondContact O-N 3.03Å; A127-E131 WeakPolarHBondContact O-CB 3.23Å; A127-E131 PolarHBondContact O-N 3.45Å
128E96.9Very high96.5Very high101 Ų101106.5 Ų106.547%0.47250%0.498SS..Hα-helixtrans-61.9-44.4174.9-74.3-175.9140.100112.2H124 R126 E131 I132H124-E128 IonicContact CD2-OE1 3.27Å; H124-E128 IonicContact NE2-OE1 2.68Å; H124-E128 PolarHBondContact NE2-OE1 2.88Å; H124-E128 WeakPolarHBondContact O-CG 3.34Å; H124-E128 PolarHBondContact O-N 3.39Å; R126-E128 PolarHBondContact O-N 2.92Å; E128-E131 PolarHBondContact O-N 3.08Å; E128-I132 WeakPolarHBondContact O-CB 3.44Å; E128-I132 VanDerWaalsContact O-CG1 3.23Å; E128-I132 WeakPolarHBondContact O-CG1 3.3Å; E128-I132 PolarHBondContact O-N 2.85Å
129R97.6Very high96.4Very high158 Ų158110 Ų11060%0.59651%0.51SS*.Hα-helixtrans-62.2-44.8175.8-71.3172.7-167166.40.3111.6R125 R126 E131 I132 Q133R125-R129 VanDerWaalsContact O-CG 3.29Å; R125-R129 WeakPolarHBondContact O-CG 3.25Å; R125-R129 PolarHBondContact O-N 3.37Å; R126-R129 PolarHBondContact O-N 3.02Å; R129-E131 VanDerWaalsContact C-N 3.31Å; R129-E131 PolarHBondContact O-N 3.35Å; R129-I132 PolarHBondContact O-N 3.18Å; R129-Q133 WeakPolarHBondContact O-CG 3.37Å; R129-Q133 PolarHBondContact O-N 2.86Å
130A96.1Very high96.2Very high54 Ų54108.1 Ų108.145%0.44650%0.503SS..Hα-helixtrans-60.4-42176.700000111.3R126 A127 Q133 R134R126-A130 WeakPolarHBondContact O-CB 3.46Å; R126-A130 PolarHBondContact O-N 2.91Å; A127-A130 PolarHBondContact O-N 3.03Å; A130-Q133 PolarHBondContact O-N 2.91Å; A130-R134 WeakPolarHBondContact O-CB 3.45Å; A130-R134 PolarHBondContact O-N 2.96Å
131E96.5Very high96Very high85 Ų85110.5 Ų110.540%0.39751%0.509SS..Hα-helixtrans-68.4-39.5177-17558.7-161.300112A127 E128 R129 Q133 R134 V135A127-E131 WeakPolarHBondContact O-CB 3.23Å; A127-E131 PolarHBondContact O-N 3.45Å; E128-E131 PolarHBondContact O-N 3.08Å; R129-E131 VanDerWaalsContact C-N 3.31Å; R129-E131 PolarHBondContact O-N 3.35Å; E131-Q133 VanDerWaalsContact C-N 3.33Å; E131-Q133 PolarHBondContact O-N 3.34Å; E131-R134 PolarHBondContact O-N 3.48Å; E131-R134 IonicContact OE1-CZ 2.83Å; E131-R134 IonicContact OE1-NE 2.67Å; E131-R134 PolarHBondContact OE1-NE 3.32Å; E131-R134 IonicContact OE1-NH2 3.46Å; E131-R134 PolarHBondContact OE1-NH2 3.33Å; E131-R134 IonicContact OE2-CZ 2.91Å; E131-R134 IonicContact OE2-NE 3.38Å; E131-R134 PolarHBondContact OE2-NE 3.44Å; E131-R134 IonicContact OE2-NH2 2.99Å; E131-V135 WeakPolarHBondContact O-CB 3.45Å; E131-V135 WeakPolarHBondContact O-CG2 3.48Å; E131-V135 PolarHBondContact O-N 2.96Å
132I96.6Very high95.7Very high86 Ų86108.7 Ų108.744%0.44151%0.51SS..Hα-helixtrans-59.2-45.7173.4-71.5164.3000110.6E128 R129 V135 R136E128-I132 WeakPolarHBondContact O-CB 3.44Å; E128-I132 VanDerWaalsContact O-CG1 3.23Å; E128-I132 WeakPolarHBondContact O-CG1 3.3Å; E128-I132 PolarHBondContact O-N 2.85Å; R129-I132 PolarHBondContact O-N 3.18Å; I132-V135 PolarHBondContact O-N 3.03Å; I132-R136 WeakPolarHBondContact O-CB 3.37Å; I132-R136 WeakPolarHBondContact O-CG 3.49Å; I132-R136 PolarHBondContact O-N 3.21Å
133Q93.6Very high95.6Very high132 Ų132112.7 Ų112.762%0.61752%0.521SS*.Hα-helixtrans-63-44176.3-74.3178.1-14.800111.4R129 A130 E131 V135 R136 A137R129-Q133 WeakPolarHBondContact O-CG 3.37Å; R129-Q133 PolarHBondContact O-N 2.86Å; A130-Q133 PolarHBondContact O-N 2.91Å; E131-Q133 VanDerWaalsContact C-N 3.33Å; E131-Q133 PolarHBondContact O-N 3.34Å; Q133-V135 PolarHBondContact O-N 2.91Å; Q133-R136 PolarHBondContact O-N 3.39Å; Q133-A137 WeakPolarHBondContact O-CB 3.36Å; Q133-A137 PolarHBondContact O-N 2.71Å
134R95.6Very high95.2Very high129 Ų129111.1 Ų111.149%0.48751%0.514SS..Hα-helixtrans-58.2-47.6176.8-165.8-173.975.576.43.1111.6A130 E131 R136 A137 E138A130-R134 WeakPolarHBondContact O-CB 3.45Å; A130-R134 PolarHBondContact O-N 2.96Å; E131-R134 PolarHBondContact O-N 3.48Å; E131-R134 IonicContact OE1-CZ 2.83Å; E131-R134 IonicContact OE1-NE 2.67Å; E131-R134 PolarHBondContact OE1-NE 3.32Å; E131-R134 IonicContact OE1-NH2 3.46Å; E131-R134 PolarHBondContact OE1-NH2 3.33Å; E131-R134 IonicContact OE2-CZ 2.91Å; E131-R134 IonicContact OE2-NE 3.38Å; E131-R134 PolarHBondContact OE2-NE 3.44Å; E131-R134 IonicContact OE2-NH2 2.99Å; R134-R136 PolarHBondContact O-N 2.81Å; R134-A137 PolarHBondContact O-N 3.09Å; R134-E138 IonicContact CZ-OE2 3.98Å; R134-E138 IonicContact NH1-OE2 3.95Å; R134-E138 PolarHBondContact NH1-OE2 3.32Å; R134-E138 VanDerWaalsContact NH1-OE2 3.09Å; R134-E138 WeakPolarHBondContact O-CB 3.32Å; R134-E138 PolarHBondContact O-N 2.86Å
135V96Very high94.7Very high49 Ų49109.7 Ų109.730%0.29751%0.51SS..Hα-helixtrans-65.5-38.5178.4171.10000111.6E131 I132 Q133 K139E131-V135 WeakPolarHBondContact O-CB 3.45Å; E131-V135 WeakPolarHBondContact O-CG2 3.48Å; E131-V135 PolarHBondContact O-N 2.96Å; I132-V135 PolarHBondContact O-N 3.03Å; Q133-V135 PolarHBondContact O-N 2.91Å; V135-K139 HydrophobicContact CG1-CD 4.27Å; V135-K139 WeakPolarHBondContact O-CB 3.38Å; V135-K139 WeakPolarHBondContact O-CG 3.45Å; V135-K139 PolarHBondContact O-N 3.39Å
136R95.5Very high94.4Very high177 Ų177112.2 Ų112.267%0.66852%0.52SS*.Hα-helixtrans-63.9-46.7174.4-75.8178-175.7172.42.3111.4I132 Q133 R134 E138 K139 E140I132-R136 WeakPolarHBondContact O-CB 3.37Å; I132-R136 WeakPolarHBondContact O-CG 3.49Å; I132-R136 PolarHBondContact O-N 3.21Å; Q133-R136 PolarHBondContact O-N 3.39Å; R134-R136 PolarHBondContact O-N 2.81Å; R136-E138 VanDerWaalsContact C-N 3.35Å; R136-E138 PolarHBondContact O-N 3.44Å; R136-K139 PolarHBondContact O-N 2.95Å; R136-E140 PolarHBondContact O-N 3.32Å
137A94.1Very high93.9Very high64 Ų64107.7 Ų107.753%0.52951%0.508SS..Hα-helixtrans-62-41.5177.100000111.9Q133 R134 E140 K141Q133-A137 WeakPolarHBondContact O-CB 3.36Å; Q133-A137 PolarHBondContact O-N 2.71Å; R134-A137 PolarHBondContact O-N 3.09Å; A137-E140 PolarHBondContact O-N 2.88Å; A137-K141 VanDerWaalsContact O-CB 3.29Å; A137-K141 WeakPolarHBondContact O-CB 3.38Å; A137-K141 PolarHBondContact O-N 3.16Å
138E93.8Very high93.5Very high109 Ų109107.8 Ų107.851%0.50951%0.508SS..Hα-helixtrans-64.4-43.3176.7-174.3168.3-170.200111.9R134 R136 K141 D142R134-E138 IonicContact CZ-OE2 3.98Å; R134-E138 IonicContact NH1-OE2 3.95Å; R134-E138 PolarHBondContact NH1-OE2 3.32Å; R134-E138 VanDerWaalsContact NH1-OE2 3.09Å; R134-E138 WeakPolarHBondContact O-CB 3.32Å; R134-E138 PolarHBondContact O-N 2.86Å; R136-E138 VanDerWaalsContact C-N 3.35Å; R136-E138 PolarHBondContact O-N 3.44Å; E138-K141 PolarHBondContact O-N 3.43Å; E138-D142 WeakPolarHBondContact O-CB 3.33Å; E138-D142 PolarHBondContact O-N 3.03Å
139K95.6Very high92.9Very high149 Ų149109.8 Ų109.865%0.64852%0.518SS*.Hα-helixtrans-64-41.8175.2-77.6179.3-179.9178.40112.9V135 R136 D142 R143V135-K139 HydrophobicContact CG1-CD 4.27Å; V135-K139 WeakPolarHBondContact O-CB 3.38Å; V135-K139 WeakPolarHBondContact O-CG 3.45Å; V135-K139 PolarHBondContact O-N 3.39Å; R136-K139 PolarHBondContact O-N 2.95Å; K139-D142 PolarHBondContact O-N 3.47Å; K139-R143 WeakPolarHBondContact O-CB 3.28Å; K139-R143 PolarHBondContact O-N 3.14Å
140E93.1Very high92.2Very high83 Ų83108.4 Ų108.439%0.38852%0.518SS..Hα-helixtrans-67.8-41177.1-175.154.6-149.200110.9R136 A137 D142 R143 Q144R136-E140 PolarHBondContact O-N 3.32Å; A137-E140 PolarHBondContact O-N 2.88Å; E140-D142 VanDerWaalsContact C-N 3.35Å; E140-D142 PolarHBondContact O-N 3.13Å; E140-R143 WeakPolarHBondContact O-CB 3.33Å; E140-R143 PolarHBondContact O-N 2.9Å; E140-R143 IonicContact OE1-NH1 3.33Å; E140-Q144 VanDerWaalsContact O-CG 3.31Å; E140-Q144 WeakPolarHBondContact O-CG 3.38Å; E140-Q144 PolarHBondContact O-N 3.38Å; E140-Q144 PolarHBondContact OE1-NE2 2.95Å
141K94.3Very high91.5Very high141 Ų141114 Ų11461%0.61353%0.528SS*.Hα-helixtrans-60-43.6174-173.1-179.1-179.5-178.60112A137 E138 Q144 N145A137-K141 VanDerWaalsContact O-CB 3.29Å; A137-K141 WeakPolarHBondContact O-CB 3.38Å; A137-K141 PolarHBondContact O-N 3.16Å; E138-K141 PolarHBondContact O-N 3.43Å; K141-Q144 PolarHBondContact O-N 2.89Å; K141-N145 WeakPolarHBondContact O-CB 3.36Å; K141-N145 PolarHBondContact O-N 3.42Å; K141-N145 PolarHBondContact O-ND2 2.96Å
142D92.3Very high90.6Very high107 Ų107114.7 Ų114.757%0.57253%0.531SS*.Hα-helixtrans-63.5-41.3176.4-171.762.2000111.9E138 K139 E140 Q144 N145 R146E138-D142 WeakPolarHBondContact O-CB 3.33Å; E138-D142 PolarHBondContact O-N 3.03Å; K139-D142 PolarHBondContact O-N 3.47Å; E140-D142 VanDerWaalsContact C-N 3.35Å; E140-D142 PolarHBondContact O-N 3.13Å; D142-Q144 PolarHBondContact O-N 3.31Å; D142-N145 PolarHBondContact O-N 3.42Å; D142-R146 WeakPolarHBondContact O-CB 3.47Å; D142-R146 PolarHBondContact O-N 3.47Å
