G4LVG9_SCHMA Loading...

Mitochondrial 60S ribosomal protein L7/L12,putative

AlphaFold DB , UniProt , Accession G4LVG9, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 181 aa.

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Site Residue pLDDT pLDDT confidence pLDDT10 pLDDT10 confidence SASA SASA [Ų] SASA10 SASA10 [Ų] RSA RSA unformatted RSA10 RSA10 unformatted Surface Surface10 (not used) Disorder (not used) Disorder Sec. str. Secondary structure Isomer Phi (φ) Psi (ψ) Omega (ω) Chi 1 (χ1) Chi 2 (χ2) Chi 3 (χ3) Chi 4 (χ4) Chi 5 (χ5) Tau (τ) Contacts (colored by PAE) Contact details
1M45.6Very low42.3Very low246 Ų246166.3 Ų166.3100%1.21286%0.855SS**  0106.70-78.2116.5143.100109
2N38Very low42.8Very low152 Ų152168.1 Ų168.181%0.81386%0.856SS**  trans-66.9139.4164.3-77.2-39.1000108.9
3L38Very low42.1Very low166 Ų166163.1 Ų163.187%0.86984%0.844SS**  trans176.7107.7136.5-97139.8000110.2K5L3-K5 PolarHBondContact O-N 3.43Å
4L38.2Very low41.4Very low146 Ų146159.4 Ų159.476%0.76484%0.839SS**  trans-35.3121.9159.4-76.860.8000111.4
5K48Very low41.3Very low213 Ų213161.5 Ų161.593%0.92684%0.839SS**  trans-10271.8152-75.4-164.8-180-1790108.6L3L3-K5 PolarHBondContact O-N 3.43Å
6F39.6Very low40.9Very low207 Ų207164.3 Ų164.391%0.90884%0.837SS**  trans-89.3106154.9-115.6-94.4000105.8
7G39.4Very low41Very low67 Ų67162.5 Ų162.569%0.69183%0.83SS**  trans-157.1100.2-171.200000114
8R47Very low40.9Very low243 Ų243157.3 Ų157.392%0.91782%0.823SS**  trans82.797.7149-63.7-172.5179165.4-0.4119.7
9I43.7Very low41Very low160 Ų160158.2 Ų158.282%0.82182%0.82SS**  trans-41.9131.5135.8-117.579.9000111.7
10V48.8Very low40.8Very low129 Ų129156 Ų15678%0.78282%0.819SS**  trans-158.690.9151.5179.40000104.3
11S39.1Very low41Very low100 Ų100156 Ų15670%0.69981%0.813SS**  4186.882.1-156.50000114.7
12H48.7Very low40.7Very low188 Ų188150 Ų15087%0.8779%0.791SS**  trans-143.8112.3145-147.487.3000109.8
13C32.7Very low40.7Very low103 Ų103153.9 Ų153.970%0.69680%0.797SS**  trans-74.4163.2169.7-77.30000111.4
14S32.4Very low40.8Very low112 Ų112151.4 Ų151.478%0.78379%0.788SS**  trans68.2119.4157.9-74.80000117.7
15F40.6Very low40.8Very low190 Ų190152.5 Ų152.583%0.83379%0.789SS**  -175.8128.391.2-168.9-117.1000111.4
16Y34.3Very low40.7Very low206 Ų206150.6 Ų150.681%0.80879%0.786SS**  trans-67.7131.4169.5-134.2-109.2000109.6
17N42.2Very low40.4Very low135 Ų135145 Ų14572%0.72278%0.778SS**  trans165.5129.4130.8-96.5-48.5000113.7
18G39.2Very low40.5Very low68 Ų68147.3 Ų147.370%0.70178%0.779SS**  6689.912900000117.7
19F43.6Very low40.2Very low174 Ų174143.7 Ų143.776%0.76378%0.777SS**  trans-122.370.1153.6-118.5-67.9000110.5K21F19-K21 VanDerWaalsContact C-N 3.3Å; F19-K21 HydrophobicContact CD1-CB 4.36Å; F19-K21 HydrophobicContact CD1-CD 3.63Å; F19-K21 HydrophobicContact CD1-CG 3.53Å; F19-K21 HydrophobicContact CE1-CD 3.78Å; F19-K21 HydrophobicContact CE1-CG 3.66Å; F19-K21 PolarHBondContact O-N 3.13Å; F19-K21 VanDerWaalsContact O-N 3.11Å
20S36.7Very low39.8Very low115 Ų115144.4 Ų144.480%0.80478%0.782SS**  trans-6790.5153.7168.80000107.7P22S20-P22 WeakPolarHBondContact O-CD 3.45Å
21K44.7Very low39.1Very low157 Ų157141.3 Ų141.368%0.68378%0.776SS**  trans-88.9114.5170-104.7161.7-168.2-163.80108.5F19 Y23F19-K21 VanDerWaalsContact C-N 3.3Å; F19-K21 HydrophobicContact CD1-CB 4.36Å; F19-K21 HydrophobicContact CD1-CD 3.63Å; F19-K21 HydrophobicContact CD1-CG 3.53Å; F19-K21 HydrophobicContact CE1-CD 3.78Å; F19-K21 HydrophobicContact CE1-CG 3.66Å; F19-K21 PolarHBondContact O-N 3.13Å; F19-K21 VanDerWaalsContact O-N 3.11Å; K21-Y23 PolarHBondContact O-N 3.44Å
22P40.3Very low39Very low118 Ų118141.1 Ų141.177%0.76678%0.781SS**  trans-69.8110.5175.327.7-32.1000109.5S20 T24S20-P22 WeakPolarHBondContact O-CD 3.45Å; P22-T24 PolarHBondContact O-N 2.93Å
23Y38Very low38.7Very low235 Ų235138.8 Ų138.892%0.92278%0.775SS**  trans-92.183.4174.9-151.4-94.9000107.8K21K21-Y23 PolarHBondContact O-N 3.44Å
24T38.8Very low39.5Very low113 Ų113142.9 Ų142.969%0.69378%0.781SS**  trans-144.2121.5175-64.10000109.1P22P22-T24 PolarHBondContact O-N 2.93Å
25Q39.2Very low40.1Very low169 Ų169144.3 Ų144.379%0.7978%0.78SS**  trans79.5113.3168.1-70.1-176.250.500119
26M45.1Very low40.2Very low174 Ų174142.5 Ų142.586%0.85778%0.778SS**  148.586.4129.2-75.8-178.3-161.500106.7
27A35Very low41Very low89 Ų89138.2 Ų138.274%0.73677%0.773SS**  56.6128.484.900000113.1
28T39.9Very low41.7Very low115 Ų115136.4 Ų136.471%0.70677%0.768SS**  trans78.683.8165.975.30000118.2
29N40.7Very low42.4Very low167 Ų167138.3 Ų138.389%0.89377%0.768SS**  trans-152.872138.2-80.3-46.5000106.3G31N29-G31 PolarHBondContact O-N 3.27Å
30L35.4Very low42.7Very low176 Ų176134.7 Ų134.792%0.92177%0.765SS**  27.279.5107.6-95.579.4000113.2
31G35Very low43.4Very low63 Ų63136.9 Ų136.965%0.64977%0.766SS**  trans-150.759.5173.700000110.4N29 D33N29-G31 PolarHBondContact O-N 3.27Å; G31-D33 PolarHBondContact O-N 3.22Å; G31-D33 VanDerWaalsContact O-N 3.13Å
32A36.6Very low43.5Very low97 Ų97133.6 Ų133.680%0.80276%0.763SS**  trans26.973.4161.900000115.3K34A32-K34 PolarHBondContact O-N 3.44Å
33D42Very low44.4Very low138 Ų138131.8 Ų131.874%0.73876%0.759SS**  trans-52.9104.4157.4-76.2-66.3000107.7G31 D35G31-D33 PolarHBondContact O-N 3.22Å; G31-D33 VanDerWaalsContact O-N 3.13Å; D33-D35 PolarHBondContact O-N 3.33Å
34K49.2Very low45.6Very low190 Ų190127.9 Ų127.983%0.82675%0.754SS**  trans-62.294.2158.6-72.1179.8175.9173.40106.1A32 L36A32-K34 PolarHBondContact O-N 3.44Å; K34-L36 PolarHBondContact O-N 3.26Å
35D45.2Very low47.1Very low142 Ų142129.7 Ų129.776%0.75976%0.759SS**  trans34.375.9148.9-55.9-57.5000113.7D33 V37D33-D35 PolarHBondContact O-N 3.33Å; D35-V37 HydrophobicContact CB-CG2 4.41Å; D35-V37 PolarHBondContact O-N 3.28Å
36L42.9Very low49Very low152 Ų152128.4 Ų128.480%0.79675%0.751SS**  trans-66.668158.2-65.7174000108.2K34 P38K34-L36 PolarHBondContact O-N 3.26Å; L36-P38 VanDerWaalsContact O-CD 3.27Å; L36-P38 WeakPolarHBondContact O-CD 2.89Å
37V51.8Low50.8Low115 Ų115128.8 Ų128.870%0.69775%0.751SS**  trans-68.9113.7161179.30000104.4D35D35-V37 HydrophobicContact CB-CG2 4.41Å; D35-V37 PolarHBondContact O-N 3.28Å
38P57.3Low53.3Low98 Ų98130 Ų13064%0.63674%0.737SS**  trans-53.7142.7176.724.1-33000107.5L36 S40L36-P38 VanDerWaalsContact O-CD 3.27Å; L36-P38 WeakPolarHBondContact O-CD 2.89Å; P38-S40 PolarHBondContact O-N 2.9Å
39P53.2Low55.8Low108 Ų108127.7 Ų127.770%0.70172%0.724SS**  trans-52.5112.7175.223.6-31.9000106.1L41P39-L41 PolarHBondContact O-N 2.89Å
40S49.6Very low58.3Low98 Ų98128.1 Ų128.169%0.68572%0.718SS**  trans-59.296.4161.665.70000102.8P38 S42P38-S40 PolarHBondContact O-N 2.9Å; S40-S42 WeakPolarHBondContact O-CA 3.05Å; S40-S42 PolarHBondContact O-N 3.27Å; S40-S42 PolarHBondContact O-OG 2.88Å
41L50.7Low61Low160 Ų160124.7 Ų124.784%0.83870%0.697SS**  trans-57101.3173-79.2167.2000103P39 A43P39-L41 PolarHBondContact O-N 2.89Å; L41-A43 PolarHBondContact O-N 2.95Å; L41-A43 VanDerWaalsContact O-N 3.12Å
42S48Very low63.8Low88 Ų88124.5 Ų124.562%0.61568%0.68SS**  trans-53.1126.7-164.2-59.10000105.3S40 D44S40-S42 WeakPolarHBondContact O-CA 3.05Å; S40-S42 PolarHBondContact O-N 3.27Å; S40-S42 PolarHBondContact O-OG 2.88Å; S42-D44 PolarHBondContact O-N 3.34Å
43A58.2Low66.5Low81 Ų81124.3 Ų124.367%0.66966%0.663SS**  trans-48.694.3172.200000107.1L41 N45L41-A43 PolarHBondContact O-N 2.95Å; L41-A43 VanDerWaalsContact O-N 3.12Å; A43-N45 PolarHBondContact O-N 2.98Å
44D63.2Low69Low153 Ų153123 Ų12382%0.81865%0.652SS**  trans-62.992164.1-75.4-36.6000102.3S42 K46S42-D44 PolarHBondContact O-N 3.34Å; D44-K46 PolarHBondContact O-N 3.12Å
45N70.5Confident71.1Confident150 Ų150118 Ų11880%0.80263%0.634SS**  trans-6769.5169.5-90.3-73.3000105.8A43 E47A43-N45 PolarHBondContact O-N 2.98Å; N45-E47 PolarHBondContact O-N 2.99Å
46K79Confident73.4Confident142 Ų142115.2 Ų115.262%0.61762%0.621SS**  trans-65.896.9160.9-176171.3-177.2177.70104.2D44 Y48D44-K46 PolarHBondContact O-N 3.12Å; K46-Y48 HydrophobicContact CB-CE2 4.28Å; K46-Y48 HydrophobicContact CD-CE1 3.89Å; K46-Y48 HydrophobicContact CG-CE1 4.06Å; K46-Y48 WeakPolarHBondContact O-CD2 3.49Å; K46-Y48 WeakPolarHBondContact O-CE2 3.32Å; K46-Y48 PolarHBondContact O-N 3.41Å; K46-Y48 VanDerWaalsContact O-N 3.09Å