143R93.3Very high89.9Confident145 Ų145118.4 Ų118.455%0.54754%0.539SS..Hα-helixtrans-60.7-46.5174.3-176.5174.8177-96.1-1.8111.9K139 E140 R146 I147K139-R143 WeakPolarHBondContact O-CB 3.28Å; K139-R143 PolarHBondContact O-N 3.14Å; E140-R143 WeakPolarHBondContact O-CB 3.33Å; E140-R143 PolarHBondContact O-N 2.9Å; E140-R143 IonicContact OE1-NH1 3.33Å; R143-R146 PolarHBondContact O-N 2.97Å; R143-I147 HydrophobicContact CG-CD1 4.2Å; R143-I147 VanDerWaalsContact O-CG1 3.3Å; R143-I147 WeakPolarHBondContact O-CG1 3.5Å; R143-I147 PolarHBondContact O-N 3.35Å; R143-I147 VanDerWaalsContact O-N 3.07Å
144Q89.3Confident89.3Confident97 Ų97118.3 Ų118.345%0.45354%0.537SS..Hα-helixtrans-62.9-42.3175.9-67.4-62.3-26.600111.5E140 K141 D142 R146 I147 A148E140-Q144 VanDerWaalsContact O-CG 3.31Å; E140-Q144 WeakPolarHBondContact O-CG 3.38Å; E140-Q144 PolarHBondContact O-N 3.38Å; E140-Q144 PolarHBondContact OE1-NE2 2.95Å; K141-Q144 PolarHBondContact O-N 2.89Å; D142-Q144 PolarHBondContact O-N 3.31Å; Q144-R146 PolarHBondContact O-N 2.86Å; Q144-I147 PolarHBondContact O-N 3.23Å; Q144-A148 WeakPolarHBondContact O-CB 3.49Å; Q144-A148 PolarHBondContact O-N 2.83Å
145N88.8Confident88.3Confident87 Ų87117.3 Ų117.347%0.46554%0.538SS..Hα-helixtrans-62.2-43.6176.7-73.3-15.8000111.9K141 D142 I147 A148 E149K141-N145 WeakPolarHBondContact O-CB 3.36Å; K141-N145 PolarHBondContact O-N 3.42Å; K141-N145 PolarHBondContact O-ND2 2.96Å; D142-N145 PolarHBondContact O-N 3.42Å; N145-I147 PolarHBondContact O-N 3.5Å; N145-A148 PolarHBondContact O-N 2.88Å; N145-E149 VanDerWaalsContact O-CB 3.31Å; N145-E149 WeakPolarHBondContact O-CB 3.43Å; N145-E149 PolarHBondContact O-N 3.45Å
146R90.4Very high87.3Confident176 Ų176120.4 Ų120.466%0.66455%0.549SS*.Hα-helixtrans-63.1-40.6176.9-179.9178.4148.7-173.8-6.9112.1D142 R143 Q144 E149 E150D142-R146 WeakPolarHBondContact O-CB 3.47Å; D142-R146 PolarHBondContact O-N 3.47Å; R143-R146 PolarHBondContact O-N 2.97Å; Q144-R146 PolarHBondContact O-N 2.86Å; R146-E149 PolarHBondContact O-N 3.25Å; R146-E150 WeakPolarHBondContact O-CB 3.31Å; R146-E150 PolarHBondContact O-N 3.36Å
147I87.7Confident86.5Confident77 Ų77117.5 Ų117.540%0.39554%0.543SS..Hα-helixtrans-65.3-42.9175.2-67.2166.2000110.5R143 Q144 N145 E150 R151R143-I147 HydrophobicContact CG-CD1 4.2Å; R143-I147 VanDerWaalsContact O-CG1 3.3Å; R143-I147 WeakPolarHBondContact O-CG1 3.5Å; R143-I147 PolarHBondContact O-N 3.35Å; R143-I147 VanDerWaalsContact O-N 3.07Å; Q144-I147 PolarHBondContact O-N 3.23Å; N145-I147 PolarHBondContact O-N 3.5Å; I147-E150 PolarHBondContact O-N 2.94Å; I147-R151 WeakPolarHBondContact O-CB 3.34Å; I147-R151 PolarHBondContact O-N 3.28Å
148A86.7Confident85.7Confident57 Ų57120 Ų12047%0.47154%0.544SS..Hα-helixtrans-64.9-41.2177.300000111.9Q144 N145 R151 H152Q144-A148 WeakPolarHBondContact O-CB 3.49Å; Q144-A148 PolarHBondContact O-N 2.83Å; N145-A148 PolarHBondContact O-N 2.88Å; A148-R151 PolarHBondContact O-N 2.87Å; A148-H152 VanDerWaalsContact O-CB 3.27Å; A148-H152 WeakPolarHBondContact O-CB 3.35Å; A148-H152 PolarHBondContact O-N 3.32Å
149E84.8Confident84.8Confident143 Ų143117.3 Ų117.367%0.66854%0.54SS*.Hα-helixtrans-69.5-39.7177.7-170.5177.1-173.600111.8N145 R146 H152 R153N145-E149 VanDerWaalsContact O-CB 3.31Å; N145-E149 WeakPolarHBondContact O-CB 3.43Å; N145-E149 PolarHBondContact O-N 3.45Å; R146-E149 PolarHBondContact O-N 3.25Å; E149-H152 PolarHBondContact O-N 2.88Å; E149-R153 VanDerWaalsContact O-CB 3.31Å; E149-R153 WeakPolarHBondContact O-CB 3.4Å; E149-R153 PolarHBondContact O-N 3.45Å
150E82.2Confident84.1Confident129 Ų129117.2 Ų117.260%0.60354%0.54SS*.Hα-helixtrans-65.5-41.7174-171.1178.4171.500111.5R146 I147 R153 K154R146-E150 WeakPolarHBondContact O-CB 3.31Å; R146-E150 PolarHBondContact O-N 3.36Å; I147-E150 PolarHBondContact O-N 2.94Å; E150-R153 PolarHBondContact O-N 3.08Å; E150-K154 WeakPolarHBondContact O-CB 3.25Å; E150-K154 PolarHBondContact O-N 3.45Å
151R81.6Confident83.6Confident173 Ų173120 Ų12065%0.65355%0.55SS**Hα-helixtrans-60.8-45.8171.5177.7-177.1-93.4171.5-6.4110.6I147 A148 K154 E155I147-R151 WeakPolarHBondContact O-CB 3.34Å; I147-R151 PolarHBondContact O-N 3.28Å; A148-R151 PolarHBondContact O-N 2.87Å; R151-K154 PolarHBondContact O-N 3.28Å; R151-E155 WeakPolarHBondContact CD-OE1 3.14Å; R151-E155 HydrophobicContact CG-CG 4.4Å; R151-E155 VanDerWaalsContact CG-OE1 3.22Å; R151-E155 WeakPolarHBondContact CG-OE1 3.49Å; R151-E155 WeakPolarHBondContact O-CB 3.33Å; R151-E155 VanDerWaalsContact O-CG 3.27Å; R151-E155 WeakPolarHBondContact O-CG 3.29Å; R151-E155 PolarHBondContact O-N 3.45Å
152H77.6Confident83Confident99 Ų99119 Ų11946%0.45855%0.546SS..Hα-helixtrans-63.7-43.2179.6-169.6-96000111.7A148 E149 K154 E155 E156A148-H152 VanDerWaalsContact O-CB 3.27Å; A148-H152 WeakPolarHBondContact O-CB 3.35Å; A148-H152 PolarHBondContact O-N 3.32Å; E149-H152 PolarHBondContact O-N 2.88Å; H152-K154 PolarHBondContact O-N 2.67Å; H152-E155 PolarHBondContact O-N 2.88Å; H152-E156 IonicContact CE1-OE1 3.87Å; H152-E156 PolarHBondContact CE1-OE1 3.37Å; H152-E156 IonicContact ND1-OE1 3.09Å; H152-E156 PolarHBondContact ND1-OE1 2.94Å; H152-E156 WeakPolarHBondContact O-CB 3.43Å; H152-E156 WeakPolarHBondContact O-CG 3.26Å; H152-E156 PolarHBondContact O-N 3.46Å
153R81.4Confident82.4Confident163 Ų163116.1 Ų116.162%0.61554%0.537SS*.Hα-helixtrans-64.2-40.7176.3-174.8178172.3172.31.3111.9E149 E150 E156 E157E149-R153 VanDerWaalsContact O-CB 3.31Å; E149-R153 WeakPolarHBondContact O-CB 3.4Å; E149-R153 PolarHBondContact O-N 3.45Å; E150-R153 PolarHBondContact O-N 3.08Å; R153-E156 PolarHBondContact O-N 3.28Å; R153-E157 IonicContact NE-OE1 2.71Å; R153-E157 PolarHBondContact NE-OE1 3.01Å; R153-E157 IonicContact NH2-OE1 3.99Å; R153-E157 WeakPolarHBondContact O-CB 3.29Å; R153-E157 WeakPolarHBondContact O-CG 3.39Å; R153-E157 PolarHBondContact O-N 3.07Å
154K81.4Confident81.8Confident130 Ų130112.7 Ų112.757%0.56553%0.53SS*.Hα-helixtrans-65-40.7173.9-173.7175.6179.4-178.60111.7E150 R151 H152 E157 E158E150-K154 WeakPolarHBondContact O-CB 3.25Å; E150-K154 PolarHBondContact O-N 3.45Å; R151-K154 PolarHBondContact O-N 3.28Å; H152-K154 PolarHBondContact O-N 2.67Å; K154-E157 PolarHBondContact O-N 3.33Å; K154-E158 VanDerWaalsContact CE-OE1 3.31Å; K154-E158 WeakPolarHBondContact CE-OE1 3.44Å; K154-E158 WeakPolarHBondContact O-CB 3.08Å; K154-E158 WeakPolarHBondContact O-CG 3.43Å; K154-E158 PolarHBondContact O-N 3.44Å
155E75.4Confident81.4Confident109 Ų109110.9 Ų110.951%0.50952%0.523SS..Hα-helixtrans-64.7-37.9174.6-75.3175.5-165.300112.1R151 H152 A159R151-E155 WeakPolarHBondContact CD-OE1 3.14Å; R151-E155 HydrophobicContact CG-CG 4.4Å; R151-E155 VanDerWaalsContact CG-OE1 3.22Å; R151-E155 WeakPolarHBondContact CG-OE1 3.49Å; R151-E155 WeakPolarHBondContact O-CB 3.33Å; R151-E155 VanDerWaalsContact O-CG 3.27Å; R151-E155 WeakPolarHBondContact O-CG 3.29Å; R151-E155 PolarHBondContact O-N 3.45Å; H152-E155 PolarHBondContact O-N 2.88Å; E155-A159 WeakPolarHBondContact O-CB 3.5Å; E155-A159 PolarHBondContact O-N 3.12Å
156E73.7Confident80.7Confident114 Ų114109.1 Ų109.153%0.53351%0.514SS..Hα-helixtrans-68.5-41.9174.7-75.7-174.515800112.5H152 R153 A159 K160H152-E156 IonicContact CE1-OE1 3.87Å; H152-E156 PolarHBondContact CE1-OE1 3.37Å; H152-E156 IonicContact ND1-OE1 3.09Å; H152-E156 PolarHBondContact ND1-OE1 2.94Å; H152-E156 WeakPolarHBondContact O-CB 3.43Å; H152-E156 WeakPolarHBondContact O-CG 3.26Å; H152-E156 PolarHBondContact O-N 3.46Å; R153-E156 PolarHBondContact O-N 3.28Å; E156-A159 PolarHBondContact O-N 2.96Å; E156-K160 VanDerWaalsContact O-CB 3.3Å; E156-K160 WeakPolarHBondContact O-CB 3.43Å; E156-K160 PolarHBondContact O-N 2.94Å
157E78.9Confident80.1Confident116 Ų116105.9 Ų105.954%0.54251%0.509SS..Hα-helixtrans-67.3-41175.8-73.4179.4-168.600111.7R153 K154 K160 K161R153-E157 IonicContact NE-OE1 2.71Å; R153-E157 PolarHBondContact NE-OE1 3.01Å; R153-E157 IonicContact NH2-OE1 3.99Å; R153-E157 WeakPolarHBondContact O-CB 3.29Å; R153-E157 WeakPolarHBondContact O-CG 3.39Å; R153-E157 PolarHBondContact O-N 3.07Å; K154-E157 PolarHBondContact O-N 3.33Å; E157-K160 PolarHBondContact O-N 3.39Å; E157-K161 WeakPolarHBondContact O-CB 3.23Å; E157-K161 PolarHBondContact O-N 3.39Å
158E76.6Confident79.6Confident116 Ų116108.4 Ų108.454%0.54252%0.517SS..Hα-helixtrans-67.8-37.5173.1-75.5-177-169.200112.1K154 K162K154-E158 VanDerWaalsContact CE-OE1 3.31Å; K154-E158 WeakPolarHBondContact CE-OE1 3.44Å; K154-E158 WeakPolarHBondContact O-CB 3.08Å; K154-E158 WeakPolarHBondContact O-CG 3.43Å; K154-E158 PolarHBondContact O-N 3.44Å; E158-K162 WeakPolarHBondContact O-CB 3.33Å; E158-K162 PolarHBondContact O-N 2.97Å
159A76.8Confident79Confident53 Ų53111.3 Ų111.344%0.43852%0.519SS..Hα-helixtrans-65.7-40.1174.200000111.7E155 E156 A163E155-A159 WeakPolarHBondContact O-CB 3.5Å; E155-A159 PolarHBondContact O-N 3.12Å; E156-A159 PolarHBondContact O-N 2.96Å; A159-A163 WeakPolarHBondContact O-CB 3.28Å; A159-A163 PolarHBondContact O-N 2.98Å