47E84.2Confident75.9Confident183 Ų183112.9 Ų112.986%0.85561%0.609SS**  trans-62.6115176.6-171.8166.717500107.8N45N45-E47 PolarHBondContact O-N 2.99Å
48Y86.6Confident77.9Confident114 Ų114116 Ų11645%0.44761%0.609SS.*  trans-88.5144.6178.4-64.7-78.8000109.1K46 I52 H53K46-Y48 HydrophobicContact CB-CE2 4.28Å; K46-Y48 HydrophobicContact CD-CE1 3.89Å; K46-Y48 HydrophobicContact CG-CE1 4.06Å; K46-Y48 WeakPolarHBondContact O-CD2 3.49Å; K46-Y48 WeakPolarHBondContact O-CE2 3.32Å; K46-Y48 PolarHBondContact O-N 3.41Å; K46-Y48 VanDerWaalsContact O-N 3.09Å; Y48-I52 HydrophobicContact CD1-CG2 4.19Å; Y48-I52 HydrophobicContact CG-CG2 4.12Å; Y48-H53 PolarHBondContact O-CD2 3.16Å; Y48-H53 PolarHBondContact O-NE2 2.87Å
49P92.7Very high79.6Confident66 Ų66114.9 Ų114.943%0.42960%0.597SS.*  trans-63.915617627.3-34.4000111H51 I52P49-H51 WeakPolarHBondContact CG-CE1 3.31Å; P49-H51 PolarHBondContact O-N 2.64Å; P49-I52 HydrophobicContact CG-CG1 3.84Å; P49-I52 PolarHBondContact O-N 3.42Å
50K93.1Very high81.4Confident176 Ų176114.1 Ų114.177%0.76559%0.594SS**Hα-helixtrans-47.6-41.2-175.2-65.4-176.1177.8-177.20114.1I52 H53 E54K50-I52 VanDerWaalsContact C-N 3.27Å; K50-I52 PolarHBondContact O-N 3.41Å; K50-H53 PolarHBondContact O-N 2.74Å; K50-E54 WeakPolarHBondContact O-CG 3.38Å; K50-E54 PolarHBondContact O-N 3.3Å
51H92.8Very high83.5Confident105 Ų105113.8 Ų113.849%0.48659%0.592SS.*Hα-helixtrans-62.8-30.3-179.167.5-97.4000113.5P49 I55P49-H51 WeakPolarHBondContact CG-CE1 3.31Å; P49-H51 PolarHBondContact O-N 2.64Å; H51-I55 WeakPolarHBondContact O-CD1 3.47Å; H51-I55 VanDerWaalsContact O-CG1 3.24Å; H51-I55 WeakPolarHBondContact O-CG1 3.25Å; H51-I55 PolarHBondContact O-N 2.98Å; H51-I55 VanDerWaalsContact O-N 3.08Å
52I93.1Very high85.6Confident58 Ų58109 Ų10930%0.29757%0.567SS.*Hα-helixtrans-72.6-43.5177.2-60.9-63.6000110.1Y48 P49 K50 E54 I55 V56Y48-I52 HydrophobicContact CD1-CG2 4.19Å; Y48-I52 HydrophobicContact CG-CG2 4.12Å; P49-I52 HydrophobicContact CG-CG1 3.84Å; P49-I52 PolarHBondContact O-N 3.42Å; K50-I52 VanDerWaalsContact C-N 3.27Å; K50-I52 PolarHBondContact O-N 3.41Å; I52-E54 VanDerWaalsContact C-N 3.28Å; I52-E54 PolarHBondContact O-N 3.46Å; I52-I55 PolarHBondContact O-N 3.32Å; I52-V56 HydrophobicContact CG2-CG2 4.42Å; I52-V56 WeakPolarHBondContact O-CG2 3.37Å; I52-V56 PolarHBondContact O-N 3.48Å
53H92.8Very high87.8Confident94 Ų94108.7 Ų108.744%0.43556%0.561SS.*Hα-helixtrans-59.9-39.9174.4-73.1-72.4000111.8Y48 K50 V56 N57Y48-H53 PolarHBondContact O-CD2 3.16Å; Y48-H53 PolarHBondContact O-NE2 2.87Å; K50-H53 PolarHBondContact O-N 2.74Å; H53-V56 PolarHBondContact O-N 3.05Å; H53-N57 WeakPolarHBondContact O-CB 3.42Å; H53-N57 PolarHBondContact O-N 2.96Å; H53-N57 PolarHBondContact O-ND2 3.33Å
54E95.1Very high89.4Confident111 Ų111112.4 Ų112.452%0.51957%0.569SS.*Hα-helixtrans-61.6-42.9174.2-71.6171-159.700112.5K50 I52 N57 R58K50-E54 WeakPolarHBondContact O-CG 3.38Å; K50-E54 PolarHBondContact O-N 3.3Å; I52-E54 VanDerWaalsContact C-N 3.28Å; I52-E54 PolarHBondContact O-N 3.46Å; E54-N57 PolarHBondContact O-N 3.07Å; E54-R58 WeakPolarHBondContact O-CB 3.44Å; E54-R58 VanDerWaalsContact O-CG 3.32Å; E54-R58 WeakPolarHBondContact O-CG 3.38Å; E54-R58 PolarHBondContact O-N 3.31Å
55I94.2Very high90.9Very high85 Ų85111.8 Ų111.844%0.43657%0.565SS.*Hα-helixtrans-63.3-45.9176.2-69.5163.5000110.5H51 I52 N57 R58 I59H51-I55 WeakPolarHBondContact O-CD1 3.47Å; H51-I55 VanDerWaalsContact O-CG1 3.24Å; H51-I55 WeakPolarHBondContact O-CG1 3.25Å; H51-I55 PolarHBondContact O-N 2.98Å; H51-I55 VanDerWaalsContact O-N 3.08Å; I52-I55 PolarHBondContact O-N 3.32Å; I55-N57 PolarHBondContact O-N 2.96Å; I55-R58 PolarHBondContact O-N 3.41Å; I55-I59 HydrophobicContact CG2-CD1 3.61Å; I55-I59 HydrophobicContact CG2-CG1 4.31Å; I55-I59 VanDerWaalsContact O-CG1 3.29Å; I55-I59 WeakPolarHBondContact O-CG1 3.24Å; I55-I59 PolarHBondContact O-N 3.35Å
56V93.1Very high92Very high82 Ų82109 Ų10950%0.49755%0.547SS..Hα-helixtrans-60.7-46.5178.7171.80000110.9I52 H53 R58 I59 S60I52-V56 HydrophobicContact CG2-CG2 4.42Å; I52-V56 WeakPolarHBondContact O-CG2 3.37Å; I52-V56 PolarHBondContact O-N 3.48Å; H53-V56 PolarHBondContact O-N 3.05Å; V56-R58 VanDerWaalsContact C-N 3.33Å; V56-R58 PolarHBondContact O-N 3.32Å; V56-I59 PolarHBondContact O-N 3.05Å; V56-S60 WeakPolarHBondContact O-CB 3.24Å; V56-S60 PolarHBondContact O-N 2.86Å; V56-S60 PolarHBondContact O-OG 3.02Å
57N94.1Very high92.8Very high103 Ų103104.9 Ų104.955%0.55153%0.533SS*.Hα-helixtrans-60.9-43.4177.9-70.4-18.6000111.4H53 E54 I55 S60 S61H53-N57 WeakPolarHBondContact O-CB 3.42Å; H53-N57 PolarHBondContact O-N 2.96Å; H53-N57 PolarHBondContact O-ND2 3.33Å; E54-N57 PolarHBondContact O-N 3.07Å; I55-N57 PolarHBondContact O-N 2.96Å; N57-S60 WeakPolarHBondContact CA-OG 3.25Å; N57-S60 PolarHBondContact O-N 2.9Å; N57-S60 PolarHBondContact O-OG 3.08Å; N57-S61 PolarHBondContact O-N 2.91Å; N57-S61 PolarHBondContact O-OG 3.4Å
58R94.7Very high93.2Very high181 Ų18198.9 Ų98.968%0.68352%0.515SS*.Hα-helixtrans-61.5-50.2175.8-74.6176.8-177.1-119.22.7111.3E54 I55 V56 S60 S61 L62E54-R58 WeakPolarHBondContact O-CB 3.44Å; E54-R58 VanDerWaalsContact O-CG 3.32Å; E54-R58 WeakPolarHBondContact O-CG 3.38Å; E54-R58 PolarHBondContact O-N 3.31Å; I55-R58 PolarHBondContact O-N 3.41Å; V56-R58 VanDerWaalsContact C-N 3.33Å; V56-R58 PolarHBondContact O-N 3.32Å; R58-S60 VanDerWaalsContact C-N 3.3Å; R58-S60 PolarHBondContact O-N 3.16Å; R58-S61 PolarHBondContact O-N 3.49Å; R58-S61 VanDerWaalsContact O-N 3.1Å; R58-S61 PolarHBondContact O-OG 3.12Å; R58-L62 WeakPolarHBondContact O-CG 2.87Å; R58-L62 PolarHBondContact O-N 3.14Å
59I92.9Very high93.5Very high75 Ų7598 Ų9839%0.38552%0.519SS..Hα-helixtrans-59-41.9178.6-67168.9000111.1I55 V56 S61 L62 L70I55-I59 HydrophobicContact CG2-CD1 3.61Å; I55-I59 HydrophobicContact CG2-CG1 4.31Å; I55-I59 VanDerWaalsContact O-CG1 3.29Å; I55-I59 WeakPolarHBondContact O-CG1 3.24Å; I55-I59 PolarHBondContact O-N 3.35Å; V56-I59 PolarHBondContact O-N 3.05Å; I59-S61 PolarHBondContact O-N 3.15Å; I59-L62 PolarHBondContact O-N 3.42Å; I59-L62 VanDerWaalsContact O-N 3.17Å; I59-L70 HydrophobicContact CG1-CD1 4.31Å
60S89.9Confident93.6Very high92 Ų9297.7 Ų97.764%0.64351%0.513SS*.Hα-helixtrans-66-21.9179.671.30000114.2V56 N57 R58V56-S60 WeakPolarHBondContact O-CB 3.24Å; V56-S60 PolarHBondContact O-N 2.86Å; V56-S60 PolarHBondContact O-OG 3.02Å; N57-S60 WeakPolarHBondContact CA-OG 3.25Å; N57-S60 PolarHBondContact O-N 2.9Å; N57-S60 PolarHBondContact O-OG 3.08Å; R58-S60 VanDerWaalsContact C-N 3.3Å; R58-S60 PolarHBondContact O-N 3.16Å
61S94.6Very high93.5Very high91 Ų9191.9 Ų91.964%0.63650%0.495SS*.Hα-helixtrans-89.1-11.3177.667.80000113.8N57 R58 I59N57-S61 PolarHBondContact O-N 2.91Å; N57-S61 PolarHBondContact O-OG 3.4Å; R58-S61 PolarHBondContact O-N 3.49Å; R58-S61 VanDerWaalsContact O-N 3.1Å; R58-S61 PolarHBondContact O-OG 3.12Å; I59-S61 PolarHBondContact O-N 3.15Å
62L94.1Very high93.4Very high60 Ų6091.3 Ų91.331%0.31449%0.492SS..SBendtrans-78.7149.7-179.2-66.7175.9000111.7R58 I59 E66 V67 L70R58-L62 WeakPolarHBondContact O-CG 2.87Å; R58-L62 PolarHBondContact O-N 3.14Å; I59-L62 PolarHBondContact O-N 3.42Å; I59-L62 VanDerWaalsContact O-N 3.17Å; L62-E66 HydrophobicContact CB-CB 4.2Å; L62-E66 HydrophobicContact CD2-CB 4.1Å; L62-V67 HydrophobicContact CB-CG2 3.84Å; L62-V67 HydrophobicContact CD1-CG2 4.5Å; L62-L70 HydrophobicContact CD1-CD1 3.68Å
63T94.4Very high93.3Very high80 Ų8093.3 Ų93.349%0.49150%0.503SS..  trans-77.2160.5170.365.60000111.4L65 E66 V67T63-L65 PolarHBondContact O-N 2.87Å; T63-E66 WeakPolarHBondContact CB-OE2 3.47Å; T63-E66 PolarHBondContact N-OE2 3.33Å; T63-E66 PolarHBondContact O-N 3.35Å; T63-E66 VanDerWaalsContact O-N 3.13Å; T63-E66 WeakPolarHBondContact OG1-CG 3.27Å; T63-E66 PolarHBondContact OG1-OE2 3.14Å; T63-V67 WeakPolarHBondContact O-CG2 3.42Å; T63-V67 PolarHBondContact O-N 2.9Å
64L92.5Very high93.2Very high159 Ų15993.2 Ų93.283%0.83251%0.505SS*.Hα-helixtrans-58.4-32-179.1-66.8177.4000113.5A68L64-A68 PolarHBondContact O-N 3.47Å