160K80.2Confident78.4Confident147 Ų147107.8 Ų107.864%0.63950%0.502SS*.Hα-helixtrans-67.8-45.7175.9-171.6178.5179.4-177.40111.5E156 E157 K162 A163 D164E156-K160 VanDerWaalsContact O-CB 3.3Å; E156-K160 WeakPolarHBondContact O-CB 3.43Å; E156-K160 PolarHBondContact O-N 2.94Å; E157-K160 PolarHBondContact O-N 3.39Å; K160-K162 VanDerWaalsContact C-N 3.33Å; K160-K162 PolarHBondContact O-N 2.96Å; K160-A163 PolarHBondContact O-N 3.04Å; K160-D164 PolarHBondContact O-N 3.46Å
161K81.4Confident78Confident141 Ų141110.1 Ų110.161%0.61351%0.51SS*.Hα-helixtrans-62.1-41.1175.1-173.5179.3177.1-176.60111.6E157 D164 D165E157-K161 WeakPolarHBondContact O-CB 3.23Å; E157-K161 PolarHBondContact O-N 3.39Å; K161-D164 PolarHBondContact O-N 3.43Å; K161-D165 WeakPolarHBondContact O-CB 3.42Å; K161-D165 PolarHBondContact O-N 3.31Å
162K81.6Confident77.4Confident120 Ų120106.9 Ų106.952%0.52251%0.509SS..Hα-helixtrans-64.6-39.4174.6-174.9169.8-176.3169.10111.9E158 K160 D166E158-K162 WeakPolarHBondContact O-CB 3.33Å; E158-K162 PolarHBondContact O-N 2.97Å; K160-K162 VanDerWaalsContact C-N 3.33Å; K160-K162 PolarHBondContact O-N 2.96Å; K162-D166 WeakPolarHBondContact O-CB 3.4Å; K162-D166 PolarHBondContact O-N 3.02Å
163A80.8Confident76.7Confident46 Ų46104.5 Ų104.538%0.3850%0.499SS..Hα-helixtrans-65.5-42.3174.500000111.9A159 K160 D166 L167A159-A163 WeakPolarHBondContact O-CB 3.28Å; A159-A163 PolarHBondContact O-N 2.98Å; K160-A163 PolarHBondContact O-N 3.04Å; A163-D166 PolarHBondContact O-N 2.9Å; A163-L167 WeakPolarHBondContact O-CB 3.48Å; A163-L167 WeakPolarHBondContact O-CD1 3.41Å; A163-L167 VanDerWaalsContact O-CG 3.3Å; A163-L167 WeakPolarHBondContact O-CG 3.49Å; A163-L167 PolarHBondContact O-N 3.43Å
164D80.3Confident75.9Confident73 Ų73101.9 Ų101.939%0.3951%0.506SS..Hα-helixtrans-67.1-40.3176.8-76.7-14.6000112.1K160 K161 L167 K168K160-D164 PolarHBondContact O-N 3.46Å; K161-D164 PolarHBondContact O-N 3.43Å; D164-L167 PolarHBondContact O-N 2.88Å; D164-K168 WeakPolarHBondContact O-CB 3.39Å; D164-K168 VanDerWaalsContact O-CG 3.24Å; D164-K168 WeakPolarHBondContact O-CG 3.48Å; D164-K168 PolarHBondContact O-N 3.26Å
165D80.1Confident75Confident59 Ų5998.9 Ų98.932%0.31651%0.512SS..Hα-helixtrans-68.7-37.5174.6-74.7-14.9000111.4K161 K168 K169K161-D165 WeakPolarHBondContact O-CB 3.42Å; K161-D165 PolarHBondContact O-N 3.31Å; D165-K168 PolarHBondContact O-N 2.92Å; D165-K169 VanDerWaalsContact O-CB 3.23Å; D165-K169 WeakPolarHBondContact O-CB 3.4Å; D165-K169 WeakPolarHBondContact O-CG 3.38Å; D165-K169 PolarHBondContact O-N 3.42Å
166D75Confident74.1Confident51 Ų51101.6 Ų101.627%0.27353%0.527SS..Hα-helixtrans-69.1-35.2174-77-12.8000111.6K162 A163 K170K162-D166 WeakPolarHBondContact O-CB 3.4Å; K162-D166 PolarHBondContact O-N 3.02Å; A163-D166 PolarHBondContact O-N 2.9Å; D166-K170 VanDerWaalsContact O-CB 3.23Å; D166-K170 WeakPolarHBondContact O-CB 3.28Å; D166-K170 VanDerWaalsContact O-CG 3.24Å; D166-K170 WeakPolarHBondContact O-CG 3.26Å; D166-K170 PolarHBondContact O-N 3.5Å
167L77.5Confident73.3Confident108 Ų10898.4 Ų98.457%0.56552%0.524SS*.Hα-helixtrans-66.6-44.2172-81.8161.5000111.5A163 D164 K170 K171A163-L167 WeakPolarHBondContact O-CB 3.48Å; A163-L167 WeakPolarHBondContact O-CD1 3.41Å; A163-L167 VanDerWaalsContact O-CG 3.3Å; A163-L167 WeakPolarHBondContact O-CG 3.49Å; A163-L167 PolarHBondContact O-N 3.43Å; D164-L167 PolarHBondContact O-N 2.88Å; L167-K170 PolarHBondContact O-N 3.36Å; L167-K171 WeakPolarHBondContact O-CB 3.42Å; L167-K171 PolarHBondContact O-N 2.84Å
168K77.2Confident72.4Confident130 Ų13097.7 Ų97.757%0.56554%0.538SS*.Hα-helixtrans-63.8-45174.1-73.2168.1-171.7167.10111D164 D165 K171 V172D164-K168 WeakPolarHBondContact O-CB 3.39Å; D164-K168 VanDerWaalsContact O-CG 3.24Å; D164-K168 WeakPolarHBondContact O-CG 3.48Å; D164-K168 PolarHBondContact O-N 3.26Å; D165-K168 PolarHBondContact O-N 2.92Å; K168-K171 WeakPolarHBondContact O-CB 3.45Å; K168-K171 PolarHBondContact O-N 3.39Å; K168-V172 VanDerWaalsContact O-CG2 3.27Å; K168-V172 WeakPolarHBondContact O-CG2 3.41Å; K168-V172 PolarHBondContact O-N 3.05Å
169K74.8Confident71.6Confident117 Ų117100 Ų10051%0.50955%0.554SS.*Hα-helixtrans-61.2-45.6174.9-76.3169.7-171.3170.40111.5D165 K171 V172 L173D165-K169 VanDerWaalsContact O-CB 3.23Å; D165-K169 WeakPolarHBondContact O-CB 3.4Å; D165-K169 WeakPolarHBondContact O-CG 3.38Å; D165-K169 PolarHBondContact O-N 3.42Å; K169-K171 VanDerWaalsContact C-N 3.32Å; K169-K171 PolarHBondContact O-N 3.27Å; K169-V172 PolarHBondContact O-N 2.95Å; K169-L173 HydrophobicContact CB-CD1 4.32Å; K169-L173 VanDerWaalsContact O-CB 3.23Å; K169-L173 WeakPolarHBondContact O-CB 3.43Å; K169-L173 WeakPolarHBondContact O-CD1 3.4Å; K169-L173 VanDerWaalsContact O-CG 3.3Å; K169-L173 WeakPolarHBondContact O-CG 3.48Å; K169-L173 PolarHBondContact O-N 2.95Å
170K72.1Confident70.6Confident70 Ų70102 Ų10230%0.30455%0.554SS.*Hα-helixtrans-59.1-42.6173.6-83176.2168.1-171.40111.8D166 L167 V172 L173 S174 L184 E188D166-K170 VanDerWaalsContact O-CB 3.23Å; D166-K170 WeakPolarHBondContact O-CB 3.28Å; D166-K170 VanDerWaalsContact O-CG 3.24Å; D166-K170 WeakPolarHBondContact O-CG 3.26Å; D166-K170 PolarHBondContact O-N 3.5Å; L167-K170 PolarHBondContact O-N 3.36Å; K170-V172 VanDerWaalsContact C-N 3.35Å; K170-V172 PolarHBondContact O-N 3.35Å; K170-L173 PolarHBondContact O-N 2.98Å; K170-S174 WeakPolarHBondContact O-CB 3.27Å; K170-S174 PolarHBondContact O-N 3.34Å; K170-L184 HydrophobicContact CG-CD1 4.11Å; K170-E188 IonicContact NZ-OE1 2.59Å; K170-E188 PolarHBondContact NZ-OE1 2.91Å; K170-E188 IonicContact NZ-OE2 2.69Å; K170-E188 PolarHBondContact NZ-OE2 3.14Å
171K72.7Confident69.6Low177 Ų17797.3 Ų97.377%0.7755%0.547SS*.Hα-helixtrans-63.5-39.8176.7-169.5175.3-179179.10111.9L167 K168 K169L167-K171 WeakPolarHBondContact O-CB 3.42Å; L167-K171 PolarHBondContact O-N 2.84Å; K168-K171 WeakPolarHBondContact O-CB 3.45Å; K168-K171 PolarHBondContact O-N 3.39Å; K169-K171 VanDerWaalsContact C-N 3.32Å; K169-K171 PolarHBondContact O-N 3.27Å
172V70.9Confident68.8Low106 Ų10693.2 Ų93.264%0.64254%0.544SS*.Hα-helixtrans-72-44176.8173.20000111.6K168 K169 K170 G175 M176K168-V172 VanDerWaalsContact O-CG2 3.27Å; K168-V172 WeakPolarHBondContact O-CG2 3.41Å; K168-V172 PolarHBondContact O-N 3.05Å; K169-V172 PolarHBondContact O-N 2.95Å; K170-V172 VanDerWaalsContact C-N 3.35Å; K170-V172 PolarHBondContact O-N 3.35Å; V172-G175 WeakPolarHBondContact O-CA 3.37Å; V172-G175 PolarHBondContact O-N 2.91Å; V172-M176 PolarHBondContact O-N 2.96Å
173L61.6Low67.9Low49 Ų4995 Ų9526%0.25755%0.553SS.*Hα-helixtrans-75.1-27.6-178.8-73.2159.6000113.2K169 K170 G175 M176 F180 L184K169-L173 HydrophobicContact CB-CD1 4.32Å; K169-L173 VanDerWaalsContact O-CB 3.23Å; K169-L173 WeakPolarHBondContact O-CB 3.43Å; K169-L173 WeakPolarHBondContact O-CD1 3.4Å; K169-L173 VanDerWaalsContact O-CG 3.3Å; K169-L173 WeakPolarHBondContact O-CG 3.48Å; K169-L173 PolarHBondContact O-N 2.95Å; K170-L173 PolarHBondContact O-N 2.98Å; L173-G175 PolarHBondContact O-N 3.33Å; L173-M176 PolarHBondContact O-N 3.39Å; L173-M176 VanDerWaalsContact O-N 3.1Å; L173-F180 HydrophobicContact CB-CD1 4.19Å; L173-F180 HydrophobicContact CD1-CD1 3.39Å; L173-F180 HydrophobicContact CD1-CE1 3.2Å; L173-F180 HydrophobicContact CD1-CG 4.38Å; L173-F180 HydrophobicContact CD1-CZ 4.07Å; L173-F180 HydrophobicContact CD2-CB 4.2Å; L173-F180 HydrophobicContact CD2-CD1 3.58Å; L173-F180 HydrophobicContact CD2-CD2 4.22Å; L173-F180 HydrophobicContact CD2-CE1 3.94Å; L173-F180 HydrophobicContact CD2-CG 3.73Å; L173-F180 HydrophobicContact CD2-CZ 4.38Å; L173-F180 HydrophobicContact CG-CD1 3.9Å; L173-F180 HydrophobicContact CG-CE1 4.13Å; L173-L184 HydrophobicContact CD1-CD1 3.91Å
174S63.9Low66.9Low107 Ų10794.8 Ų94.875%0.74855%0.545SS*.THydrogen-bonded Turntrans-62.4-20.7166.6-173.20000112K170K170-S174 WeakPolarHBondContact O-CB 3.27Å; K170-S174 PolarHBondContact O-N 3.34Å
175G62.5Low66.1Low68 Ų6894.2 Ų94.270%0.70155%0.551SS**THydrogen-bonded Turntrans-88.5-16.4172.500000114.9V172 L173V172-G175 WeakPolarHBondContact O-CA 3.37Å; V172-G175 PolarHBondContact O-N 2.91Å; L173-G175 PolarHBondContact O-N 3.33Å
176M58.5Low65.2Low165 Ų16598 Ų9881%0.81356%0.564SS**SBendtrans-103.513-169.8-155.474.9144.800114.4V172 L173V172-M176 PolarHBondContact O-N 2.96Å; L173-M176 PolarHBondContact O-N 3.39Å; L173-M176 VanDerWaalsContact O-N 3.1Å
177G55.9Low64.4Low47 Ų4798.2 Ų98.249%0.48557%0.573SS.*  trans101.2147.9169.700000115.5N179G177-N179 PolarHBondContact O-N 3.26Å
178A60.3Low63.4Low101 Ų10198.2 Ų98.284%0.83557%0.57SS**THydrogen-bonded Turntrans-65.59.4-160.100000117.9
179N59.6Low62.6Low164 Ų16495.9 Ų95.988%0.87757%0.57SS**THydrogen-bonded Turntrans-106.3-9.3-174.2-70.6-15.4000114.8G177G177-N179 PolarHBondContact O-N 3.26Å
180F56Low61.7Low96 Ų9699.9 Ų99.942%0.42158%0.582SS.*SBendtrans-89.3-15.3176.5-163.5-92000113.6L173 G182 F183 L184L173-F180 HydrophobicContact CB-CD1 4.19Å; L173-F180 HydrophobicContact CD1-CD1 3.39Å; L173-F180 HydrophobicContact CD1-CE1 3.2Å; L173-F180 HydrophobicContact CD1-CG 4.38Å; L173-F180 HydrophobicContact CD1-CZ 4.07Å; L173-F180 HydrophobicContact CD2-CB 4.2Å; L173-F180 HydrophobicContact CD2-CD1 3.58Å; L173-F180 HydrophobicContact CD2-CD2 4.22Å; L173-F180 HydrophobicContact CD2-CE1 3.94Å; L173-F180 HydrophobicContact CD2-CG 3.73Å; L173-F180 HydrophobicContact CD2-CZ 4.38Å; L173-F180 HydrophobicContact CG-CD1 3.9Å; L173-F180 HydrophobicContact CG-CE1 4.13Å; F180-G182 VanDerWaalsContact C-N 3.27Å; F180-G182 PolarHBondContact O-N 3.3Å; F180-F183 PolarHBondContact O-N 3.34Å; F180-L184 HydrophobicContact CD1-CD1 3.96Å; F180-L184 HydrophobicContact CD1-CG 4.34Å; F180-L184 HydrophobicContact CE1-CD1 3.8Å; F180-L184 HydrophobicContact CE1-CG 3.95Å
181G59.6Low60.8Low48 Ų48104.3 Ų104.350%0.49560%0.601SS.*Hα-helixtrans-64.5-24.5-175.200000115.1F183 A185G181-F183 PolarHBondContact O-N 3.26Å; G181-A185 WeakPolarHBondContact O-CB 3.45Å; G181-A185 PolarHBondContact O-N 3.19Å
182G65.1Low59.9Low55 Ų5599.2 Ų99.257%0.56759%0.588SS**Hα-helixtrans-70-28.3-17800000114.7F180F180-G182 VanDerWaalsContact C-N 3.27Å; F180-G182 PolarHBondContact O-N 3.3Å
183F62.6Low59.7Low159 Ų159104.4 Ų104.470%0.69760%0.602SS**Hα-helixtrans-80-41-179-173.2-102.8000111.9F180 G181 K186 A187F180-F183 PolarHBondContact O-N 3.34Å; G181-F183 PolarHBondContact O-N 3.26Å; F183-K186 PolarHBondContact O-N 3.43Å; F183-A187 PolarHBondContact O-N 3.48Å
184L59.6Low60.4Low40 Ų40112.4 Ų112.421%0.20963%0.628CS.*Hα-helixtrans-69.9-39.9178.3-74.4172000112.8K170 L173 F180 K186 A187 E188K170-L184 HydrophobicContact CG-CD1 4.11Å; L173-L184 HydrophobicContact CD1-CD1 3.91Å; F180-L184 HydrophobicContact CD1-CD1 3.96Å; F180-L184 HydrophobicContact CD1-CG 4.34Å; F180-L184 HydrophobicContact CE1-CD1 3.8Å; F180-L184 HydrophobicContact CE1-CG 3.95Å; L184-K186 PolarHBondContact O-N 2.9Å; L184-A187 PolarHBondContact O-N 3.07Å; L184-E188 PolarHBondContact O-N 3.01Å; L184-E188 VanDerWaalsContact O-N 3.09Å
185A62.7Low61.3Low62 Ų62111.3 Ų111.351%0.51261%0.614SS.*Hα-helixtrans-62.3-32.9175.900000112.6G181 S189G181-A185 WeakPolarHBondContact O-CB 3.45Å; G181-A185 PolarHBondContact O-N 3.19Å; A185-S189 PolarHBondContact O-N 3.2Å
186K60.5Low62.5Low139 Ų139111.4 Ų111.460%0.60460%0.601SS**Hα-helixtrans-76.8-26.6178.4-153.1165.2-173.4164.60112.6F183 L184 R190F183-K186 PolarHBondContact O-N 3.43Å; L184-K186 PolarHBondContact O-N 2.9Å; K186-R190 WeakPolarHBondContact O-CG 3.44Å
187A59.3Low64.1Low54 Ų54106.5 Ų106.545%0.44659%0.593SS.*Hα-helixtrans-76.1-41174.200000112.1F183 L184 R190F183-A187 PolarHBondContact O-N 3.48Å; L184-A187 PolarHBondContact O-N 3.07Å; A187-R190 PolarHBondContact O-N 2.86Å
188E57Low65.8Low109 Ų109113.2 Ų113.251%0.50960%0.603SS.*Hα-helixtrans-68.7-35.6176-83.5-17915300113K170 L184 R190 K191K170-E188 IonicContact NZ-OE1 2.59Å; K170-E188 PolarHBondContact NZ-OE1 2.91Å; K170-E188 IonicContact NZ-OE2 2.69Å; K170-E188 PolarHBondContact NZ-OE2 3.14Å; L184-E188 PolarHBondContact O-N 3.01Å; L184-E188 VanDerWaalsContact O-N 3.09Å; E188-R190 PolarHBondContact O-N 3.48Å; E188-K191 PolarHBondContact O-N 2.87Å
189S60.2Low67.3Low80 Ų80112.2 Ų112.256%0.55958%0.581SS**THydrogen-bonded Turntrans-65.9-21.8175.8126.40000113.5A185A185-S189 PolarHBondContact O-N 3.2Å
190R55.9Low69Low202 Ų202108.5 Ų108.576%0.76256%0.561SS**THydrogen-bonded Turntrans-85.1-12.4178-75.2-178178.3-171.3-0.7113.5K186 A187 E188K186-R190 WeakPolarHBondContact O-CG 3.44Å; A187-R190 PolarHBondContact O-N 2.86Å; E188-R190 PolarHBondContact O-N 3.48Å
191K52.1Low70.9Confident162 Ų162110.8 Ų110.870%0.70457%0.57SS**SBendtrans-95.12.2-178.5-143.4174.7-177.9-173.90113.4E188E188-K191 PolarHBondContact O-N 2.87Å
192S54.8Low72.6Confident71 Ų71115.9 Ų115.950%0.49758%0.575SS.*SBendtrans-80148.5171.9177.90000110.4R194S192-R194 PolarHBondContact O-N 2.91Å
193K65.9Low74Confident215 Ų215119.1 Ų119.194%0.93557%0.573SS**SBendtrans-45.58.8176.9-82.7173.9172.1174.50117.7L195K193-L195 PolarHBondContact O-N 2.8Å
194R77.1Confident75.6Confident216 Ų216114.1 Ų114.182%0.81556%0.556SS**  trans-73.1107.2174.3-75.8-177.8166.2166.3-3.2109S192 T196S192-R194 PolarHBondContact O-N 2.91Å; R194-T196 PolarHBondContact O-N 3.31Å
195L82.1Confident77.4Confident85 Ų85116.9 Ų116.945%0.44557%0.57SS.*  trans-50.6139.7169.4-66.6175.2000109.9K193 E199 I200K193-L195 PolarHBondContact O-N 2.8Å; L195-E199 VanDerWaalsContact CA-OE2 3.25Å; L195-E199 WeakPolarHBondContact CA-OE2 3.43Å; L195-E199 HydrophobicContact CB-CB 4.02Å; L195-E199 HydrophobicContact CD2-CB 4.14Å; L195-E199 WeakPolarHBondContact CD2-OE2 3.43Å; L195-I200 HydrophobicContact CB-CD1 4.16Å; L195-I200 HydrophobicContact CB-CG1 3.52Å; L195-I200 HydrophobicContact CD1-CG1 4.26Å
196T88Confident78.9Confident70 Ų70116.8 Ų116.843%0.42957%0.57SS.*  trans-64.4156.2173.866.90000110R194 R198 E199 I200R194-T196 PolarHBondContact O-N 3.31Å; T196-R198 PolarHBondContact O-N 2.9Å; T196-R198 VanDerWaalsContact O-N 3.08Å; T196-E199 WeakPolarHBondContact CG2-OE1 3.38Å; T196-E199 PolarHBondContact N-OE2 3.44Å; T196-E199 PolarHBondContact O-N 3.24Å; T196-E199 WeakPolarHBondContact OG1-CG 3.29Å; T196-E199 PolarHBondContact OG1-N 2.92Å; T196-E199 PolarHBondContact OG1-OE1 3.49Å; T196-I200 WeakPolarHBondContact O-CG1 3.47Å; T196-I200 PolarHBondContact O-N 3.02Å
197G92.3Very high80.6Confident62 Ų62115.1 Ų115.164%0.63957%0.567SS**Hα-helixtrans-55.5-29.9175.400000112.9K201G197-K201 VanDerWaalsContact O-CB 3.28Å; G197-K201 WeakPolarHBondContact O-CB 3.48Å; G197-K201 PolarHBondContact O-N 3.29Å
198R91.7Very high82.3Confident188 Ų188120.3 Ų120.371%0.70958%0.575SS**Hα-helixtrans-68.5-44.6174.2-172.6179.6-175.9-171.81.4112T196 R202T196-R198 PolarHBondContact O-N 2.9Å; T196-R198 VanDerWaalsContact O-N 3.08Å; R198-R202 WeakPolarHBondContact O-CB 3.45Å; R198-R202 PolarHBondContact O-N 3.36Å
199E92.3Very high84.1Confident80 Ų80124.7 Ų124.737%0.37459%0.587SS.*Hα-helixtrans-66.4-44.7177.2-75.2147.2-140.200112L195 T196 K201 R202 K203L195-E199 VanDerWaalsContact CA-OE2 3.25Å; L195-E199 WeakPolarHBondContact CA-OE2 3.43Å; L195-E199 HydrophobicContact CB-CB 4.02Å; L195-E199 HydrophobicContact CD2-CB 4.14Å; L195-E199 WeakPolarHBondContact CD2-OE2 3.43Å; T196-E199 WeakPolarHBondContact CG2-OE1 3.38Å; T196-E199 PolarHBondContact N-OE2 3.44Å; T196-E199 PolarHBondContact O-N 3.24Å; T196-E199 WeakPolarHBondContact OG1-CG 3.29Å; T196-E199 PolarHBondContact OG1-N 2.92Å; T196-E199 PolarHBondContact OG1-OE1 3.49Å; E199-K201 VanDerWaalsContact C-N 3.33Å; E199-K201 PolarHBondContact O-N 2.93Å; E199-R202 PolarHBondContact O-N 3.37Å; E199-K203 WeakPolarHBondContact O-CB 3.4Å; E199-K203 PolarHBondContact O-N 2.88Å
200I94.7Very high85.5Confident86 Ų86127.1 Ų127.144%0.44159%0.59SS.*Hα-helixtrans-58.9-48.9176.1-62.5172.7000109.3L195 T196 R202 K203 T204L195-I200 HydrophobicContact CB-CD1 4.16Å; L195-I200 HydrophobicContact CB-CG1 3.52Å; L195-I200 HydrophobicContact CD1-CG1 4.26Å; T196-I200 WeakPolarHBondContact O-CG1 3.47Å; T196-I200 PolarHBondContact O-N 3.02Å; I200-R202 PolarHBondContact O-N 3.35Å; I200-K203 PolarHBondContact O-N 3.37Å; I200-T204 WeakPolarHBondContact O-CB 3.36Å; I200-T204 PolarHBondContact O-N 3.27Å; I200-T204 PolarHBondContact O-OG1 2.95Å
201K96Very high87.2Confident143 Ų143122.6 Ų122.662%0.62259%0.586SS**Hα-helixtrans-58.4-48.4177.1-178.8178.8177.9-178.60111.7G197 E199 T204 L205G197-K201 VanDerWaalsContact O-CB 3.28Å; G197-K201 WeakPolarHBondContact O-CB 3.48Å; G197-K201 PolarHBondContact O-N 3.29Å; E199-K201 VanDerWaalsContact C-N 3.33Å; E199-K201 PolarHBondContact O-N 2.93Å; K201-T204 PolarHBondContact O-N 2.98Å; K201-L205 HydrophobicContact CG-CD1 3.88Å; K201-L205 HydrophobicContact CG-CG 4.38Å; K201-L205 WeakPolarHBondContact O-CB 3.39Å; K201-L205 VanDerWaalsContact O-CG 3.26Å; K201-L205 WeakPolarHBondContact O-CG 3.43Å; K201-L205 PolarHBondContact O-N 3.24Å
202R95.3Very high89Confident156 Ų156119 Ų11959%0.58957%0.574SS**Hα-helixtrans-60.5-47.9-180-174.9-173.8-69159.9-6.7111.1R198 E199 I200 L205 A206R198-R202 WeakPolarHBondContact O-CB 3.45Å; R198-R202 PolarHBondContact O-N 3.36Å; E199-R202 PolarHBondContact O-N 3.37Å; I200-R202 PolarHBondContact O-N 3.35Å; R202-L205 PolarHBondContact O-N 3.24Å; R202-A206 WeakPolarHBondContact O-CB 3.39Å; R202-A206 PolarHBondContact O-N 3.27Å