65L94Very high92.7Very high141 Ų14191 Ų9174%0.73850%0.495SS*.Hα-helixtrans-69.5-46.1176.6-65.2177.9000111.2T63 V67 A68 D69T63-L65 PolarHBondContact O-N 2.87Å; L65-V67 VanDerWaalsContact C-N 3.27Å; L65-V67 PolarHBondContact O-N 3.25Å; L65-A68 WeakPolarHBondContact O-CB 2.95Å; L65-A68 PolarHBondContact O-N 2.7Å; L65-A68 VanDerWaalsContact O-N 3.08Å; L65-D69 PolarHBondContact O-N 2.85Å; L65-D69 VanDerWaalsContact O-N 3.13Å
66E94.5Very high92.4Very high90 Ų9093.4 Ų93.442%0.42150%0.502SS..Hα-helixtrans-65.6-31.6177.9-66.6165.8135.200112.2L62 T63 A68 D69 L70L62-E66 HydrophobicContact CB-CB 4.2Å; L62-E66 HydrophobicContact CD2-CB 4.1Å; T63-E66 WeakPolarHBondContact CB-OE2 3.47Å; T63-E66 PolarHBondContact N-OE2 3.33Å; T63-E66 PolarHBondContact O-N 3.35Å; T63-E66 VanDerWaalsContact O-N 3.13Å; T63-E66 WeakPolarHBondContact OG1-CG 3.27Å; T63-E66 PolarHBondContact OG1-OE2 3.14Å; E66-A68 VanDerWaalsContact C-N 3.32Å; E66-D69 PolarHBondContact O-N 3.3Å; E66-L70 VanDerWaalsContact O-CB 3.29Å; E66-L70 WeakPolarHBondContact O-CB 3.42Å; E66-L70 PolarHBondContact O-N 3.48Å
67V94.8Very high92.2Very high56 Ų5698 Ų9834%0.33952%0.515SS..Hα-helixtrans-65.6-36.4173.3174.20000111.3L62 T63 L65 L70 S71L62-V67 HydrophobicContact CB-CG2 3.84Å; L62-V67 HydrophobicContact CD1-CG2 4.5Å; T63-V67 WeakPolarHBondContact O-CG2 3.42Å; T63-V67 PolarHBondContact O-N 2.9Å; L65-V67 VanDerWaalsContact C-N 3.27Å; L65-V67 PolarHBondContact O-N 3.25Å; V67-L70 PolarHBondContact O-N 2.94Å; V67-S71 PolarHBondContact O-N 2.98Å
68A92.5Very high91.9Very high58 Ų5898.6 Ų98.648%0.47952%0.518SS..Hα-helixtrans-65.2-46174.600000111.2L64 L65 E66 L70 S71 E72L64-A68 PolarHBondContact O-N 3.47Å; L65-A68 WeakPolarHBondContact O-CB 2.95Å; L65-A68 PolarHBondContact O-N 2.7Å; L65-A68 VanDerWaalsContact O-N 3.08Å; E66-A68 VanDerWaalsContact C-N 3.32Å; A68-L70 VanDerWaalsContact C-N 3.34Å; A68-L70 PolarHBondContact O-N 3.32Å; A68-S71 WeakPolarHBondContact O-CB 3.36Å; A68-S71 PolarHBondContact O-N 3.37Å; A68-E72 PolarHBondContact O-N 3.48Å
69D94.6Very high91.1Very high96 Ų9696 Ų9651%0.51352%0.518SS..Hα-helixtrans-61.6-42175.6-67.8-19000111.7L65 E66 S71 E72 L73L65-D69 PolarHBondContact O-N 2.85Å; L65-D69 VanDerWaalsContact O-N 3.13Å; E66-D69 PolarHBondContact O-N 3.3Å; D69-S71 VanDerWaalsContact C-N 3.32Å; D69-S71 PolarHBondContact O-N 3.46Å; D69-E72 PolarHBondContact O-N 3.21Å; D69-L73 WeakPolarHBondContact O-CB 3.15Å; D69-L73 WeakPolarHBondContact O-CG 3.49Å; D69-L73 PolarHBondContact O-N 3.38Å
70L94.3Very high90.3Very high58 Ų5897 Ų9730%0.30452%0.523SS..Hα-helixtrans-58-45.2174.4179.2156.1000110.9I59 L62 E66 V67 A68 L73 L74I59-L70 HydrophobicContact CG1-CD1 4.31Å; L62-L70 HydrophobicContact CD1-CD1 3.68Å; E66-L70 VanDerWaalsContact O-CB 3.29Å; E66-L70 WeakPolarHBondContact O-CB 3.42Å; E66-L70 PolarHBondContact O-N 3.48Å; V67-L70 PolarHBondContact O-N 2.94Å; A68-L70 VanDerWaalsContact C-N 3.34Å; A68-L70 PolarHBondContact O-N 3.32Å; L70-L73 PolarHBondContact O-N 2.9Å; L70-L74 HydrophobicContact CD2-CD1 3.52Å; L70-L74 HydrophobicContact CD2-CG 4.1Å; L70-L74 VanDerWaalsContact O-CG 3.32Å; L70-L74 WeakPolarHBondContact O-CG 3.27Å; L70-L74 PolarHBondContact O-N 3.38Å
71S90.7Very high89.2Confident55 Ų5599.8 Ų99.839%0.38552%0.523SS..Hα-helixtrans-61.7-44.3177.7-176.60000111.8V67 A68 D69 L74 Q75V67-S71 PolarHBondContact O-N 2.98Å; A68-S71 WeakPolarHBondContact O-CB 3.36Å; A68-S71 PolarHBondContact O-N 3.37Å; D69-S71 VanDerWaalsContact C-N 3.32Å; D69-S71 PolarHBondContact O-N 3.46Å; S71-L74 PolarHBondContact O-N 3.32Å; S71-Q75 VanDerWaalsContact O-CG 3.28Å; S71-Q75 WeakPolarHBondContact O-CG 3.36Å; S71-Q75 PolarHBondContact O-N 2.87Å; S71-Q75 PolarHBondContact O-NE2 3.27Å; S71-Q75 PolarHBondContact OG-NE2 2.81Å; S71-Q75 VanDerWaalsContact OG-NE2 3.12Å
72E90.1Very high87.7Confident92 Ų92100.4 Ų100.443%0.4352%0.519SS..Hα-helixtrans-64.8-42.3177.5-170.7-177.5161.600111.8A68 D69 L74 Q75 K76A68-E72 PolarHBondContact O-N 3.48Å; D69-E72 PolarHBondContact O-N 3.21Å; E72-L74 PolarHBondContact O-N 2.98Å; E72-Q75 PolarHBondContact O-N 3.46Å; E72-K76 HydrophobicContact CG-CD 4.41Å; E72-K76 WeakPolarHBondContact O-CG 3.44Å; E72-K76 PolarHBondContact O-N 2.85Å; E72-K76 WeakPolarHBondContact OE1-CE 3.36Å; E72-K76 IonicContact OE1-NZ 2.64Å; E72-K76 PolarHBondContact OE1-NZ 2.89Å
73L91.1Very high86.1Confident101 Ų101103.7 Ų103.753%0.52954%0.542SS..Hα-helixtrans-62.9-42176-73.6176.3000111.8D69 L70 Q75 K76 K77D69-L73 WeakPolarHBondContact O-CB 3.15Å; D69-L73 WeakPolarHBondContact O-CG 3.49Å; D69-L73 PolarHBondContact O-N 3.38Å; L70-L73 PolarHBondContact O-N 2.9Å; L73-Q75 VanDerWaalsContact C-N 3.34Å; L73-K76 PolarHBondContact O-N 2.81Å; L73-K77 VanDerWaalsContact O-CB 3.3Å; L73-K77 WeakPolarHBondContact O-CB 3.34Å; L73-K77 WeakPolarHBondContact O-CG 3.48Å; L73-K77 PolarHBondContact O-N 3.27Å
74L90.6Very high84.6Confident92 Ų92100.9 Ų100.948%0.48253%0.529SS..Hα-helixtrans-62.7-41.4174.7-72.4-178.8000111.6L70 S71 E72 K77 L78L70-L74 HydrophobicContact CD2-CD1 3.52Å; L70-L74 HydrophobicContact CD2-CG 4.1Å; L70-L74 VanDerWaalsContact O-CG 3.32Å; L70-L74 WeakPolarHBondContact O-CG 3.27Å; L70-L74 PolarHBondContact O-N 3.38Å; S71-L74 PolarHBondContact O-N 3.32Å; E72-L74 PolarHBondContact O-N 2.98Å; L74-K77 PolarHBondContact O-N 3.07Å; L74-L78 VanDerWaalsContact O-CB 3.3Å; L74-L78 WeakPolarHBondContact O-CB 3.35Å; L74-L78 VanDerWaalsContact O-CG 3.32Å; L74-L78 WeakPolarHBondContact O-CG 3.21Å; L74-L78 PolarHBondContact O-N 2.73Å
75Q86Confident82.9Confident64 Ų6498.6 Ų98.630%0.29952%0.524SS..Hα-helixtrans-62.2-46.2176-72.6169.260.800111.9S71 E72 L73 N79 I80S71-Q75 VanDerWaalsContact O-CG 3.28Å; S71-Q75 WeakPolarHBondContact O-CG 3.36Å; S71-Q75 PolarHBondContact O-N 2.87Å; S71-Q75 PolarHBondContact O-NE2 3.27Å; S71-Q75 PolarHBondContact OG-NE2 2.81Å; S71-Q75 VanDerWaalsContact OG-NE2 3.12Å; E72-Q75 PolarHBondContact O-N 3.46Å; L73-Q75 VanDerWaalsContact C-N 3.34Å; Q75-N79 WeakPolarHBondContact O-CA 3.47Å; Q75-N79 PolarHBondContact O-N 2.89Å; Q75-I80 PolarHBondContact O-N 3.46Å
76K88Confident81.3Confident136 Ų13698.1 Ų98.159%0.59153%0.526SS*.Hα-helixtrans-62.2-44.2176-72.8176.2-178.1168.80111.9E72 L73 N79E72-K76 HydrophobicContact CG-CD 4.41Å; E72-K76 WeakPolarHBondContact O-CG 3.44Å; E72-K76 PolarHBondContact O-N 2.85Å; E72-K76 WeakPolarHBondContact OE1-CE 3.36Å; E72-K76 IonicContact OE1-NZ 2.64Å; E72-K76 PolarHBondContact OE1-NZ 2.89Å; L73-K76 PolarHBondContact O-N 2.81Å; K76-N79 PolarHBondContact O-N 3.22Å
77K87.7Confident79.5Confident178 Ų178100 Ų10077%0.77454%0.536SS*.Hα-helixtrans-68.7-40.2-178.6-73.8-67.9-178.1-175.20112.8L73 L74 N79L73-K77 VanDerWaalsContact O-CB 3.3Å; L73-K77 WeakPolarHBondContact O-CB 3.34Å; L73-K77 WeakPolarHBondContact O-CG 3.48Å; L73-K77 PolarHBondContact O-N 3.27Å; L74-K77 PolarHBondContact O-N 3.07Å; K77-N79 VanDerWaalsContact C-N 3.27Å
78L87.8Confident77.7Confident116 Ų116102 Ų10261%0.60755%0.551SS**Hα-helixtrans-86.4-1179.5-61.2176.5000112.6L74 I80L74-L78 VanDerWaalsContact O-CB 3.3Å; L74-L78 WeakPolarHBondContact O-CB 3.35Å; L74-L78 VanDerWaalsContact O-CG 3.32Å; L74-L78 WeakPolarHBondContact O-CG 3.21Å; L74-L78 PolarHBondContact O-N 2.73Å; L78-I80 HydrophobicContact CB-CB 4.48Å; L78-I80 HydrophobicContact CB-CD1 3.63Å; L78-I80 HydrophobicContact CB-CG1 3.66Å; L78-I80 HydrophobicContact CD1-CD1 3.74Å; L78-I80 HydrophobicContact CG-CD1 4.34Å; L78-I80 PolarHBondContact O-N 3.01Å
79N78.7Confident76.1Confident127 Ų127107.3 Ų107.368%0.67957%0.568SS**THydrogen-bonded Turntrans45.831.1-169.8-163.925.4000112.3Q75 K76 K77 K81Q75-N79 WeakPolarHBondContact O-CA 3.47Å; Q75-N79 PolarHBondContact O-N 2.89Å; K76-N79 PolarHBondContact O-N 3.22Å; K77-N79 VanDerWaalsContact C-N 3.27Å; N79-K81 PolarHBondContact O-N 2.95Å
80I76Confident74.3Confident96 Ų96111.5 Ų111.549%0.49259%0.587SS.*  trans-78.687.7171.6-61169.5000103.3Q75 L78 N82Q75-I80 PolarHBondContact O-N 3.46Å; L78-I80 HydrophobicContact CB-CB 4.48Å; L78-I80 HydrophobicContact CB-CD1 3.63Å; L78-I80 HydrophobicContact CB-CG1 3.66Å; L78-I80 HydrophobicContact CD1-CD1 3.74Å; L78-I80 HydrophobicContact CG-CD1 4.34Å; L78-I80 PolarHBondContact O-N 3.01Å; I80-N82 VanDerWaalsContact C-N 3.33Å; I80-N82 PolarHBondContact O-N 2.8Å
81K66Low72.4Confident149 Ų149110.9 Ų110.965%0.64859%0.594SS**  trans-50.4112.9156.7-68.4-178.5-177.8172.80103.7N79 T83N79-K81 PolarHBondContact O-N 2.95Å; K81-T83 HydrophobicContact CB-CG2 4.44Å; K81-T83 PolarHBondContact O-N 2.89Å
82N63.2Low70.3Confident104 Ų104117.6 Ų117.656%0.55662%0.619SS**  trans-64.780.6171.3-175.454.3000106.4I80 G84I80-N82 VanDerWaalsContact C-N 3.33Å; I80-N82 PolarHBondContact O-N 2.8Å; N82-G84 PolarHBondContact O-N 2.6Å
83T59.8Low68.1Low130 Ų130118 Ų11880%0.79864%0.638SS**  trans-69.67.5160.548.80000110.1K81K81-T83 HydrophobicContact CB-CG2 4.44Å; K81-T83 PolarHBondContact O-N 2.89Å
84G63.8Low66.1Low21 Ų21118.2 Ų118.222%0.21665%0.646CS.*SBendtrans-41.1143.8153.200000108.9N82 V86N82-G84 PolarHBondContact O-N 2.6Å; G84-V86 VanDerWaalsContact C-N 3.31Å; G84-V86 PolarHBondContact O-N 3.39Å
85P57.2Low64.1Low111 Ų111121.6 Ų121.672%0.72166%0.663SS**  trans-57.1100.5-164.424.1-33.3000108M87P85-M87 HydrophobicContact CB-CG 4.35Å; P85-M87 PolarHBondContact O-N 3.25Å
86V59.5Low62.3Low130 Ų130125.5 Ų125.579%0.78869%0.686SS**  trans-5983.3143.2-172.40000101.3G84 P88G84-V86 VanDerWaalsContact C-N 3.31Å; G84-V86 PolarHBondContact O-N 3.39Å; V86-P88 WeakPolarHBondContact O-CD 3.31Å
87M56.9Low60.3Low129 Ų129128 Ų12864%0.63570%0.699SS**  trans-45.9118.7170.1-82.3-74-82.100102.8P85 M89P85-M87 HydrophobicContact CB-CG 4.35Å; P85-M87 PolarHBondContact O-N 3.25Å; M87-M89 PolarHBondContact O-N 3.29Å
88P58Low58.3Low100 Ų100125 Ų12565%0.64970%0.698SS**  trans-6093.7170.922.2-29000105.4V86 M90 G91V86-P88 WeakPolarHBondContact O-CD 3.31Å; P88-M90 PolarHBondContact O-N 2.89Å; P88-G91 PolarHBondContact O-N 3.25Å
89M58Low56.3Low169 Ų169126.1 Ų126.183%0.83371%0.71SS**THydrogen-bonded Turntrans-61.98.5159.3-81.4-77.1125.100110.6M87M87-M89 PolarHBondContact O-N 3.29Å
90M56.8Low54.8Low184 Ų184128.3 Ų128.391%0.90672%0.716SS**THydrogen-bonded Turntrans-115.132.5-179.5-68.6-63-171.200112.2P88P88-M90 PolarHBondContact O-N 2.89Å
91G53.7Low53.3Low44 Ų44130.8 Ų130.845%0.45473%0.725SS.*SBendtrans-146.551.3-179.100000114.2P88P88-G91 PolarHBondContact O-N 3.25Å
92Q46.8Very low52.2Low196 Ų196129.7 Ų129.792%0.91673%0.734SS**SBendtrans16384.8144.8-88.8160.189.400112.4
93A44.5Very low51.4Low100 Ų100132.5 Ų132.583%0.82674%0.743SS**  trans-156.288.1138.500000107.5
94P48.5Very low50.7Low107 Ų107134 Ų13470%0.69574%0.741SS**  trans-74.1161.4163.432.5-30000108.9
95I49.8Very low49.8Very low163 Ų163142.1 Ų142.184%0.83677%0.773SS**  trans114.495.1163.5-55.7156.4000112.5
96N48.5Very low49.4Very low145 Ų145145 Ų14578%0.77578%0.778SS**  trans106.167.9133.6-154.853.3000116.6
97Q46.2Very low48.9Very low188 Ų188142.4 Ų142.488%0.87977%0.77SS**  trans-146.7147.3130.2-68.6-156.71.200111
98P43.9Very low48.6Very low116 Ų116141.8 Ų141.875%0.75378%0.775SS**  trans-74.7151.7-160.3-13.630.8000114.1E100P98-E100 PolarHBondContact O-N 3.16Å
99V46.3Very low48.3Very low140 Ų140142.4 Ų142.485%0.84878%0.777SS**  trans-60105.9173.3179.80000109.9
100E48Very low48.3Very low173 Ų173143.7 Ų143.781%0.80878%0.778SS**  trans-118.4130.4161.7-74.2-175.3170.100108.5P98P98-E100 PolarHBondContact O-N 3.16Å
101E43.2Very low48.5Very low147 Ų147139 Ų13969%0.68776%0.76SS**  trans34110-179.3-94.574.3-161.100121.2E103E101-E103 HydrophobicContact CB-CG 4.46Å; E101-E103 HydrophobicContact CG-CG 4.43Å; E101-E103 PolarHBondContact O-N 3.19Å
102P43.5Very low48.9Very low127 Ų127139.3 Ų139.383%0.82576%0.758SS**  trans-79.584.1158.432.1-28000110
103E47.2Very low50.2Low162 Ų162132.6 Ų132.676%0.75773%0.726SS**  trans-100.7116.2168.2-74.1-166156.500111.5E101E101-E103 HydrophobicContact CB-CG 4.46Å; E101-E103 HydrophobicContact CG-CG 4.43Å; E101-E103 PolarHBondContact O-N 3.19Å
104E44.5Very low51.9Low163 Ų163128.8 Ų128.876%0.76269%0.693SS**  trans7185.2156.9-69.2179152.200118.2Q106E104-Q106 PolarHBondContact O-N 3.27Å
105Q44.9Very low53.6Low190 Ų190123.7 Ų123.789%0.88866%0.66SS**  trans-36.983.8137.2-113.397.2-6.800111.8A107Q105-A107 PolarHBondContact O-N 3.37Å
106Q48.4Very low55.3Low173 Ų173118.5 Ų118.581%0.80863%0.632SS**  trans-72.191.4157.7-74.917930.500106.6E104E104-Q106 PolarHBondContact O-N 3.27Å
107A48.9Very low56.9Low75 Ų75111.6 Ų111.662%0.6260%0.595SS**  trans-46.4126.717000000108.2Q105 T109Q105-A107 PolarHBondContact O-N 3.37Å; A107-T109 PolarHBondContact O-N 3.27Å
108P52Low58.8Low116 Ų116105.1 Ų105.175%0.75357%0.568SS**  trans-61.6104.4-179.423.9-31.8000107.2K110P108-K110 VanDerWaalsContact C-N 3.31Å; P108-K110 PolarHBondContact O-N 3.13Å
109T51.4Low60.5Low113 Ų113106.5 Ų106.569%0.69356%0.562SS**  trans-58.7101.5171.552.80000105.6A107 T111A107-T109 PolarHBondContact O-N 3.27Å; T109-T111 PolarHBondContact O-N 3.44Å
110K56.7Low62.3Low195 Ų195102.5 Ų102.585%0.84853%0.533SS*.  trans-66.474.1170.3-69.4178.2177.8174.50107.3P108 A112P108-K110 VanDerWaalsContact C-N 3.31Å; P108-K110 PolarHBondContact O-N 3.13Å; K110-A112 PolarHBondContact O-N 3.22Å
111T61.6Low64Low86 Ų8698.1 Ų98.153%0.52852%0.515SS..  trans-84.825.8176.352.30000111.1T109 F113T109-T111 PolarHBondContact O-N 3.44Å; T111-F113 PolarHBondContact O-N 2.81Å
112A61.9Low65.7Low51 Ų5194.9 Ų94.942%0.42151%0.514SS..  trans-92.594.7176.800000107.7K110 D158K110-A112 PolarHBondContact O-N 3.22Å; A112-D158 WeakPolarHBondContact CB-OD1 3.27Å
113F74.9Confident67.6Low54 Ų5492.9 Ų92.924%0.23751%0.508CS..EExtended strand (participates in β ladder)trans-93.5134.5172.3-63.7-82.1000109.4T111 D158 V159 K161 A164 I180 E181T111-F113 PolarHBondContact O-N 2.81Å; F113-D158 PolarHBondContact O-N 2.89Å; F113-V159 HydrophobicContact CB-CG2 4.37Å; F113-V159 PolarHBondContact N-O 3.1Å; F113-V159 VanDerWaalsContact O-CG2 3.26Å; F113-V159 WeakPolarHBondContact O-CG2 3.19Å; F113-V159 PolarHBondContact O-N 3.31Å; F113-V159 VanDerWaalsContact O-N 3.13Å; F113-K161 HydrophobicContact CD2-CB 4.11Å; F113-K161 HydrophobicContact CE2-CB 3.63Å; F113-K161 HydrophobicContact CE2-CG 4.11Å; F113-K161 HydrophobicContact CZ-CB 4.24Å; F113-K161 HydrophobicContact CZ-CG 4.23Å; F113-A164 HydrophobicContact CB-CB 4.03Å; F113-I180 HydrophobicContact CB-CG2 3.85Å; F113-I180 HydrophobicContact CD1-CG2 3.62Å; F113-I180 HydrophobicContact CG-CG2 4.08Å; F113-E181 CarbonylContact C-O 3.59Å; F113-E181 VanDerWaalsContact CA-O 3.29Å; F113-E181 WeakPolarHBondContact CA-O 3.27Å
114S80.6Confident69.5Low20 Ų2088.8 Ų88.814%0.1449%0.488CS..EExtended strand (participates in β ladder)trans-104.9120.3171.1-168.30000109.7N154 E181S114-N154 PolarHBondContact OG-OD1 2.83Å; S114-E181 PolarHBondContact N-O 3.13Å; S114-E181 PolarHBondContact O-N 3.18Å
115V84.1Confident71.4Confident0 Ų083.5 Ų83.50%046%0.462CS..EExtended strand (participates in β ladder)trans-92109.3177.8-177.50000108.6I155 K156 V159 A164 I167 I178V115-I155 HydrophobicContact CG1-CD1 4.32Å; V115-I155 PolarHBondContact O-N 3.18Å; V115-K156 PolarHBondContact N-O 2.73Å; V115-V159 HydrophobicContact CG2-CG2 3.75Å; V115-A164 HydrophobicContact CG2-CB 3.8Å; V115-I167 HydrophobicContact CG1-CG2 3.88Å; V115-I178 HydrophobicContact CG1-CD1 4.39Å; V115-I178 HydrophobicContact CG1-CG2 3.55Å
116K84.1Confident73.5Confident55 Ų5580.5 Ų80.524%0.23945%0.451CS..EExtended strand (participates in β ladder)trans-103.9130.4178.3-71.4178.9-168.4173.40111.5V118 N154 I178 A179 E181K116-V118 PolarHBondContact O-N 2.94Å; K116-N154 WeakPolarHBondContact CE-OD1 3.3Å; K116-N154 WeakPolarHBondContact CG-OD1 3.16Å; K116-I178 WeakPolarHBondContact O-CA 3.37Å; K116-A179 PolarHBondContact N-O 3.11Å; K116-A179 PolarHBondContact O-N 2.93Å; K116-E181 WeakPolarHBondContact CE-OE2 3.44Å; K116-E181 IonicContact NZ-OE1 2.6Å; K116-E181 PolarHBondContact NZ-OE1 3.36Å; K116-E181 IonicContact NZ-OE2 2.62Å; K116-E181 PolarHBondContact NZ-OE2 3.3Å
117L82.5Confident75.5Confident0 Ų077.1 Ų77.10%044%0.435CS..EExtended strand (participates in β ladder)trans-75.5113.8164.1-176.461.1000108.3F120 L128 I132 A151 P152 A153 I155 A176L117-F120 HydrophobicContact CD1-CB 4.46Å; L117-F120 HydrophobicContact CD2-CD1 4.24Å; L117-L128 HydrophobicContact CD1-CD2 4.24Å; L117-L128 HydrophobicContact CD2-CD2 4.06Å; L117-I132 HydrophobicContact CD2-CD1 4.46Å; L117-A151 HydrophobicContact CD2-CB 4.12Å; L117-A151 HydrophobicContact CG-CB 4.26Å; L117-P152 CarbonylContact O-C 3.5Å; L117-P152 WeakPolarHBondContact O-CA 3.39Å; L117-A153 PolarHBondContact N-O 2.76Å; L117-A153 PolarHBondContact O-N 3.28Å; L117-A153 VanDerWaalsContact O-N 3.12Å; L117-I155 HydrophobicContact CB-CD1 3.94Å; L117-I155 HydrophobicContact CB-CG1 3.99Å; L117-A176 HydrophobicContact CD1-CB 3.56Å