203K94.9Very high90.7Very high122 Ų122118.6 Ų118.653%0.5358%0.582SS.*Hα-helixtrans-60.1-51.7178.7-173.7-177.3176.4-1770111E199 I200 L205 A206 D207E199-K203 WeakPolarHBondContact O-CB 3.4Å; E199-K203 PolarHBondContact O-N 2.88Å; I200-K203 PolarHBondContact O-N 3.37Å; K203-L205 VanDerWaalsContact C-N 3.31Å; K203-L205 PolarHBondContact O-N 3.13Å; K203-A206 WeakPolarHBondContact O-CB 3.42Å; K203-A206 PolarHBondContact O-N 3.02Å; K203-A206 VanDerWaalsContact O-N 3.14Å; K203-D207 VanDerWaalsContact O-CG 3.23Å; K203-D207 PolarHBondContact O-N 3.23Å
204T95.8Very high92Very high55 Ų55111.4 Ų111.434%0.33755%0.552SS.*Hα-helixtrans-61.9-36.5-179.9-59.90000112.9I200 K201 R208I200-T204 WeakPolarHBondContact O-CB 3.36Å; I200-T204 PolarHBondContact O-N 3.27Å; I200-T204 PolarHBondContact O-OG1 2.95Å; K201-T204 PolarHBondContact O-N 2.98Å; T204-R208 WeakPolarHBondContact O-CB 3.46Å; T204-R208 VanDerWaalsContact O-CG 3.25Å; T204-R208 WeakPolarHBondContact O-CG 3.49Å; T204-R208 PolarHBondContact O-N 3.13Å; T204-R208 VanDerWaalsContact O-N 3.16Å
205L96.2Very high92.7Very high97 Ų97107.8 Ų107.851%0.50855%0.549SS..Hα-helixtrans-70.7-37.4175.4-71.3175.3000112.2K201 R202 K203 R208 R209K201-L205 HydrophobicContact CG-CD1 3.88Å; K201-L205 HydrophobicContact CG-CG 4.38Å; K201-L205 WeakPolarHBondContact O-CB 3.39Å; K201-L205 VanDerWaalsContact O-CG 3.26Å; K201-L205 WeakPolarHBondContact O-CG 3.43Å; K201-L205 PolarHBondContact O-N 3.24Å; R202-L205 PolarHBondContact O-N 3.24Å; K203-L205 VanDerWaalsContact C-N 3.31Å; K203-L205 PolarHBondContact O-N 3.13Å; L205-R208 PolarHBondContact O-N 3.07Å; L205-R209 WeakPolarHBondContact O-CB 3.43Å; L205-R209 PolarHBondContact O-N 3.11Å; L205-R209 VanDerWaalsContact O-N 3.07Å
206A95.6Very high93.2Very high61 Ų61111.7 Ų111.750%0.50457%0.571SS.*Hα-helixtrans-63.9-46.4173.900000111.3R202 K203 R208 R209R202-A206 WeakPolarHBondContact O-CB 3.39Å; R202-A206 PolarHBondContact O-N 3.27Å; K203-A206 WeakPolarHBondContact O-CB 3.42Å; K203-A206 PolarHBondContact O-N 3.02Å; K203-A206 VanDerWaalsContact O-N 3.14Å; A206-R208 PolarHBondContact O-N 3.5Å; A206-R209 PolarHBondContact O-N 2.94Å; A206-R209 VanDerWaalsContact O-N 3.08Å
207D95.3Very high93.6Very high103 Ų103111.5 Ų111.555%0.55157%0.566SS**Hα-helixtrans-61-33.4178.5-63.5-19000112.2K203K203-D207 VanDerWaalsContact O-CG 3.23Å; K203-D207 PolarHBondContact O-N 3.23Å
208R95.1Very high93.7Very high163 Ų163117.6 Ų117.662%0.61557%0.57SS**Hα-helixtrans-79.7-23.3176.9-72.1176.1-174.5-159.50.5113.5T204 L205 A206 Q210T204-R208 WeakPolarHBondContact O-CB 3.46Å; T204-R208 VanDerWaalsContact O-CG 3.25Å; T204-R208 WeakPolarHBondContact O-CG 3.49Å; T204-R208 PolarHBondContact O-N 3.13Å; T204-R208 VanDerWaalsContact O-N 3.16Å; L205-R208 PolarHBondContact O-N 3.07Å; A206-R208 PolarHBondContact O-N 3.5Å; R208-Q210 PolarHBondContact O-N 3.36Å
209R93.9Very high93.9Very high201 Ų201114.3 Ų114.376%0.75856%0.562SS**  trans-80.6107-177.4-179.9176.4166.8-128.10.2109.1L205 A206L205-R209 WeakPolarHBondContact O-CB 3.43Å; L205-R209 PolarHBondContact O-N 3.11Å; L205-R209 VanDerWaalsContact O-N 3.07Å; A206-R209 PolarHBondContact O-N 2.94Å; A206-R209 VanDerWaalsContact O-N 3.08Å
210Q89.6Confident94.1Very high132 Ų132114.9 Ų114.962%0.61757%0.568SS**  trans-82.1130.2171.6-63.1-60.6-53.400109.6R208R208-Q210 PolarHBondContact O-N 3.36Å
211P91.8Very high94.2Very high106 Ų106113.3 Ų113.369%0.68857%0.565SS**  trans-63.4146.917327.2-32.4000110.3
212L90.3Very high94.3Very high87 Ų87109.7 Ų109.746%0.45555%0.552SS.*  trans-94.6110.8177.2-63.1179.4000108.2I214 M229L212-I214 HydrophobicContact CB-CG2 4.3Å; L212-M229 HydrophobicContact CD1-CE 4.24Å; L212-M229 HydrophobicContact CD1-SD 3.81Å; L212-M229 HydrophobicContact CD2-CE 4.49Å; L212-M229 HydrophobicContact CD2-SD 3.5Å; L212-M229 VanDerWaalsContact CD2-SD 3.5Å; L212-M229 HydrophobicContact CG-SD 4.32Å
213G90Very high94.3Very high63 Ų63109.9 Ų109.965%0.64955%0.552SS**  trans-97.878.517000000109.7
214I93.7Very high94.4Very high63 Ų63109 Ų10932%0.32355%0.554SS.*  trans-106.7-9.7-173.257.9171.6000114.1L212 N216 M217 L222 R225L212-I214 HydrophobicContact CB-CG2 4.3Å; I214-N216 VanDerWaalsContact C-N 3.3Å; I214-N216 PolarHBondContact O-N 2.92Å; I214-M217 HydrophobicContact CB-SD 4.35Å; I214-M217 HydrophobicContact CG2-SD 4.01Å; I214-M217 PolarHBondContact O-N 3.11Å; I214-L222 HydrophobicContact CB-CD2 3.94Å; I214-L222 HydrophobicContact CG2-CD2 4.29Å; I214-R225 HydrophobicContact CG2-CG 4.27Å
215D92.2Very high94.4Very high140 Ų140109.8 Ų109.875%0.74955%0.55SS**THydrogen-bonded Turntrans-65-33-166.6-50.9-43.7000113.2
216N93.2Very high94.5Very high168 Ų168107.6 Ų107.690%0.89855%0.546SS*.THydrogen-bonded Turntrans-110.623.6-176.5-59.6-18.5000112.8I214I214-N216 VanDerWaalsContact C-N 3.3Å; I214-N216 PolarHBondContact O-N 2.92Å
217M95Very high94.6Very high66 Ų66109.5 Ų109.533%0.32555%0.545SS..  trans-92.4140.1-178.2-66-173.873.200112.3I214 L222 R225I214-M217 HydrophobicContact CB-SD 4.35Å; I214-M217 HydrophobicContact CG2-SD 4.01Å; I214-M217 PolarHBondContact O-N 3.11Å; M217-L222 HydrophobicContact CB-CD2 3.74Å; M217-L222 HydrophobicContact CB-CG 3.78Å; M217-L222 HydrophobicContact SD-CD2 4.31Å; M217-R225 HydrophobicContact CE-CB 4.14Å
218R95.9Very high94.6Very high190 Ų190109.6 Ų109.672%0.71754%0.542SS*.  trans-71.1154.6171.7-169.3175.2177-166.7-2.2110.9D220 S221 L222R218-D220 PolarHBondContact O-N 3.24Å; R218-S221 CarbonylContact O-C 3.6Å; R218-S221 WeakPolarHBondContact O-CA 3.47Å; R218-S221 WeakPolarHBondContact O-CB 3.34Å; R218-S221 PolarHBondContact O-N 3.33Å; R218-L222 PolarHBondContact O-N 2.87Å
219E96Very high94.6Very high118 Ų118105.2 Ų105.255%0.55153%0.529SS*.Hα-helixtrans-49.4-48.1-177.4-168.7-175166.600114.3S221 L222 R223E219-S221 VanDerWaalsContact C-N 3.27Å; E219-S221 PolarHBondContact O-N 2.86Å; E219-L222 WeakPolarHBondContact O-CB 3.31Å; E219-L222 PolarHBondContact O-N 2.84Å; E219-L222 VanDerWaalsContact O-N 3.14Å; E219-R223 WeakPolarHBondContact O-CG 3.2Å; E219-R223 PolarHBondContact O-N 2.89Å; E219-R223 IonicContact OE1-CZ 2.9Å; E219-R223 IonicContact OE1-NE 3.89Å; E219-R223 PolarHBondContact OE1-NE 3.25Å; E219-R223 IonicContact OE1-NH2 2.67Å; E219-R223 PolarHBondContact OE1-NH2 3.29Å
220D96.8Very high94.8Very high92 Ų92102.7 Ų102.749%0.49252%0.52SS..Hα-helixtrans-61.2-38.3178.8-66.1-34.8000112R218 R223 N224R218-D220 PolarHBondContact O-N 3.24Å; D220-R223 PolarHBondContact O-N 3.42Å; D220-N224 PolarHBondContact O-N 2.95Å; D220-N224 VanDerWaalsContact O-N 3.12Å; D220-N224 PolarHBondContact O-ND2 3.39Å
221S96.3Very high95.2Very high54 Ų54100.2 Ų100.238%0.37851%0.511SS..Hα-helixtrans-70-36.9176.6-51.10000111.5R218 E219 N224 R225R218-S221 CarbonylContact O-C 3.6Å; R218-S221 WeakPolarHBondContact O-CA 3.47Å; R218-S221 WeakPolarHBondContact O-CB 3.34Å; R218-S221 PolarHBondContact O-N 3.33Å; E219-S221 VanDerWaalsContact C-N 3.27Å; E219-S221 PolarHBondContact O-N 2.86Å; S221-N224 PolarHBondContact O-N 3.44Å; S221-R225 WeakPolarHBondContact O-CB 3.44Å; S221-R225 PolarHBondContact O-N 3.19Å
222L96.6Very high95.5Very high67 Ų67102.4 Ų102.435%0.35151%0.506SS..Hα-helixtrans-64-41.4173.6-72.9170.1000111.8I214 M217 R218 E219 R225 A226I214-L222 HydrophobicContact CB-CD2 3.94Å; I214-L222 HydrophobicContact CG2-CD2 4.29Å; M217-L222 HydrophobicContact CB-CD2 3.74Å; M217-L222 HydrophobicContact CB-CG 3.78Å; M217-L222 HydrophobicContact SD-CD2 4.31Å; R218-L222 PolarHBondContact O-N 2.87Å; E219-L222 WeakPolarHBondContact O-CB 3.31Å; E219-L222 PolarHBondContact O-N 2.84Å; E219-L222 VanDerWaalsContact O-N 3.14Å; L222-R225 PolarHBondContact O-N 3.42Å; L222-A226 WeakPolarHBondContact O-CB 3.18Å; L222-A226 PolarHBondContact O-N 3.4Å
223R97.4Very high95.8Very high159 Ų159102.8 Ų102.860%0.651%0.507SS*.Hα-helixtrans-61-45.7175.1-70.6175.3-177.6-137.45.1111.5E219 D220 A226 Q227E219-R223 WeakPolarHBondContact O-CG 3.2Å; E219-R223 PolarHBondContact O-N 2.89Å; E219-R223 IonicContact OE1-CZ 2.9Å; E219-R223 IonicContact OE1-NE 3.89Å; E219-R223 PolarHBondContact OE1-NE 3.25Å; E219-R223 IonicContact OE1-NH2 2.67Å; E219-R223 PolarHBondContact OE1-NH2 3.29Å; D220-R223 PolarHBondContact O-N 3.42Å; R223-A226 PolarHBondContact O-N 3.21Å; R223-Q227 PolarHBondContact O-N 3.39Å
224N96.8Very high96.2Very high104 Ų104104.7 Ų104.756%0.55650%0.499SS*.Hα-helixtrans-62.1-44.2175-70.5-25.9000111.5D220 S221 A226 Q227 E228D220-N224 PolarHBondContact O-N 2.95Å; D220-N224 VanDerWaalsContact O-N 3.12Å; D220-N224 PolarHBondContact O-ND2 3.39Å; S221-N224 PolarHBondContact O-N 3.44Å; N224-A226 VanDerWaalsContact C-N 3.34Å; N224-A226 PolarHBondContact O-N 2.93Å; N224-Q227 WeakPolarHBondContact O-CB 3.35Å; N224-Q227 PolarHBondContact O-N 3.28Å; N224-E228 WeakPolarHBondContact O-CG 3.43Å; N224-E228 PolarHBondContact O-N 3.44Å
225R95.9Very high96.4Very high71 Ų71105.9 Ų105.927%0.26850%0.503SS..Hα-helixtrans-63.1-39.7178.5-17356.7175.1170.9-2.1112.4I214 M217 S221 L222 E228 M229I214-R225 HydrophobicContact CG2-CG 4.27Å; M217-R225 HydrophobicContact CE-CB 4.14Å; S221-R225 WeakPolarHBondContact O-CB 3.44Å; S221-R225 PolarHBondContact O-N 3.19Å; L222-R225 PolarHBondContact O-N 3.42Å; R225-E228 IonicContact CZ-OE2 3.43Å; R225-E228 IonicContact NH1-OE2 3.91Å; R225-E228 PolarHBondContact NH1-OE2 3.49Å; R225-E228 PolarHBondContact O-N 3.03Å; R225-M229 WeakPolarHBondContact O-CG 3.4Å; R225-M229 PolarHBondContact O-N 2.88Å
226A96.9Very high96.6Very high51 Ų51102.7 Ų102.742%0.42149%0.485SS..Hα-helixtrans-63.3-42.2174.400000111.5L222 R223 N224 M229 W230L222-A226 WeakPolarHBondContact O-CB 3.18Å; L222-A226 PolarHBondContact O-N 3.4Å; R223-A226 PolarHBondContact O-N 3.21Å; N224-A226 VanDerWaalsContact C-N 3.34Å; N224-A226 PolarHBondContact O-N 2.93Å; A226-M229 PolarHBondContact O-N 3.35Å; A226-W230 WeakPolarHBondContact O-CB 3.38Å; A226-W230 PolarHBondContact O-N 3.47Å
227Q97.8Very high96.9Very high101 Ų101100.4 Ų100.447%0.47247%0.469SS..Hα-helixtrans-63.6-42.2176.6-171.262.347.300112.1R223 N224 W230 N231R223-Q227 PolarHBondContact O-N 3.39Å; N224-Q227 WeakPolarHBondContact O-CB 3.35Å; N224-Q227 PolarHBondContact O-N 3.28Å; Q227-W230 PolarHBondContact O-N 3.49Å; Q227-N231 PolarHBondContact NE2-OD1 3.43Å; Q227-N231 WeakPolarHBondContact O-CB 3.29Å; Q227-N231 VanDerWaalsContact O-CG 3.24Å; Q227-N231 PolarHBondContact O-N 3.12Å; Q227-N231 PolarHBondContact O-ND2 2.92Å
228E95.9Very high97Very high106 Ų10699.7 Ų99.750%0.49547%0.471SS..Hα-helixtrans-59.2-46.9173.5-72.5175.2-179.400111.8N224 R225 W230 N231 W232N224-E228 WeakPolarHBondContact O-CG 3.43Å; N224-E228 PolarHBondContact O-N 3.44Å; R225-E228 IonicContact CZ-OE2 3.43Å; R225-E228 IonicContact NH1-OE2 3.91Å; R225-E228 PolarHBondContact NH1-OE2 3.49Å; R225-E228 PolarHBondContact O-N 3.03Å; E228-W230 VanDerWaalsContact C-N 3.34Å; E228-W230 PolarHBondContact O-N 3.39Å; E228-N231 PolarHBondContact O-N 2.92Å; E228-W232 WeakPolarHBondContact O-CB 3.38Å; E228-W232 PolarHBondContact O-N 3.31Å
229M95.7Very high97.1Very high71 Ų7194.1 Ų94.135%0.3545%0.453SS..Hα-helixtrans-63.5-40.9178.1-72.6-154.7-69.600112L212 R225 A226 W232 I233L212-M229 HydrophobicContact CD1-CE 4.24Å; L212-M229 HydrophobicContact CD1-SD 3.81Å; L212-M229 HydrophobicContact CD2-CE 4.49Å; L212-M229 HydrophobicContact CD2-SD 3.5Å; L212-M229 VanDerWaalsContact CD2-SD 3.5Å; L212-M229 HydrophobicContact CG-SD 4.32Å; R225-M229 WeakPolarHBondContact O-CG 3.4Å; R225-M229 PolarHBondContact O-N 2.88Å; A226-M229 PolarHBondContact O-N 3.35Å; M229-W232 PolarHBondContact O-N 2.88Å; M229-I233 WeakPolarHBondContact O-CG1 3.23Å; M229-I233 PolarHBondContact O-N 2.91Å
230W97.8Very high97.3Very high148 Ų14895 Ų9556%0.56146%0.455SS*.Hα-helixtrans-61.5-47175.9-178.188.1000111.4A226 Q227 E228 W232 I233 H234A226-W230 WeakPolarHBondContact O-CB 3.38Å; A226-W230 PolarHBondContact O-N 3.47Å; Q227-W230 PolarHBondContact O-N 3.49Å; E228-W230 VanDerWaalsContact C-N 3.34Å; E228-W230 PolarHBondContact O-N 3.39Å; W230-W232 VanDerWaalsContact C-N 3.28Å; W230-W232 PolarHBondContact O-N 2.85Å; W230-I233 PolarHBondContact O-N 2.92Å; W230-H234 WeakPolarHBondContact O-CB 3.49Å; W230-H234 PolarHBondContact O-N 3.14Å
231N97.9Very high97.3Very high80 Ų8096.4 Ų96.443%0.42846%0.457SS..Hα-helixtrans-59.3-40.4175.2-70.5-27000111.4Q227 E228 H234 Q235Q227-N231 PolarHBondContact NE2-OD1 3.43Å; Q227-N231 WeakPolarHBondContact O-CB 3.29Å; Q227-N231 VanDerWaalsContact O-CG 3.24Å; Q227-N231 PolarHBondContact O-N 3.12Å; Q227-N231 PolarHBondContact O-ND2 2.92Å; E228-N231 PolarHBondContact O-N 2.92Å; N231-H234 PolarHBondContact O-N 3.27Å; N231-Q235 WeakPolarHBondContact O-CB 3.17Å; N231-Q235 PolarHBondContact O-N 3.33Å
232W96.7Very high97.4Very high152 Ų15297.6 Ų97.658%0.57646%0.459SS*.Hα-helixtrans-65.9-43.5178.3-172.9-113.1000112.6E228 M229 W230 Q235 L236E228-W232 WeakPolarHBondContact O-CB 3.38Å; E228-W232 PolarHBondContact O-N 3.31Å; M229-W232 PolarHBondContact O-N 2.88Å; W230-W232 VanDerWaalsContact C-N 3.28Å; W230-W232 PolarHBondContact O-N 2.85Å; W232-Q235 PolarHBondContact O-N 3.24Å; W232-L236 HydrophobicContact CZ2-CD2 4.47Å; W232-L236 WeakPolarHBondContact O-CG 3.36Å; W232-L236 PolarHBondContact O-N 2.95Å
233I97Very high97.5Very high94 Ų94100.2 Ų100.248%0.48247%0.468SS..Hα-helixtrans-60.8-48.7174.4-69.4168.7000109.9M229 W230 Q235 L236 E237M229-I233 WeakPolarHBondContact O-CG1 3.23Å; M229-I233 PolarHBondContact O-N 2.91Å; W230-I233 PolarHBondContact O-N 2.92Å; I233-Q235 VanDerWaalsContact C-N 3.31Å; I233-Q235 PolarHBondContact O-N 3.45Å; I233-L236 PolarHBondContact O-N 3.36Å; I233-L236 VanDerWaalsContact O-N 3.14Å; I233-E237 HydrophobicContact CG2-CG 4.36Å; I233-E237 WeakPolarHBondContact O-CG 3.43Å; I233-E237 PolarHBondContact O-N 3.39Å
234H98.3Very high97.6Very high103 Ų10397 Ų9748%0.47746%0.461SS..Hα-helixtrans-58-43179.2-177.3-80.7000112W230 N231 E237 S238W230-H234 WeakPolarHBondContact O-CB 3.49Å; W230-H234 PolarHBondContact O-N 3.14Å; N231-H234 PolarHBondContact O-N 3.27Å; H234-E237 PolarHBondContact O-N 3.35Å; H234-S238 PolarHBondContact O-N 3.14Å
235Q98.1Very high97.6Very high88 Ų8895.7 Ų95.741%0.41145%0.451SS..Hα-helixtrans-60.3-47.3175.4-179.162.525.200111.9N231 W232 I233 E237 S238 E239N231-Q235 WeakPolarHBondContact O-CB 3.17Å; N231-Q235 PolarHBondContact O-N 3.33Å; W232-Q235 PolarHBondContact O-N 3.24Å; I233-Q235 VanDerWaalsContact C-N 3.31Å; I233-Q235 PolarHBondContact O-N 3.45Å; Q235-E237 VanDerWaalsContact C-N 3.31Å; Q235-E237 PolarHBondContact O-N 2.8Å; Q235-S238 WeakPolarHBondContact O-CB 3.28Å; Q235-S238 PolarHBondContact O-N 3.12Å; Q235-E239 PolarHBondContact NE2-OE1 3.37Å; Q235-E239 WeakPolarHBondContact O-CG 3.34Å; Q235-E239 PolarHBondContact O-N 3.49Å
236L97.5Very high97.8Very high73 Ų7397.2 Ų97.238%0.38246%0.461SS..Hα-helixtrans-63.3-36.6178.2-69.9174.8000112.4W232 I233 K240W232-L236 HydrophobicContact CZ2-CD2 4.47Å; W232-L236 WeakPolarHBondContact O-CG 3.36Å; W232-L236 PolarHBondContact O-N 2.95Å; I233-L236 PolarHBondContact O-N 3.36Å; I233-L236 VanDerWaalsContact O-N 3.14Å; L236-K240 VanDerWaalsContact O-CB 3.28Å; L236-K240 WeakPolarHBondContact O-CB 3.42Å; L236-K240 PolarHBondContact O-N 3.48Å
237E98.3Very high97.8Very high121 Ų12199.3 Ų99.357%0.56546%0.463SS*.Hα-helixtrans-66.8-42.3175.2-73.5-174.2160.600111.9I233 H234 Q235 K240 F241I233-E237 HydrophobicContact CG2-CG 4.36Å; I233-E237 WeakPolarHBondContact O-CG 3.43Å; I233-E237 PolarHBondContact O-N 3.39Å; H234-E237 PolarHBondContact O-N 3.35Å; Q235-E237 VanDerWaalsContact C-N 3.31Å; Q235-E237 PolarHBondContact O-N 2.8Å; E237-K240 PolarHBondContact O-N 3.13Å; E237-F241 PolarHBondContact O-N 3.46Å
238S98.3Very high97.8Very high50 Ų5099.3 Ų99.335%0.3546%0.462SS..Hα-helixtrans-59.9-50.6174.1-170.40000111.4H234 Q235 K240 F241 D242H234-S238 PolarHBondContact O-N 3.14Å; Q235-S238 WeakPolarHBondContact O-CB 3.28Å; Q235-S238 PolarHBondContact O-N 3.12Å; S238-K240 VanDerWaalsContact C-N 3.32Å; S238-K240 PolarHBondContact O-N 3.37Å; S238-F241 WeakPolarHBondContact O-CB 3.44Å; S238-F241 PolarHBondContact O-N 2.92Å; S238-F241 VanDerWaalsContact O-N 3.12Å; S238-D242 PolarHBondContact O-N 3.37Å
239E98.3Very high98Very high74 Ų7499.4 Ų99.435%0.34646%0.462SS..Hα-helixtrans-61.4-40.7178.3-72.6177.7-165.300112.1Q235 F241 D242 F243Q235-E239 PolarHBondContact NE2-OE1 3.37Å; Q235-E239 WeakPolarHBondContact O-CG 3.34Å; Q235-E239 PolarHBondContact O-N 3.49Å; E239-F241 VanDerWaalsContact C-N 3.31Å; E239-F241 PolarHBondContact O-N 3.44Å; E239-D242 PolarHBondContact O-N 3.44Å; E239-F243 HydrophobicContact CB-CE2 4.31Å; E239-F243 WeakPolarHBondContact O-CD2 3.36Å; E239-F243 WeakPolarHBondContact O-CG 3.4Å; E239-F243 PolarHBondContact O-N 2.68Å
240K98.2Very high98.1Very high135 Ų135100.3 Ų100.359%0.58747%0.466SS*.Hα-helixtrans-59.5-43.3174.6174.1-172.3163.2-165.70111.1L236 E237 S238 F243 M244L236-K240 VanDerWaalsContact O-CB 3.28Å; L236-K240 WeakPolarHBondContact O-CB 3.42Å; L236-K240 PolarHBondContact O-N 3.48Å; E237-K240 PolarHBondContact O-N 3.13Å; S238-K240 VanDerWaalsContact C-N 3.32Å; S238-K240 PolarHBondContact O-N 3.37Å; K240-F243 PolarHBondContact O-N 3.27Å; K240-M244 HydrophobicContact CG-SD 4.17Å; K240-M244 WeakPolarHBondContact O-CB 3.3Å; K240-M244 VanDerWaalsContact O-CG 3.26Å; K240-M244 WeakPolarHBondContact O-CG 3.21Å; K240-M244 PolarHBondContact O-N 2.93Å