118V85.6Confident77.4Confident51 Ų5173.6 Ų73.631%0.30941%0.406SS..EExtended strand (participates in β ladder)trans-93.9-49.9-177.7-176.70000110.9K116 S177 A179K116-V118 PolarHBondContact O-N 2.94Å; V118-S177 PolarHBondContact N-O 3.2Å; V118-A179 HydrophobicContact CG2-CB 3.49Å; V118-A179 VanDerWaalsContact CG2-CB 3.49Å
119K80.6Confident79.1Confident146 Ų14668.8 Ų68.864%0.63537%0.374SS*.EExtended strand (participates in β ladder)trans-144.9158.6178.1-70.9-176.6178.171.50109.3A176 S177K119-A176 CarbonylContact O-C 3.6Å; K119-S177 PolarHBondContact N-O 2.9Å; K119-S177 PolarHBondContact O-N 2.79Å
120F83.8Confident81Confident55 Ų5569.6 Ų69.624%0.24137%0.368CS..EExtended strand (participates in β ladder)trans-145.9153.2170.963.2-83.1000109.8L117 K125 L128 V148 A151L117-F120 HydrophobicContact CD1-CB 4.46Å; L117-F120 HydrophobicContact CD2-CD1 4.24Å; F120-K125 HydrophobicContact CD2-CB 4.41Å; F120-K125 HydrophobicContact CE2-CB 4.26Å; F120-K125 HydrophobicContact CE2-CD 4.13Å; F120-K125 HydrophobicContact CE2-CG 4.09Å; F120-L128 HydrophobicContact CB-CD2 3.34Å; F120-L128 HydrophobicContact CD1-CD2 4.35Å; F120-L128 HydrophobicContact CD2-CD2 4.12Å; F120-L128 HydrophobicContact CG-CD2 3.69Å; F120-V148 HydrophobicContact CD1-CG1 4.03Å; F120-V148 HydrophobicContact CD2-CG1 3.92Å; F120-V148 HydrophobicContact CE1-CG1 3.81Å; F120-V148 WeakPolarHBondContact CE1-O 3.35Å; F120-V148 HydrophobicContact CE2-CG1 3.69Å; F120-V148 HydrophobicContact CG-CG1 4.1Å; F120-V148 HydrophobicContact CZ-CG1 3.63Å; F120-V148 WeakPolarHBondContact CZ-O 3.21Å; F120-A151 HydrophobicContact CD1-CB 3.92Å; F120-A151 HydrophobicContact CE1-CB 3.73Å
121D83.5Confident82.5Confident81 Ų8162 Ų6243%0.43334%0.335SS..  trans-77.8127.8171.7-171.5-11.9000110.7A123 K124 K125 G175D121-A123 PolarHBondContact O-N 2.92Å; D121-A123 WeakPolarHBondContact OD1-CB 3.49Å; D121-A123 PolarHBondContact OD1-N 2.99Å; D121-K124 PolarHBondContact O-N 2.99Å; D121-K124 VanDerWaalsContact O-N 3.13Å; D121-K125 PolarHBondContact O-N 2.91Å; D121-K125 VanDerWaalsContact O-N 3.16Å; D121-G175 PolarHBondContact N-O 2.87Å
122A79.8Confident83.8Confident79 Ų7958 Ų5865%0.65331%0.31SS*.G310 helixtrans-58.8-31.5176.100000112.5K124 K125A122-K124 VanDerWaalsContact C-N 3.3Å; A122-K124 PolarHBondContact O-N 2.87Å; A122-K125 WeakPolarHBondContact O-CB 3.45Å; A122-K125 PolarHBondContact O-N 3.17Å
123A83.6Confident85.1Confident85 Ų8559.5 Ų59.570%0.70231%0.307SS*.G310 helixtrans-66-33.2177.800000112.5D121D121-A123 PolarHBondContact O-N 2.92Å; D121-A123 WeakPolarHBondContact OD1-CB 3.49Å; D121-A123 PolarHBondContact OD1-N 2.99Å
124K86Confident85.8Confident76 Ų7663.5 Ų63.533%0.3333%0.327SS..G310 helixtrans-100.77.2-178.9-59.3-172.3-178.9-179.70113.6D121 A122 I126 Q127 L128 E173 V174D121-K124 PolarHBondContact O-N 2.99Å; D121-K124 VanDerWaalsContact O-N 3.13Å; A122-K124 VanDerWaalsContact C-N 3.3Å; A122-K124 PolarHBondContact O-N 2.87Å; K124-I126 PolarHBondContact O-N 3.4Å; K124-I126 VanDerWaalsContact O-N 3.12Å; K124-Q127 WeakPolarHBondContact O-CB 3.5Å; K124-Q127 PolarHBondContact O-N 3.39Å; K124-L128 PolarHBondContact O-N 3.05Å; K124-E173 PolarHBondContact NZ-O 3.4Å; K124-V174 HydrophobicContact CB-CG1 4.43Å; K124-V174 WeakPolarHBondContact CB-O 3.4Å; K124-V174 WeakPolarHBondContact CD-O 3.45Å
125K84.2Confident86Confident53 Ų5363.4 Ų63.423%0.2333%0.326CS..Hα-helixtrans-50.9-39.5179-177.9178.6177.5-179.60113.7F120 D121 A122 L128 I129 V148 E149F120-K125 HydrophobicContact CD2-CB 4.41Å; F120-K125 HydrophobicContact CE2-CB 4.26Å; F120-K125 HydrophobicContact CE2-CD 4.13Å; F120-K125 HydrophobicContact CE2-CG 4.09Å; D121-K125 PolarHBondContact O-N 2.91Å; D121-K125 VanDerWaalsContact O-N 3.16Å; A122-K125 WeakPolarHBondContact O-CB 3.45Å; A122-K125 PolarHBondContact O-N 3.17Å; K125-L128 PolarHBondContact O-N 2.64Å; K125-I129 HydrophobicContact CG-CD1 3.93Å; K125-I129 WeakPolarHBondContact O-CD1 3.4Å; K125-I129 VanDerWaalsContact O-CG1 3.24Å; K125-I129 WeakPolarHBondContact O-CG1 3.13Å; K125-I129 PolarHBondContact O-N 2.92Å; K125-V148 HydrophobicContact CG-CG1 4.13Å; K125-E149 IonicContact NZ-OE1 3.94Å; K125-E149 PolarHBondContact NZ-OE1 3.07Å
126I89.1Confident86.1Confident126 Ų12664.9 Ų64.965%0.64633%0.333SS*.Hα-helixtrans-65.7-40.8179.5-60.9175.9000111.2K124 K130K124-I126 PolarHBondContact O-N 3.4Å; K124-I126 VanDerWaalsContact O-N 3.12Å; I126-K130 WeakPolarHBondContact O-CG 3.46Å; I126-K130 PolarHBondContact O-N 3.09Å
127Q90.2Very high86.2Confident102 Ų10267 Ų6748%0.47735%0.352SS..Hα-helixtrans-67.5-42.6175.9-66.4173.21000109.8K124 I129 K130 E131 V174K124-Q127 WeakPolarHBondContact O-CB 3.5Å; K124-Q127 PolarHBondContact O-N 3.39Å; Q127-I129 VanDerWaalsContact C-N 3.32Å; Q127-I129 PolarHBondContact O-N 2.89Å; Q127-K130 WeakPolarHBondContact O-CA 3.22Å; Q127-K130 WeakPolarHBondContact O-CB 3.42Å; Q127-K130 PolarHBondContact O-N 2.99Å; Q127-E131 PolarHBondContact O-N 3.36Å; Q127-E131 VanDerWaalsContact O-N 3.07Å; Q127-V174 HydrophobicContact CB-CG1 3.37Å; Q127-V174 HydrophobicContact CB-CG2 4.41Å
128L88.9Confident86.4Confident2 Ų275.2 Ų75.21%0.0139%0.391CS..Hα-helixtrans-60.3-40.7178.9-176.759.1000112.6L117 F120 K124 K125 K130 E131 I132 V148 L171 V174 A176L117-L128 HydrophobicContact CD1-CD2 4.24Å; L117-L128 HydrophobicContact CD2-CD2 4.06Å; F120-L128 HydrophobicContact CB-CD2 3.34Å; F120-L128 HydrophobicContact CD1-CD2 4.35Å; F120-L128 HydrophobicContact CD2-CD2 4.12Å; F120-L128 HydrophobicContact CG-CD2 3.69Å; K124-L128 PolarHBondContact O-N 3.05Å; K125-L128 PolarHBondContact O-N 2.64Å; L128-K130 VanDerWaalsContact C-N 3.28Å; L128-K130 PolarHBondContact O-N 2.91Å; L128-E131 PolarHBondContact O-N 2.62Å; L128-I132 HydrophobicContact CD1-CD1 4.05Å; L128-I132 HydrophobicContact CD1-CG1 4.4Å; L128-I132 HydrophobicContact CG-CD1 3.86Å; L128-I132 WeakPolarHBondContact O-CG1 3.39Å; L128-I132 PolarHBondContact O-N 3.34Å; L128-V148 HydrophobicContact CD2-CG1 3.8Å; L128-V148 HydrophobicContact CD2-CG2 4.29Å; L128-V148 HydrophobicContact CG-CG1 4.46Å; L128-V148 HydrophobicContact CG-CG2 4.23Å; L128-L171 HydrophobicContact CD1-CD2 3.46Å; L128-L171 VanDerWaalsContact CD1-CD2 3.46Å; L128-V174 HydrophobicContact CB-CG1 4.03Å; L128-V174 VanDerWaalsContact N-CG1 3.26Å; L128-A176 HydrophobicContact CD1-CB 3.8Å; L128-A176 HydrophobicContact CD2-CB 4.27Å
129I89.2Confident86.3Confident14 Ų1474.7 Ų74.77%0.07239%0.385CS..Hα-helixtrans-63.6-34.6175.5-67.5159.5000111.3K125 Q127 K133 L141 A144 K145 V148K125-I129 HydrophobicContact CG-CD1 3.93Å; K125-I129 WeakPolarHBondContact O-CD1 3.4Å; K125-I129 VanDerWaalsContact O-CG1 3.24Å; K125-I129 WeakPolarHBondContact O-CG1 3.13Å; K125-I129 PolarHBondContact O-N 2.92Å; Q127-I129 VanDerWaalsContact C-N 3.32Å; Q127-I129 PolarHBondContact O-N 2.89Å; I129-K133 WeakPolarHBondContact O-CG 3.3Å; I129-K133 PolarHBondContact O-N 3.4Å; I129-K133 VanDerWaalsContact O-N 3.16Å; I129-L141 HydrophobicContact CG2-CD1 4.01Å; I129-A144 HydrophobicContact CG2-CB 4.03Å; I129-K145 HydrophobicContact CD1-CG 3.77Å; I129-V148 HydrophobicContact CG1-CB 4.35Å; I129-V148 HydrophobicContact CG1-CG2 3.89Å
130K89.3Confident86.7Confident130 Ų13072.9 Ų72.957%0.56538%0.383SS*.Hα-helixtrans-65.9-46175.7-70177.4179.5-176.60110.8I126 Q127 L128 K133 Q134I126-K130 WeakPolarHBondContact O-CG 3.46Å; I126-K130 PolarHBondContact O-N 3.09Å; Q127-K130 WeakPolarHBondContact O-CA 3.22Å; Q127-K130 WeakPolarHBondContact O-CB 3.42Å; Q127-K130 PolarHBondContact O-N 2.99Å; L128-K130 VanDerWaalsContact C-N 3.28Å; L128-K130 PolarHBondContact O-N 2.91Å; K130-K133 PolarHBondContact O-N 2.94Å; K130-Q134 WeakPolarHBondContact O-CG 3.01Å; K130-Q134 PolarHBondContact O-N 3.5Å