241F98.4Very high98.1Very high122 Ų12299.6 Ų99.654%0.53546%0.463SS..Hα-helixtrans-60.8-49177176.7-92.7000111.2E237 S238 E239 F243 M244 E245E237-F241 PolarHBondContact O-N 3.46Å; S238-F241 WeakPolarHBondContact O-CB 3.44Å; S238-F241 PolarHBondContact O-N 2.92Å; S238-F241 VanDerWaalsContact O-N 3.12Å; E239-F241 VanDerWaalsContact C-N 3.31Å; E239-F241 PolarHBondContact O-N 3.44Å; F241-F243 VanDerWaalsContact C-N 3.34Å; F241-F243 PolarHBondContact O-N 3.47Å; F241-M244 WeakPolarHBondContact O-CB 3.22Å; F241-M244 PolarHBondContact O-N 3.22Å; F241-E245 HydrophobicContact CD1-CG 4.32Å; F241-E245 HydrophobicContact CE1-CG 3.8Å; F241-E245 HydrophobicContact CE2-CG 4.27Å; F241-E245 HydrophobicContact CZ-CG 3.77Å; F241-E245 PolarHBondContact O-N 2.91Å
242D98.4Very high98.1Very high79 Ų79103.2 Ų103.242%0.42247%0.472SS..Hα-helixtrans-58.8-44.7178.5-69.3-25.4000111.6S238 E239 M244 E245 Q246S238-D242 PolarHBondContact O-N 3.37Å; E239-D242 PolarHBondContact O-N 3.44Å; D242-M244 VanDerWaalsContact C-N 3.32Å; D242-M244 PolarHBondContact O-N 2.92Å; D242-E245 PolarHBondContact O-N 3.02Å; D242-Q246 WeakPolarHBondContact O-CB 3.32Å; D242-Q246 VanDerWaalsContact O-CG 3.28Å; D242-Q246 WeakPolarHBondContact O-CG 3.44Å; D242-Q246 PolarHBondContact O-N 3.45Å
243F98.6Very high98.2Very high123 Ų123100.5 Ų100.554%0.53947%0.465SS..Hα-helixtrans-63.6-36.2175-70.9-47000112.6E239 K240 F241 M247E239-F243 HydrophobicContact CB-CE2 4.31Å; E239-F243 WeakPolarHBondContact O-CD2 3.36Å; E239-F243 WeakPolarHBondContact O-CG 3.4Å; E239-F243 PolarHBondContact O-N 2.68Å; K240-F243 PolarHBondContact O-N 3.27Å; F241-F243 VanDerWaalsContact C-N 3.34Å; F241-F243 PolarHBondContact O-N 3.47Å; F243-M247 VanDerWaalsContact O-CB 3.29Å; F243-M247 WeakPolarHBondContact O-CB 3.45Å; F243-M247 WeakPolarHBondContact O-CG 3.33Å; F243-M247 PolarHBondContact O-N 3.47Å
244M98.4Very high98.2Very high92 Ų92100.7 Ų100.745%0.45347%0.466SS..Hα-helixtrans-64.2-43176-77177.857.500111.8K240 F241 D242 M247 K248K240-M244 HydrophobicContact CG-SD 4.17Å; K240-M244 WeakPolarHBondContact O-CB 3.3Å; K240-M244 VanDerWaalsContact O-CG 3.26Å; K240-M244 WeakPolarHBondContact O-CG 3.21Å; K240-M244 PolarHBondContact O-N 2.93Å; F241-M244 WeakPolarHBondContact O-CB 3.22Å; F241-M244 PolarHBondContact O-N 3.22Å; D242-M244 VanDerWaalsContact C-N 3.32Å; D242-M244 PolarHBondContact O-N 2.92Å; M244-M247 PolarHBondContact O-N 2.9Å; M244-K248 WeakPolarHBondContact O-CG 3.22Å; M244-K248 PolarHBondContact O-N 3.48Å
245E98.3Very high98.2Very high76 Ų7699.4 Ų99.436%0.35547%0.466SS..Hα-helixtrans-67.6-44176.7-68-52.3114.100111.7F241 D242 M247 K248 H249F241-E245 HydrophobicContact CD1-CG 4.32Å; F241-E245 HydrophobicContact CE1-CG 3.8Å; F241-E245 HydrophobicContact CE2-CG 4.27Å; F241-E245 HydrophobicContact CZ-CG 3.77Å; F241-E245 PolarHBondContact O-N 2.91Å; D242-E245 PolarHBondContact O-N 3.02Å; E245-M247 VanDerWaalsContact C-N 3.32Å; E245-M247 PolarHBondContact O-N 2.94Å; E245-K248 WeakPolarHBondContact O-CB 3.23Å; E245-K248 PolarHBondContact O-N 3.29Å; E245-K248 VanDerWaalsContact O-N 3.13Å; E245-K248 WeakPolarHBondContact OE1-CD 3.47Å; E245-K248 WeakPolarHBondContact OE1-CE 3.37Å; E245-K248 IonicContact OE1-NZ 3.48Å; E245-K248 PolarHBondContact OE1-NZ 2.97Å; E245-H249 PolarHBondContact O-N 3.32Å
246Q98.4Very high98.2Very high103 Ų10397.6 Ų97.648%0.48146%0.46SS..Hα-helixtrans-57.3-44.9173.1-73.4176.97.600111.7D242 K248 H249 Q250D242-Q246 WeakPolarHBondContact O-CB 3.32Å; D242-Q246 VanDerWaalsContact O-CG 3.28Å; D242-Q246 WeakPolarHBondContact O-CG 3.44Å; D242-Q246 PolarHBondContact O-N 3.45Å; Q246-K248 VanDerWaalsContact C-N 3.33Å; Q246-K248 PolarHBondContact O-N 2.92Å; Q246-H249 PolarHBondContact O-N 3.27Å; Q246-Q250 WeakPolarHBondContact O-CB 3.28Å; Q246-Q250 WeakPolarHBondContact O-CG 3.3Å; Q246-Q250 PolarHBondContact O-N 2.93Å
247M98.2Very high98.3Very high94 Ų9498.2 Ų98.246%0.46346%0.464SS..Hα-helixtrans-64.7-34.9177.7-75-66.2-64.800112.5F243 M244 E245 R251F243-M247 VanDerWaalsContact O-CB 3.29Å; F243-M247 WeakPolarHBondContact O-CB 3.45Å; F243-M247 WeakPolarHBondContact O-CG 3.33Å; F243-M247 PolarHBondContact O-N 3.47Å; M244-M247 PolarHBondContact O-N 2.9Å; E245-M247 VanDerWaalsContact C-N 3.32Å; E245-M247 PolarHBondContact O-N 2.94Å; M247-R251 WeakPolarHBondContact O-CG 3.24Å; M247-R251 PolarHBondContact O-N 3.4Å; M247-R251 VanDerWaalsContact O-N 3.08Å
248K98.2Very high98.2Very high101 Ų10196.9 Ų96.944%0.43946%0.46SS..Hα-helixtrans-63.8-46.1172.3-73171.4-174.4171.70110.9M244 E245 Q246 R251 Y252M244-K248 WeakPolarHBondContact O-CG 3.22Å; M244-K248 PolarHBondContact O-N 3.48Å; E245-K248 WeakPolarHBondContact O-CB 3.23Å; E245-K248 PolarHBondContact O-N 3.29Å; E245-K248 VanDerWaalsContact O-N 3.13Å; E245-K248 WeakPolarHBondContact OE1-CD 3.47Å; E245-K248 WeakPolarHBondContact OE1-CE 3.37Å; E245-K248 IonicContact OE1-NZ 3.48Å; E245-K248 PolarHBondContact OE1-NZ 2.97Å; Q246-K248 VanDerWaalsContact C-N 3.33Å; Q246-K248 PolarHBondContact O-N 2.92Å; K248-R251 PolarHBondContact O-N 3.32Å; K248-Y252 PolarHBondContact O-N 2.91Å
249H98.1Very high98.1Very high108 Ų10898.1 Ų98.150%0.546%0.463SS..Hα-helixtrans-61.7-48.6178.4-169.571.6000111.8E245 Q246 R251 Y252 E253E245-H249 PolarHBondContact O-N 3.32Å; Q246-H249 PolarHBondContact O-N 3.27Å; H249-R251 VanDerWaalsContact C-N 3.31Å; H249-R251 PolarHBondContact O-N 2.89Å; H249-Y252 WeakPolarHBondContact O-CA 3.49Å; H249-Y252 WeakPolarHBondContact O-CB 3.19Å; H249-Y252 PolarHBondContact O-N 3.41Å; H249-E253 IonicContact CD2-OE1 3.69Å; H249-E253 IonicContact NE2-OE1 3.68Å; H249-E253 PolarHBondContact NE2-OE1 2.94Å; H249-E253 PolarHBondContact O-N 3.17Å
250Q98.3Very high98Very high91 Ų91102.6 Ų102.643%0.42548%0.476SS..Hα-helixtrans-59.8-38.9177.5-72.5175.3-4.700112.5Q246 Y252 E253 I254Q246-Q250 WeakPolarHBondContact O-CB 3.28Å; Q246-Q250 WeakPolarHBondContact O-CG 3.3Å; Q246-Q250 PolarHBondContact O-N 2.93Å; Q250-Y252 VanDerWaalsContact C-N 3.31Å; Q250-Y252 PolarHBondContact O-N 2.78Å; Q250-E253 PolarHBondContact O-N 2.86Å; Q250-I254 WeakPolarHBondContact O-CB 3.39Å; Q250-I254 VanDerWaalsContact O-CG1 3.23Å; Q250-I254 WeakPolarHBondContact O-CG1 3.48Å; Q250-I254 PolarHBondContact O-N 2.95Å
251R98.1Very high97.9Very high133 Ų133100.3 Ų100.350%0.50247%0.47SS..Hα-helixtrans-60.6-40.9174-79.5-171.3-65.7-90.84112.1M247 K248 H249 T255M247-R251 WeakPolarHBondContact O-CG 3.24Å; M247-R251 PolarHBondContact O-N 3.4Å; M247-R251 VanDerWaalsContact O-N 3.08Å; K248-R251 PolarHBondContact O-N 3.32Å; H249-R251 VanDerWaalsContact C-N 3.31Å; H249-R251 PolarHBondContact O-N 2.89Å; R251-T255 PolarHBondContact O-N 3.13Å; R251-T255 VanDerWaalsContact O-N 3.13Å; R251-T255 PolarHBondContact O-OG1 3.38Å
252Y98.3Very high97.6Very high156 Ų15699.4 Ų99.461%0.61247%0.467SS*.Hα-helixtrans-65.1-48.1175.1174.8-98.1000111.4K248 H249 Q250 I254 T255 V256K248-Y252 PolarHBondContact O-N 2.91Å; H249-Y252 WeakPolarHBondContact O-CA 3.49Å; H249-Y252 WeakPolarHBondContact O-CB 3.19Å; H249-Y252 PolarHBondContact O-N 3.41Å; Q250-Y252 VanDerWaalsContact C-N 3.31Å; Q250-Y252 PolarHBondContact O-N 2.78Å; Y252-I254 VanDerWaalsContact C-N 3.35Å; Y252-I254 PolarHBondContact O-N 3.47Å; Y252-T255 WeakPolarHBondContact O-CB 3.4Å; Y252-T255 PolarHBondContact O-N 3.49Å; Y252-V256 HydrophobicContact CD1-CG2 4.19Å; Y252-V256 HydrophobicContact CD2-CG2 4.47Å; Y252-V256 HydrophobicContact CE1-CG2 3.68Å; Y252-V256 HydrophobicContact CE2-CG2 4Å; Y252-V256 WeakPolarHBondContact O-CG2 3.23Å; Y252-V256 PolarHBondContact O-N 2.92Å
253E98.3Very high97.4Very high95 Ų95100.5 Ų100.544%0.44447%0.47SS..Hα-helixtrans-58.2-44.9177.8-69.1-168.6133.300112.2H249 Q250 T255 V256 L257H249-E253 IonicContact CD2-OE1 3.69Å; H249-E253 IonicContact NE2-OE1 3.68Å; H249-E253 PolarHBondContact NE2-OE1 2.94Å; H249-E253 PolarHBondContact O-N 3.17Å; Q250-E253 PolarHBondContact O-N 2.86Å; E253-T255 VanDerWaalsContact C-N 3.29Å; E253-T255 PolarHBondContact O-N 3.34Å; E253-V256 PolarHBondContact O-N 3.33Å; E253-L257 WeakPolarHBondContact O-CB 3.34Å; E253-L257 WeakPolarHBondContact O-CG 3.46Å; E253-L257 PolarHBondContact O-N 3.16Å
254I98.2Very high97Very high97 Ų9797.3 Ų97.350%0.49747%0.466SS..Hα-helixtrans-56.9-45.4175-71.6165.7000110.3Q250 Y252 V256 L257 L258Q250-I254 WeakPolarHBondContact O-CB 3.39Å; Q250-I254 VanDerWaalsContact O-CG1 3.23Å; Q250-I254 WeakPolarHBondContact O-CG1 3.48Å; Q250-I254 PolarHBondContact O-N 2.95Å; Y252-I254 VanDerWaalsContact C-N 3.35Å; Y252-I254 PolarHBondContact O-N 3.47Å; I254-V256 PolarHBondContact O-N 2.85Å; I254-L257 PolarHBondContact O-N 3.49Å; I254-L258 HydrophobicContact CG2-CD1 3.86Å; I254-L258 HydrophobicContact CG2-CG 4.27Å; I254-L258 WeakPolarHBondContact O-CB 3.36Å; I254-L258 VanDerWaalsContact O-CG 3.24Å; I254-L258 WeakPolarHBondContact O-CG 3.19Å; I254-L258 PolarHBondContact O-N 3.24Å