131E89.4Confident86.9Confident37 Ų3773.7 Ų73.717%0.17339%0.389CS..Hα-helixtrans-64.4-43.7177.7-60.5-45.313200112.2Q127 L128 K133 Q134 V135 V170 L171 V174Q127-E131 PolarHBondContact O-N 3.36Å; Q127-E131 VanDerWaalsContact O-N 3.07Å; L128-E131 PolarHBondContact O-N 2.62Å; E131-K133 VanDerWaalsContact C-N 3.26Å; E131-K133 PolarHBondContact O-N 3.27Å; E131-Q134 WeakPolarHBondContact O-CA 3.45Å; E131-Q134 WeakPolarHBondContact O-CB 3.29Å; E131-Q134 PolarHBondContact O-N 3.12Å; E131-Q134 PolarHBondContact OE2-OE1 2.88Å; E131-V135 WeakPolarHBondContact O-CG2 3.01Å; E131-V135 PolarHBondContact O-N 3.03Å; E131-V170 HydrophobicContact CB-CG1 4.32Å; E131-V170 HydrophobicContact CG-CG1 3.94Å; E131-V170 WeakPolarHBondContact OE2-CG1 3.03Å; E131-L171 HydrophobicContact CB-CD2 3.49Å; E131-L171 VanDerWaalsContact CB-CD2 3.49Å; E131-L171 HydrophobicContact CG-CD2 4.35Å; E131-V174 HydrophobicContact CG-CB 4.49Å; E131-V174 HydrophobicContact CG-CG2 3.73Å
132I88.7Confident87.1Confident0 Ų074.1 Ų74.10%039%0.394CS..Hα-helixtrans-61.9-35178-73.7165.4000111.8L117 L128 Q134 V135 I136 F147 V148 L171L117-I132 HydrophobicContact CD2-CD1 4.46Å; L128-I132 HydrophobicContact CD1-CD1 4.05Å; L128-I132 HydrophobicContact CD1-CG1 4.4Å; L128-I132 HydrophobicContact CG-CD1 3.86Å; L128-I132 WeakPolarHBondContact O-CG1 3.39Å; L128-I132 PolarHBondContact O-N 3.34Å; I132-Q134 VanDerWaalsContact C-N 3.3Å; I132-Q134 PolarHBondContact O-N 3.21Å; I132-V135 PolarHBondContact O-N 3.38Å; I132-I136 PolarHBondContact O-N 3.38Å; I132-F147 HydrophobicContact CD1-CD1 4.2Å; I132-F147 HydrophobicContact CD1-CE1 4.31Å; I132-F147 HydrophobicContact CG2-CD1 4.17Å; I132-V148 HydrophobicContact CD1-CG2 3.21Å; I132-L171 HydrophobicContact CG1-CD2 4.27Å
133K89.6Confident87.6Confident83 Ų8375.5 Ų75.536%0.36139%0.387SS..Hα-helixtrans-68.4-27.1173-75.5-175.470.3-175.80113.4I129 K130 E131 P137 L141 A144I129-K133 WeakPolarHBondContact O-CG 3.3Å; I129-K133 PolarHBondContact O-N 3.4Å; I129-K133 VanDerWaalsContact O-N 3.16Å; K130-K133 PolarHBondContact O-N 2.94Å; E131-K133 VanDerWaalsContact C-N 3.26Å; E131-K133 PolarHBondContact O-N 3.27Å; K133-P137 WeakPolarHBondContact O-CA 3.19Å; K133-L141 HydrophobicContact CD-CD1 4.12Å; K133-A144 HydrophobicContact CG-CB 3.93Å
134Q88.2Confident87.8Confident138 Ų13871.4 Ų71.465%0.64535%0.354SS*.Hα-helixtrans-77-39.8173-65.6179.919.400111K130 E131 I132K130-Q134 WeakPolarHBondContact O-CG 3.01Å; K130-Q134 PolarHBondContact O-N 3.5Å; E131-Q134 WeakPolarHBondContact O-CA 3.45Å; E131-Q134 WeakPolarHBondContact O-CB 3.29Å; E131-Q134 PolarHBondContact O-N 3.12Å; E131-Q134 PolarHBondContact OE2-OE1 2.88Å; I132-Q134 VanDerWaalsContact C-N 3.3Å; I132-Q134 PolarHBondContact O-N 3.21Å
135V86.3Confident87.9Confident19 Ų1972.5 Ų72.512%0.11536%0.359CS..Hα-helixtrans-69.9-42.1178.7176.80000111.3E131 I132 I155 K156 I167E131-V135 WeakPolarHBondContact O-CG2 3.01Å; E131-V135 PolarHBondContact O-N 3.03Å; I132-V135 PolarHBondContact O-N 3.38Å; V135-I155 HydrophobicContact CG1-CG2 3.87Å; V135-K156 HydrophobicContact CG1-CD 3.91Å; V135-K156 HydrophobicContact CG1-CG 4.09Å; V135-K156 WeakPolarHBondContact O-CE 3.41Å; V135-K156 PolarHBondContact O-NZ 3.27Å; V135-I167 HydrophobicContact CG1-CD1 3.96Å; V135-I167 HydrophobicContact CG1-CG1 4.22Å; V135-I167 HydrophobicContact CG1-CG2 4.35Å; V135-I167 HydrophobicContact CG2-CG1 4.35Å; V135-I167 HydrophobicContact CG2-CG2 4.39Å
136I86.5Confident88.2Confident31 Ų3176.8 Ų76.816%0.15938%0.377CS..  trans-126.380.4-178.8-42.3172.4000109.7I132 E138 M139 I155 K156I132-I136 PolarHBondContact O-N 3.38Å; I136-E138 HydrophobicContact CG2-CB 4.45Å; I136-E138 PolarHBondContact O-N 2.92Å; I136-E138 VanDerWaalsContact O-N 3.16Å; I136-M139 HydrophobicContact CB-CG 4.3Å; I136-M139 HydrophobicContact CB-SD 4.34Å; I136-M139 HydrophobicContact CD1-SD 4.02Å; I136-M139 HydrophobicContact CG2-CG 3.78Å; I136-M139 HydrophobicContact CG2-SD 4.15Å; I136-M139 PolarHBondContact O-N 3.17Å; I136-I155 HydrophobicContact CD1-CG2 3.94Å; I136-I155 WeakPolarHBondContact CD1-O 3.16Å; I136-I155 HydrophobicContact CG1-CG2 4.33Å; I136-K156 HydrophobicContact CG1-CG 4.45Å
137P85.6Confident88.1Confident99 Ų9972.2 Ų72.264%0.64335%0.353SS*.THydrogen-bonded Turntrans-65.9-17.9-17726.3-34.7000113.9K133 M139K133-P137 WeakPolarHBondContact O-CA 3.19Å; P137-M139 PolarHBondContact O-N 3.08Å
138E86.2Confident87.9Confident173 Ų17367.4 Ų67.481%0.80833%0.33SS*.THydrogen-bonded Turntrans-66-16.5176.2-58.8-64.5160.100112.9I136I136-E138 HydrophobicContact CG2-CB 4.45Å; I136-E138 PolarHBondContact O-N 2.92Å; I136-E138 VanDerWaalsContact O-N 3.16Å
139M84.1Confident87.9Confident39 Ų3972.9 Ų72.919%0.19236%0.356CS..SBendtrans-91.1128.3178.9-61.5-173.688.800112.4I136 P137 Q143 F147I136-M139 HydrophobicContact CB-CG 4.3Å; I136-M139 HydrophobicContact CB-SD 4.34Å; I136-M139 HydrophobicContact CD1-SD 4.02Å; I136-M139 HydrophobicContact CG2-CG 3.78Å; I136-M139 HydrophobicContact CG2-SD 4.15Å; I136-M139 PolarHBondContact O-N 3.17Å; P137-M139 PolarHBondContact O-N 3.08Å; M139-Q143 HydrophobicContact CB-CB 4.37Å; M139-Q143 HydrophobicContact CE-CB 4.04Å; M139-F147 HydrophobicContact CE-CB 3.68Å; M139-F147 HydrophobicContact CE-CD2 3.92Å; M139-F147 HydrophobicContact CE-CG 3.92Å; M139-F147 HydrophobicContact SD-CD2 4.49Å; M139-F147 HydrophobicContact SD-CG 4.37Å
140N89Confident87.8Confident108 Ų10875.4 Ų75.458%0.57838%0.375SS*.  trans-72.6158.7171.5-167.1-14.3000111V142 Q143 A144N140-V142 PolarHBondContact O-N 3.49Å; N140-Q143 CarbonylContact O-C 3.47Å; N140-Q143 WeakPolarHBondContact O-CA 3.48Å; N140-Q143 PolarHBondContact O-N 3.03Å; N140-A144 PolarHBondContact O-N 2.91Å
141L87.2Confident87.3Confident73 Ų7370.6 Ų70.638%0.38236%0.359SS..Hα-helixtrans-48.8-36.3176.9-175.567.2000113.4I129 K133 K145I129-L141 HydrophobicContact CG2-CD1 4.01Å; K133-L141 HydrophobicContact CD-CD1 4.12Å; L141-K145 VanDerWaalsContact O-CG 3.27Å; L141-K145 WeakPolarHBondContact O-CG 3.42Å; L141-K145 PolarHBondContact O-N 3.28Å; L141-K145 VanDerWaalsContact O-N 3.15Å
142V88.5Confident87.1Confident89 Ų8974 Ų7454%0.53938%0.384SS..Hα-helixtrans-70.1-41177-178.90000111.4N140 K146N140-V142 PolarHBondContact O-N 3.49Å; V142-K146 WeakPolarHBondContact O-CG 3.42Å; V142-K146 PolarHBondContact O-N 2.99Å
143Q89.7Confident86.9Confident108 Ų10874.7 Ų74.751%0.50539%0.39SS..Hα-helixtrans-71.4-40.9177.6-69.8-178.7-34.800111.4M139 N140 K145 K146 F147M139-Q143 HydrophobicContact CB-CB 4.37Å; M139-Q143 HydrophobicContact CE-CB 4.04Å; N140-Q143 CarbonylContact O-C 3.47Å; N140-Q143 WeakPolarHBondContact O-CA 3.48Å; N140-Q143 PolarHBondContact O-N 3.03Å; Q143-K145 VanDerWaalsContact C-N 3.33Å; Q143-K145 PolarHBondContact O-N 3.2Å; Q143-K146 PolarHBondContact O-N 3.39Å; Q143-F147 VanDerWaalsContact O-CB 3.3Å; Q143-F147 WeakPolarHBondContact O-CB 3.32Å; Q143-F147 PolarHBondContact O-N 3.3Å
144A87.6Confident86.8Confident0 Ų074.4 Ų74.40%039%0.392CS..Hα-helixtrans-61.4-40.3176.900000112.2I129 K133 N140 F147 V148I129-A144 HydrophobicContact CG2-CB 4.03Å; K133-A144 HydrophobicContact CG-CB 3.93Å; N140-A144 PolarHBondContact O-N 2.91Å; A144-F147 PolarHBondContact O-N 3.36Å; A144-V148 WeakPolarHBondContact O-CG2 3.34Å; A144-V148 PolarHBondContact O-N 3.22Å
145K88.2Confident86.6Confident99 Ų9968.2 Ų68.243%0.4336%0.364SS..Hα-helixtrans-59.7-48.3173.4-78.3173.6179.7-171.50112I129 L141 Q143 F147 E149I129-K145 HydrophobicContact CD1-CG 3.77Å; L141-K145 VanDerWaalsContact O-CG 3.27Å; L141-K145 WeakPolarHBondContact O-CG 3.42Å; L141-K145 PolarHBondContact O-N 3.28Å; L141-K145 VanDerWaalsContact O-N 3.15Å; Q143-K145 VanDerWaalsContact C-N 3.33Å; Q143-K145 PolarHBondContact O-N 3.2Å; K145-F147 VanDerWaalsContact C-N 3.33Å; K145-F147 PolarHBondContact O-N 2.9Å; K145-E149 VanDerWaalsContact O-CG 3.31Å; K145-E149 WeakPolarHBondContact O-CG 3.45Å; K145-E149 PolarHBondContact O-N 2.67Å; K145-E149 VanDerWaalsContact O-N 3.14Å
146K90.6Very high86.3Confident142 Ų14270.6 Ų70.662%0.61737%0.372SS*.Hα-helixtrans-63.7-38.8177.3-71.2-177176.1-173.60112.2V142 Q143 E149 S150V142-K146 WeakPolarHBondContact O-CG 3.42Å; V142-K146 PolarHBondContact O-N 2.99Å; Q143-K146 PolarHBondContact O-N 3.39Å; K146-E149 PolarHBondContact O-N 2.69Å; K146-S150 WeakPolarHBondContact O-CB 2.91Å; K146-S150 PolarHBondContact O-N 3.13Å; K146-S150 PolarHBondContact O-OG 3.48Å