255T98Very high96.6Very high76 Ų7698.6 Ų98.647%0.46647%0.471SS..Hα-helixtrans-61.1-46.5179.1-56.70000111.3R251 Y252 E253 L258 N259R251-T255 PolarHBondContact O-N 3.13Å; R251-T255 VanDerWaalsContact O-N 3.13Å; R251-T255 PolarHBondContact O-OG1 3.38Å; Y252-T255 WeakPolarHBondContact O-CB 3.4Å; Y252-T255 PolarHBondContact O-N 3.49Å; E253-T255 VanDerWaalsContact C-N 3.29Å; E253-T255 PolarHBondContact O-N 3.34Å; T255-L258 PolarHBondContact O-N 3.43Å; T255-N259 PolarHBondContact O-N 2.97Å; T255-N259 PolarHBondContact O-ND2 2.9Å
256V98.1Very high95.6Very high50 Ų50101.6 Ų101.630%0.30348%0.483SS..Hα-helixtrans-62.4-44.3176.61730000111.2Y252 E253 I254 N259 R260Y252-V256 HydrophobicContact CD1-CG2 4.19Å; Y252-V256 HydrophobicContact CD2-CG2 4.47Å; Y252-V256 HydrophobicContact CE1-CG2 3.68Å; Y252-V256 HydrophobicContact CE2-CG2 4Å; Y252-V256 WeakPolarHBondContact O-CG2 3.23Å; Y252-V256 PolarHBondContact O-N 2.92Å; E253-V256 PolarHBondContact O-N 3.33Å; I254-V256 PolarHBondContact O-N 2.85Å; V256-N259 PolarHBondContact O-N 2.67Å; V256-R260 HydrophobicContact CG1-CG 4.43Å; V256-R260 VanDerWaalsContact O-CG 3.32Å; V256-R260 WeakPolarHBondContact O-CG 3.31Å; V256-R260 PolarHBondContact O-N 3.49Å
257L97.9Very high94.1Very high87 Ų87104.8 Ų104.846%0.45550%0.495SS..Hα-helixtrans-63.2-43178.7-73.2171.6000111.7E253 I254 N259 R260 I261E253-L257 WeakPolarHBondContact O-CB 3.34Å; E253-L257 WeakPolarHBondContact O-CG 3.46Å; E253-L257 PolarHBondContact O-N 3.16Å; I254-L257 PolarHBondContact O-N 3.49Å; L257-N259 VanDerWaalsContact C-N 3.34Å; L257-N259 PolarHBondContact O-N 2.89Å; L257-R260 PolarHBondContact O-N 2.84Å; L257-I261 VanDerWaalsContact O-CG1 3.28Å; L257-I261 WeakPolarHBondContact O-CG1 3.33Å; L257-I261 PolarHBondContact O-N 2.9Å
258L96.7Very high92.4Very high93 Ų93108.8 Ų108.849%0.48751%0.51SS..Hα-helixtrans-60.7-44175.3-72.8173.2000111.3I254 T255 R260 I261 Q262I254-L258 HydrophobicContact CG2-CD1 3.86Å; I254-L258 HydrophobicContact CG2-CG 4.27Å; I254-L258 WeakPolarHBondContact O-CB 3.36Å; I254-L258 VanDerWaalsContact O-CG 3.24Å; I254-L258 WeakPolarHBondContact O-CG 3.19Å; I254-L258 PolarHBondContact O-N 3.24Å; T255-L258 PolarHBondContact O-N 3.43Å; L258-R260 PolarHBondContact O-N 3.45Å; L258-I261 PolarHBondContact O-N 2.91Å; L258-Q262 WeakPolarHBondContact O-CG 3.33Å; L258-Q262 PolarHBondContact O-N 3.49Å
259N96.5Very high90.5Very high75 Ų75113.9 Ų113.940%0.40153%0.532SS..Hα-helixtrans-60.7-46174.4-72.6-29.1000111.4T255 V256 L257 I261 Q262 H263T255-N259 PolarHBondContact O-N 2.97Å; T255-N259 PolarHBondContact O-ND2 2.9Å; V256-N259 PolarHBondContact O-N 2.67Å; L257-N259 VanDerWaalsContact C-N 3.34Å; L257-N259 PolarHBondContact O-N 2.89Å; N259-I261 VanDerWaalsContact C-N 3.33Å; N259-I261 PolarHBondContact O-N 3.36Å; N259-Q262 PolarHBondContact O-N 2.92Å; N259-H263 PolarHBondContact O-CD2 3.09Å; N259-H263 PolarHBondContact O-N 3.45Å
260R96.3Very high88.6Confident168 Ų168111.7 Ų111.763%0.63454%0.538SS*.Hα-helixtrans-59.3-42.4176.6-72171.969.6-178.43.3112.1V256 L257 L258 H263 A264V256-R260 HydrophobicContact CG1-CG 4.43Å; V256-R260 VanDerWaalsContact O-CG 3.32Å; V256-R260 WeakPolarHBondContact O-CG 3.31Å; V256-R260 PolarHBondContact O-N 3.49Å; L257-R260 PolarHBondContact O-N 2.84Å; L258-R260 PolarHBondContact O-N 3.45Å; R260-H263 PolarHBondContact O-N 3.06Å; R260-A264 WeakPolarHBondContact O-CB 3.25Å; R260-A264 PolarHBondContact O-N 2.89Å
261I95.3Very high86.7Confident87 Ų87116.4 Ų116.445%0.44656%0.56SS.*Hα-helixtrans-61.2-47.8175.5-69.9166000110.2L257 L258 N259 H263 A264 Q265L257-I261 VanDerWaalsContact O-CG1 3.28Å; L257-I261 WeakPolarHBondContact O-CG1 3.33Å; L257-I261 PolarHBondContact O-N 2.9Å; L258-I261 PolarHBondContact O-N 2.91Å; N259-I261 VanDerWaalsContact C-N 3.33Å; N259-I261 PolarHBondContact O-N 3.36Å; I261-H263 PolarHBondContact O-N 3.3Å; I261-A264 PolarHBondContact O-N 3.23Å; I261-Q265 HydrophobicContact CG2-CG 4.33Å; I261-Q265 WeakPolarHBondContact O-CB 3.26Å; I261-Q265 VanDerWaalsContact O-CG 3.31Å; I261-Q265 WeakPolarHBondContact O-CG 3.39Å; I261-Q265 PolarHBondContact O-N 2.99Å
262Q93.9Very high84.7Confident103 Ų103113.4 Ų113.448%0.48157%0.571SS.*Hα-helixtrans-59.8-45177.9-71.8178.32.900111.8L258 N259 Q265 K266L258-Q262 WeakPolarHBondContact O-CG 3.33Å; L258-Q262 PolarHBondContact O-N 3.49Å; N259-Q262 PolarHBondContact O-N 2.92Å; Q262-Q265 PolarHBondContact O-N 3.21Å; Q262-K266 WeakPolarHBondContact O-CG 3.34Å; Q262-K266 PolarHBondContact O-N 3.49Å
263H92.4Very high82.7Confident103 Ų103116 Ų11648%0.47759%0.585SS.*Hα-helixtrans-60.9-46.2175.6-78.4-73.3000111.9N259 R260 I261 Q265 K266 F267N259-H263 PolarHBondContact O-CD2 3.09Å; N259-H263 PolarHBondContact O-N 3.45Å; R260-H263 PolarHBondContact O-N 3.06Å; I261-H263 PolarHBondContact O-N 3.3Å; H263-Q265 VanDerWaalsContact C-N 3.29Å; H263-Q265 PolarHBondContact O-N 3.17Å; H263-K266 PolarHBondContact O-N 3.09Å; H263-F267 WeakPolarHBondContact O-CD2 3.49Å
264A91.3Very high80.5Confident55 Ų55114.9 Ų114.946%0.45560%0.599SS.*Hα-helixtrans-63.9-33.4177.700000112.8R260 I261R260-A264 WeakPolarHBondContact O-CB 3.25Å; R260-A264 PolarHBondContact O-N 2.89Å; I261-A264 PolarHBondContact O-N 3.23Å
265Q88.9Confident78.2Confident120 Ų120120.1 Ų120.156%0.56162%0.618SS**Hα-helixtrans-74.5-30.9177.8-75.2179.9-1500113.2I261 Q262 H263 F267 K268I261-Q265 HydrophobicContact CG2-CG 4.33Å; I261-Q265 WeakPolarHBondContact O-CB 3.26Å; I261-Q265 VanDerWaalsContact O-CG 3.31Å; I261-Q265 WeakPolarHBondContact O-CG 3.39Å; I261-Q265 PolarHBondContact O-N 2.99Å; Q262-Q265 PolarHBondContact O-N 3.21Å; H263-Q265 VanDerWaalsContact C-N 3.29Å; H263-Q265 PolarHBondContact O-N 3.17Å; Q265-F267 PolarHBondContact O-N 2.8Å; Q265-K268 PolarHBondContact O-N 2.87Å; Q265-K268 VanDerWaalsContact O-N 3.13Å
266K77.4Confident76.2Confident139 Ų139123 Ų12360%0.60464%0.635SS**Hα-helixtrans-57.4-34.9175.7-74.8171.8-173.1179.60112.1Q262 H263Q262-K266 WeakPolarHBondContact O-CG 3.34Å; Q262-K266 PolarHBondContact O-N 3.49Å; H263-K266 PolarHBondContact O-N 3.09Å
267F67.4Low73.8Confident170 Ų170124 Ų12475%0.74666%0.655SS**Hα-helixtrans-88.6-12179.2-57.7-72.3000114.3H263 Q265H263-F267 WeakPolarHBondContact O-CD2 3.49Å; Q265-F267 PolarHBondContact O-N 2.8Å
268K62.2Low71.4Confident177 Ų177122.2 Ų122.277%0.7766%0.658SS**Hα-helixtrans-81.4-11.5177.9-79.3-172.4176.9-173.70114.5Q265 G270Q265-K268 PolarHBondContact O-N 2.87Å; Q265-K268 VanDerWaalsContact O-N 3.13Å; K268-G270 VanDerWaalsContact C-N 3.3Å; K268-G270 PolarHBondContact O-N 3.45Å
269K58.7Low69.4Low209 Ų209129.1 Ų129.191%0.90968%0.678SS**THydrogen-bonded Turntrans-82.32176.8-95.9-177177177.80114.8
270G59Low67.1Low61 Ų61137 Ų13763%0.62970%0.702SS**SBendtrans-113.91.3-169.500000118.2K268K268-G270 VanDerWaalsContact C-N 3.3Å; K268-G270 PolarHBondContact O-N 3.45Å
271H57.1Low65.1Low190 Ų190141.7 Ų141.788%0.8873%0.727SS**SBendtrans-134.5112178.8-95.8-73.6000111.7
272G57Low63.6Low71 Ų71144.5 Ų144.573%0.73274%0.741SS**SBendtrans139.734.2160.700000118.8
273K55.5Low62Low211 Ų211146.6 Ų146.692%0.91776%0.755SS**  trans-137.451.2149.9-73.1-157.6-179-176.20111.6K275K273-K275 VanDerWaalsContact C-N 3.32Å; K273-K275 PolarHBondContact O-N 3.36Å; K273-K275 VanDerWaalsContact O-N 3.15Å
274G51.9Low60.3Low70 Ų70149.1 Ų149.172%0.72277%0.77SS**  trans-75.488.815700000108.4V276G274-V276 PolarHBondContact O-N 3.46Å
275K51.5Low58.5Low208 Ų208154.6 Ų154.690%0.90479%0.789SS**  trans-73.774.8167.8-167.7165.5-177.51730107.6K273 G277K273-K275 VanDerWaalsContact C-N 3.32Å; K273-K275 PolarHBondContact O-N 3.36Å; K273-K275 VanDerWaalsContact O-N 3.15Å; K275-G277 PolarHBondContact O-N 3.12Å
276V54.7Low56.6Low136 Ų136156.8 Ų156.882%0.82480%0.803SS**  trans-77.478.8169.6-168.60000106.8G274 G278G274-V276 PolarHBondContact O-N 3.46Å; V276-G278 PolarHBondContact O-N 3Å
277G47.7Very low55.2Low70 Ų70157.9 Ų157.972%0.72282%0.816SS**  trans-72.580.4166.400000108.9K275 R279K275-G277 PolarHBondContact O-N 3.12Å; G277-R279 PolarHBondContact O-N 2.9Å; G277-R279 VanDerWaalsContact O-N 3.1Å
278G47.6Very low54.3Low51 Ų51157.1 Ų157.153%0.52682%0.822SS.*  trans-65.2104171.300000110V276 W280V276-G278 PolarHBondContact O-N 3Å; G278-W280 PolarHBondContact O-N 3.36Å
279R55.4Low53.7Low237 Ų237155.5 Ų155.589%0.89483%0.826SS**  trans-73.3100.4162.3-179.5178.8176.7-152.41.1107.3G277G277-R279 PolarHBondContact O-N 2.9Å; G277-R279 VanDerWaalsContact O-N 3.1Å
280W47.8Very low53.3Low241 Ų241151.1 Ų151.191%0.91382%0.819SS**  trans-75.8137.1166.6-73.671.2000108.8G278G278-W280 PolarHBondContact O-N 3.36Å
281K54.2Low52.8Low267 Ų267159.3 Ų159.3100%1.16184%0.836SS**  trans-92.50-176.4-133.6-178.3-175.2176.70109.8

Retrieved 281 of 281 residues in 185.1 ms (Link to these results)