147F87.1Confident86Confident31 Ų3173.1 Ų73.114%0.13639%0.389CS..Hα-helixtrans-64.6-46.6-179.6179.9-92.7000112.1I132 M139 Q143 A144 K145 E149 S150 A153 N154 I155I132-F147 HydrophobicContact CD1-CD1 4.2Å; I132-F147 HydrophobicContact CD1-CE1 4.31Å; I132-F147 HydrophobicContact CG2-CD1 4.17Å; M139-F147 HydrophobicContact CE-CB 3.68Å; M139-F147 HydrophobicContact CE-CD2 3.92Å; M139-F147 HydrophobicContact CE-CG 3.92Å; M139-F147 HydrophobicContact SD-CD2 4.49Å; M139-F147 HydrophobicContact SD-CG 4.37Å; Q143-F147 VanDerWaalsContact O-CB 3.3Å; Q143-F147 WeakPolarHBondContact O-CB 3.32Å; Q143-F147 PolarHBondContact O-N 3.3Å; A144-F147 PolarHBondContact O-N 3.36Å; K145-F147 VanDerWaalsContact C-N 3.33Å; K145-F147 PolarHBondContact O-N 2.9Å; F147-E149 VanDerWaalsContact C-N 3.34Å; F147-E149 PolarHBondContact O-N 2.65Å; F147-S150 WeakPolarHBondContact CA-OG 3.26Å; F147-S150 PolarHBondContact O-N 3.42Å; F147-S150 VanDerWaalsContact O-N 3.14Å; F147-S150 PolarHBondContact O-OG 3.46Å; F147-A153 HydrophobicContact CD2-CB 4.3Å; F147-A153 HydrophobicContact CE1-CB 4.28Å; F147-A153 HydrophobicContact CE2-CB 3.69Å; F147-A153 HydrophobicContact CZ-CB 3.66Å; F147-N154 WeakPolarHBondContact CE2-O 3.38Å; F147-N154 WeakPolarHBondContact CZ-O 3.34Å; F147-I155 HydrophobicContact CE1-CG1 4.19Å; F147-I155 HydrophobicContact CZ-CG1 4.31Å
148V87Confident85.7Confident0 Ų073.9 Ų73.90%039%0.388CS..Hα-helixtrans-62.5-42.2174.8173.90000111.3F120 K125 L128 I129 I132 A144 S150 A151F120-V148 HydrophobicContact CD1-CG1 4.03Å; F120-V148 HydrophobicContact CD2-CG1 3.92Å; F120-V148 HydrophobicContact CE1-CG1 3.81Å; F120-V148 WeakPolarHBondContact CE1-O 3.35Å; F120-V148 HydrophobicContact CE2-CG1 3.69Å; F120-V148 HydrophobicContact CG-CG1 4.1Å; F120-V148 HydrophobicContact CZ-CG1 3.63Å; F120-V148 WeakPolarHBondContact CZ-O 3.21Å; K125-V148 HydrophobicContact CG-CG1 4.13Å; L128-V148 HydrophobicContact CD2-CG1 3.8Å; L128-V148 HydrophobicContact CD2-CG2 4.29Å; L128-V148 HydrophobicContact CG-CG1 4.46Å; L128-V148 HydrophobicContact CG-CG2 4.23Å; I129-V148 HydrophobicContact CG1-CB 4.35Å; I129-V148 HydrophobicContact CG1-CG2 3.89Å; I132-V148 HydrophobicContact CD1-CG2 3.21Å; A144-V148 WeakPolarHBondContact O-CG2 3.34Å; A144-V148 PolarHBondContact O-N 3.22Å; V148-S150 PolarHBondContact O-N 2.86Å; V148-A151 WeakPolarHBondContact O-CB 3Å; V148-A151 PolarHBondContact O-N 3.43Å
149E87.2Confident85.4Confident118 Ų11866 Ų6655%0.55135%0.352SS*.Hα-helixtrans-66.8-23.1176.3-71.1170-173.700113.4K125 K145 K146 F147 A151K125-E149 IonicContact NZ-OE1 3.94Å; K125-E149 PolarHBondContact NZ-OE1 3.07Å; K145-E149 VanDerWaalsContact O-CG 3.31Å; K145-E149 WeakPolarHBondContact O-CG 3.45Å; K145-E149 PolarHBondContact O-N 2.67Å; K145-E149 VanDerWaalsContact O-N 3.14Å; K146-E149 PolarHBondContact O-N 2.69Å; F147-E149 VanDerWaalsContact C-N 3.34Å; F147-E149 PolarHBondContact O-N 2.65Å; E149-A151 PolarHBondContact O-N 2.73Å
150S86.9Confident85.5Confident67 Ų6766.4 Ų66.447%0.46936%0.358SS..THydrogen-bonded Turntrans-83.99.7176.371.50000114.2K146 F147 V148K146-S150 WeakPolarHBondContact O-CB 2.91Å; K146-S150 PolarHBondContact O-N 3.13Å; K146-S150 PolarHBondContact O-OG 3.48Å; F147-S150 WeakPolarHBondContact CA-OG 3.26Å; F147-S150 PolarHBondContact O-N 3.42Å; F147-S150 VanDerWaalsContact O-N 3.14Å; F147-S150 PolarHBondContact O-OG 3.46Å; V148-S150 PolarHBondContact O-N 2.86Å
151A80.3Confident85.1Confident29 Ų2966.9 Ų66.924%0.2436%0.355CS..  trans-56.4137.417700000111.1L117 F120 V148 E149L117-A151 HydrophobicContact CD2-CB 4.12Å; L117-A151 HydrophobicContact CG-CB 4.26Å; F120-A151 HydrophobicContact CD1-CB 3.92Å; F120-A151 HydrophobicContact CE1-CB 3.73Å; V148-A151 WeakPolarHBondContact O-CB 3Å; V148-A151 PolarHBondContact O-N 3.43Å; E149-A151 PolarHBondContact O-N 2.73Å
152P84.9Confident85.1Confident108 Ų10868.7 Ų68.770%0.70137%0.365SS*.SBendcis-80.2130.79.130.1-33.8000114.5L117L117-P152 CarbonylContact O-C 3.5Å; L117-P152 WeakPolarHBondContact O-CA 3.39Å
153A85Confident84.9Confident14 Ų1468.7 Ų68.712%0.11636%0.359CS..EExtended strand (participates in β ladder)trans-140.8144.6-174.900000112.7L117 F147 I155L117-A153 PolarHBondContact N-O 2.76Å; L117-A153 PolarHBondContact O-N 3.28Å; L117-A153 VanDerWaalsContact O-N 3.12Å; F147-A153 HydrophobicContact CD2-CB 4.3Å; F147-A153 HydrophobicContact CE1-CB 4.28Å; F147-A153 HydrophobicContact CE2-CB 3.69Å; F147-A153 HydrophobicContact CZ-CB 3.66Å; A153-I155 PolarHBondContact O-N 3Å
154N87.2Confident84.7Confident77 Ų7763.6 Ų63.641%0.41234%0.336SS..EExtended strand (participates in β ladder)trans-75.7118.9176.1-66.6-76.3000110.2S114 K116 F147 T157S114-N154 PolarHBondContact OG-OD1 2.83Å; K116-N154 WeakPolarHBondContact CE-OD1 3.3Å; K116-N154 WeakPolarHBondContact CG-OD1 3.16Å; F147-N154 WeakPolarHBondContact CE2-O 3.38Å; F147-N154 WeakPolarHBondContact CZ-O 3.34Å; N154-T157 HydrophobicContact CB-CG2 4.31Å
155I83.3Confident84.7Confident8 Ų867.1 Ų67.14%0.04135%0.353CS..EExtended strand (participates in β ladder)trans-79.1-53.5179.3-50.8-177.9000109.8V115 L117 V135 I136 F147 A153 L171 I178V115-I155 HydrophobicContact CG1-CD1 4.32Å; V115-I155 PolarHBondContact O-N 3.18Å; L117-I155 HydrophobicContact CB-CD1 3.94Å; L117-I155 HydrophobicContact CB-CG1 3.99Å; V135-I155 HydrophobicContact CG1-CG2 3.87Å; I136-I155 HydrophobicContact CD1-CG2 3.94Å; I136-I155 WeakPolarHBondContact CD1-O 3.16Å; I136-I155 HydrophobicContact CG1-CG2 4.33Å; F147-I155 HydrophobicContact CE1-CG1 4.19Å; F147-I155 HydrophobicContact CZ-CG1 4.31Å; A153-I155 PolarHBondContact O-N 3Å; I155-L171 HydrophobicContact CD1-CD1 3.32Å; I155-I178 HydrophobicContact CD1-CD1 4.47Å
156K79.5Confident84.7Confident69 Ų6968.3 Ų68.330%0.336%0.36SS..EExtended strand (participates in β ladder)trans-141.7138.3173.5-74.4-166.9172.4172.50109.9V115 V135 I136 V159 I167V115-K156 PolarHBondContact N-O 2.73Å; V135-K156 HydrophobicContact CG1-CD 3.91Å; V135-K156 HydrophobicContact CG1-CG 4.09Å; V135-K156 WeakPolarHBondContact O-CE 3.41Å; V135-K156 PolarHBondContact O-NZ 3.27Å; I136-K156 HydrophobicContact CG1-CG 4.45Å; K156-V159 HydrophobicContact CB-CG1 3.64Å; K156-V159 HydrophobicContact CD-CG1 3.8Å; K156-V159 HydrophobicContact CG-CG1 4.37Å; K156-I167 HydrophobicContact CD-CD1 3.92Å
157T81.1Confident84.6Confident84 Ų8462.3 Ų62.352%0.51533%0.334SS..EExtended strand (participates in β ladder)trans-105.1153.8171.562.50000109N154 V159N154-T157 HydrophobicContact CB-CG2 4.31Å; T157-V159 VanDerWaalsContact C-N 3.33Å; T157-V159 PolarHBondContact O-N 3.38Å
158D78.7Confident84.6Confident115 Ų11564.2 Ų64.262%0.61534%0.342SS*.EExtended strand (participates in β ladder)trans59.138175.9-55.2-72.2000114.3A112 F113A112-D158 WeakPolarHBondContact CB-OD1 3.27Å; F113-D158 PolarHBondContact O-N 2.89Å
159V80.4Confident84.7Confident7 Ų770 Ų704%0.04237%0.368CS..EExtended strand (participates in β ladder)trans-89.8150.1173.6-71.20000111.2F113 V115 K156 T157 E163 A164F113-V159 HydrophobicContact CB-CG2 4.37Å; F113-V159 PolarHBondContact N-O 3.1Å; F113-V159 VanDerWaalsContact O-CG2 3.26Å; F113-V159 WeakPolarHBondContact O-CG2 3.19Å; F113-V159 PolarHBondContact O-N 3.31Å; F113-V159 VanDerWaalsContact O-N 3.13Å; V115-V159 HydrophobicContact CG2-CG2 3.75Å; K156-V159 HydrophobicContact CB-CG1 3.64Å; K156-V159 HydrophobicContact CD-CG1 3.8Å; K156-V159 HydrophobicContact CG-CG1 4.37Å; T157-V159 VanDerWaalsContact C-N 3.33Å; T157-V159 PolarHBondContact O-N 3.38Å; V159-E163 HydrophobicContact CB-CB 4.16Å; V159-A164 HydrophobicContact CG2-CB 3.83Å
160S86.3Confident84.8Confident48 Ų4867 Ų6734%0.33636%0.357SS..  trans-63.5157.7172.2650000110.7D162 E163 A164S160-D162 PolarHBondContact O-N 3.27Å; S160-E163 PolarHBondContact O-N 3.43Å; S160-E163 WeakPolarHBondContact OG-CB 3.32Å; S160-E163 WeakPolarHBondContact OG-CG 3.43Å; S160-E163 PolarHBondContact OG-N 3.21Å; S160-A164 WeakPolarHBondContact O-CB 3.3Å; S160-A164 PolarHBondContact O-N 2.75Å
161K81.3Confident84.8Confident118 Ų11863.8 Ų63.851%0.51334%0.335SS..Hα-helixtrans-56-42179.3-170.4-179.6172.5-1730111.8F113 A164 E165F113-K161 HydrophobicContact CD2-CB 4.11Å; F113-K161 HydrophobicContact CE2-CB 3.63Å; F113-K161 HydrophobicContact CE2-CG 4.11Å; F113-K161 HydrophobicContact CZ-CB 4.24Å; F113-K161 HydrophobicContact CZ-CG 4.23Å; K161-A164 PolarHBondContact O-N 3.36Å; K161-E165 WeakPolarHBondContact CE-OE1 3.32Å; K161-E165 WeakPolarHBondContact O-CG 3.06Å; K161-E165 PolarHBondContact O-N 3.39Å
162D86.6Confident85.2Confident111 Ų11166.3 Ų66.359%0.59434%0.341SS*.Hα-helixtrans-66.5-43-178.9-60.2-35000111.6S160 E165 Q166S160-D162 PolarHBondContact O-N 3.27Å; D162-E165 PolarHBondContact O-N 3.48Å; D162-Q166 WeakPolarHBondContact O-CB 3.44Å; D162-Q166 WeakPolarHBondContact O-CG 3.28Å; D162-Q166 PolarHBondContact O-N 2.95Å
163E84.3Confident85.4Confident89 Ų8968.2 Ų68.242%0.41634%0.341SS..Hα-helixtrans-65.8-41.6174.9-75176.6-14400111.9V159 S160 E165 Q166 I167V159-E163 HydrophobicContact CB-CB 4.16Å; S160-E163 PolarHBondContact O-N 3.43Å; S160-E163 WeakPolarHBondContact OG-CB 3.32Å; S160-E163 WeakPolarHBondContact OG-CG 3.43Å; S160-E163 PolarHBondContact OG-N 3.21Å; E163-E165 VanDerWaalsContact C-N 3.34Å; E163-E165 PolarHBondContact O-N 3.23Å; E163-Q166 PolarHBondContact O-N 2.63Å; E163-I167 WeakPolarHBondContact O-CB 3.32Å; E163-I167 WeakPolarHBondContact O-CD1 3.4Å; E163-I167 VanDerWaalsContact O-CG1 3.22Å; E163-I167 WeakPolarHBondContact O-CG1 3.49Å; E163-I167 PolarHBondContact O-N 3.35Å
164A84.2Confident85.4Confident1 Ų168.3 Ų68.31%0.00834%0.34CS..Hα-helixtrans-61.1-43.4177.900000111.6F113 V115 V159 S160 K161 K168 I180F113-A164 HydrophobicContact CB-CB 4.03Å; V115-A164 HydrophobicContact CG2-CB 3.8Å; V159-A164 HydrophobicContact CG2-CB 3.83Å; S160-A164 WeakPolarHBondContact O-CB 3.3Å; S160-A164 PolarHBondContact O-N 2.75Å; K161-A164 PolarHBondContact O-N 3.36Å; A164-K168 WeakPolarHBondContact O-CB 3.33Å; A164-K168 PolarHBondContact O-N 2.72Å; A164-I180 HydrophobicContact CB-CD1 4.1Å; A164-I180 HydrophobicContact CB-CG2 4.28Å
165E88.2Confident85.1Confident75 Ų7565.8 Ų65.835%0.3533%0.333SS..Hα-helixtrans-69.1-37.7176.6-72.9-174.4-166.300112.7K161 D162 E163 K169K161-E165 WeakPolarHBondContact CE-OE1 3.32Å; K161-E165 WeakPolarHBondContact O-CG 3.06Å; K161-E165 PolarHBondContact O-N 3.39Å; D162-E165 PolarHBondContact O-N 3.48Å; E163-E165 VanDerWaalsContact C-N 3.34Å; E163-E165 PolarHBondContact O-N 3.23Å; E165-K169 WeakPolarHBondContact O-CB 3.21Å; E165-K169 VanDerWaalsContact O-CG 3.27Å; E165-K169 WeakPolarHBondContact O-CG 3.18Å; E165-K169 PolarHBondContact O-N 3.47Å
166Q88.8Confident85.3Confident124 Ų12465.9 Ų65.958%0.57933%0.334SS*.Hα-helixtrans-63-49174.1-74.8171.47.800111.4D162 E163 K168 K169 V170D162-Q166 WeakPolarHBondContact O-CB 3.44Å; D162-Q166 WeakPolarHBondContact O-CG 3.28Å; D162-Q166 PolarHBondContact O-N 2.95Å; E163-Q166 PolarHBondContact O-N 2.63Å; Q166-K168 VanDerWaalsContact C-N 3.33Å; Q166-K168 PolarHBondContact O-N 2.7Å; Q166-K169 PolarHBondContact O-N 3.12Å; Q166-V170 WeakPolarHBondContact O-CG2 3.29Å; Q166-V170 PolarHBondContact O-N 2.8Å
167I87.7Confident85.6Confident16 Ų1665.4 Ų65.48%0.08234%0.339CS..Hα-helixtrans-62.5-42.8178.2-67.5166.1000110.4V115 V135 K156 E163 L171V115-I167 HydrophobicContact CG1-CG2 3.88Å; V135-I167 HydrophobicContact CG1-CD1 3.96Å; V135-I167 HydrophobicContact CG1-CG1 4.22Å; V135-I167 HydrophobicContact CG1-CG2 4.35Å; V135-I167 HydrophobicContact CG2-CG1 4.35Å; V135-I167 HydrophobicContact CG2-CG2 4.39Å; K156-I167 HydrophobicContact CD-CD1 3.92Å; E163-I167 WeakPolarHBondContact O-CB 3.32Å; E163-I167 WeakPolarHBondContact O-CD1 3.4Å; E163-I167 VanDerWaalsContact O-CG1 3.22Å; E163-I167 WeakPolarHBondContact O-CG1 3.49Å; E163-I167 PolarHBondContact O-N 3.35Å; I167-L171 HydrophobicContact CG2-CD1 3.45Å; I167-L171 VanDerWaalsContact CG2-CD1 3.45Å; I167-L171 HydrophobicContact CG2-CG 4.3Å; I167-L171 WeakPolarHBondContact O-CB 3.24Å; I167-L171 VanDerWaalsContact O-CG 3.27Å; I167-L171 WeakPolarHBondContact O-CG 3.46Å; I167-L171 PolarHBondContact O-N 2.72Å; I167-L171 VanDerWaalsContact O-N 3.08Å
168K86.6Confident85.9Confident70 Ų7061.9 Ų61.930%0.30432%0.318SS..Hα-helixtrans-57.5-49.8175.7178.4178.5177.4-173.10111.5A164 Q166 L171 E172 I178 I180A164-K168 WeakPolarHBondContact O-CB 3.33Å; A164-K168 PolarHBondContact O-N 2.72Å; Q166-K168 VanDerWaalsContact C-N 3.33Å; Q166-K168 PolarHBondContact O-N 2.7Å; K168-L171 PolarHBondContact O-N 3.13Å; K168-E172 WeakPolarHBondContact CE-OE1 3.4Å; K168-E172 WeakPolarHBondContact CE-OE2 3.42Å; K168-E172 HydrophobicContact CG-CG 4.17Å; K168-E172 IonicContact NZ-OE1 2.85Å; K168-E172 VanDerWaalsContact O-CB 3.24Å; K168-E172 WeakPolarHBondContact O-CB 3.41Å; K168-E172 VanDerWaalsContact O-CG 3.25Å; K168-E172 WeakPolarHBondContact O-CG 3.29Å; K168-E172 PolarHBondContact O-N 2.69Å; K168-I178 HydrophobicContact CB-CG2 4.14Å; K168-I178 HydrophobicContact CG-CB 4.16Å; K168-I178 HydrophobicContact CG-CG2 4.07Å; K168-I180 HydrophobicContact CB-CD1 4.04Å; K168-I180 HydrophobicContact CD-CD1 3.6Å; K168-I180 HydrophobicContact CD-CG1 4.09Å; K168-I180 HydrophobicContact CG-CD1 4.4Å
169K90Very high86.1Confident123 Ų12358 Ų5854%0.53530%0.301SS..Hα-helixtrans-59-52.4179.3-75.3171.3-176.4172.10112E165 Q166 L171 E172 E173E165-K169 WeakPolarHBondContact O-CB 3.21Å; E165-K169 VanDerWaalsContact O-CG 3.27Å; E165-K169 WeakPolarHBondContact O-CG 3.18Å; E165-K169 PolarHBondContact O-N 3.47Å; Q166-K169 PolarHBondContact O-N 3.12Å; K169-L171 VanDerWaalsContact C-N 3.31Å; K169-L171 PolarHBondContact O-N 3.36Å; K169-E172 PolarHBondContact O-N 3.08Å; K169-E173 VanDerWaalsContact O-CG 3.31Å; K169-E173 WeakPolarHBondContact O-CG 3.37Å; K169-E173 PolarHBondContact O-N 2.83Å
170V89.3Confident86.2Confident54 Ų5460.3 Ų60.333%0.32731%0.313SS..Hα-helixtrans-59.1-43.1-177.4171.60000111.6E131 Q166 V174E131-V170 HydrophobicContact CB-CG1 4.32Å; E131-V170 HydrophobicContact CG-CG1 3.94Å; E131-V170 WeakPolarHBondContact OE2-CG1 3.03Å; Q166-V170 WeakPolarHBondContact O-CG2 3.29Å; Q166-V170 PolarHBondContact O-N 2.8Å; V170-V174 WeakPolarHBondContact O-CG2 3.36Å; V170-V174 PolarHBondContact O-N 2.99Å
171L88Confident85.8Confident0 Ų065 Ų650%033%0.329CS..Hα-helixtrans-79.2-32.6-177.7-65.1172.1000112.3L128 E131 I132 I155 I167 K168 K169 V174 G175 A176 I178L128-L171 HydrophobicContact CD1-CD2 3.46Å; L128-L171 VanDerWaalsContact CD1-CD2 3.46Å; E131-L171 HydrophobicContact CB-CD2 3.49Å; E131-L171 VanDerWaalsContact CB-CD2 3.49Å; E131-L171 HydrophobicContact CG-CD2 4.35Å; I132-L171 HydrophobicContact CG1-CD2 4.27Å; I155-L171 HydrophobicContact CD1-CD1 3.32Å; I167-L171 HydrophobicContact CG2-CD1 3.45Å; I167-L171 VanDerWaalsContact CG2-CD1 3.45Å; I167-L171 HydrophobicContact CG2-CG 4.3Å; I167-L171 WeakPolarHBondContact O-CB 3.24Å; I167-L171 VanDerWaalsContact O-CG 3.27Å; I167-L171 WeakPolarHBondContact O-CG 3.46Å; I167-L171 PolarHBondContact O-N 2.72Å; I167-L171 VanDerWaalsContact O-N 3.08Å; K168-L171 PolarHBondContact O-N 3.13Å; K169-L171 VanDerWaalsContact C-N 3.31Å; K169-L171 PolarHBondContact O-N 3.36Å; L171-V174 CarbonylContact O-C 3.6Å; L171-V174 PolarHBondContact O-N 3.18Å; L171-G175 PolarHBondContact O-N 3.25Å; L171-A176 HydrophobicContact CB-CB 4.12Å; L171-A176 VanDerWaalsContact O-CB 3.25Å; L171-A176 WeakPolarHBondContact O-CB 3.44Å; L171-A176 PolarHBondContact O-N 2.79Å; L171-I178 HydrophobicContact CB-CD1 3.22Å; L171-I178 HydrophobicContact CB-CG1 4.39Å; L171-I178 HydrophobicContact CD1-CD1 3.35Å; L171-I178 HydrophobicContact CG-CD1 3.88Å
172E87.1Confident86Confident81 Ų8162.4 Ų62.438%0.37932%0.32SS..Hα-helixtrans-66.9-36.2172.9-76.2-178165.500112.5K168 K169 V174 G175 A176K168-E172 WeakPolarHBondContact CE-OE1 3.4Å; K168-E172 WeakPolarHBondContact CE-OE2 3.42Å; K168-E172 HydrophobicContact CG-CG 4.17Å; K168-E172 IonicContact NZ-OE1 2.85Å; K168-E172 VanDerWaalsContact O-CB 3.24Å; K168-E172 WeakPolarHBondContact O-CB 3.41Å; K168-E172 VanDerWaalsContact O-CG 3.25Å; K168-E172 WeakPolarHBondContact O-CG 3.29Å; K168-E172 PolarHBondContact O-N 2.69Å; K169-E172 PolarHBondContact O-N 3.08Å; E172-V174 PolarHBondContact O-N 3.17Å; E172-G175 WeakPolarHBondContact O-CA 3.46Å; E172-G175 PolarHBondContact O-N 3.36Å; E172-A176 WeakPolarHBondContact CA-O 3.32Å; E172-A176 WeakPolarHBondContact CG-O 3.48Å
173E88.8Confident86Confident148 Ų14859.8 Ų59.869%0.69231%0.306SS*.Hα-helixtrans-58.2-38.7171.4-75.8175-172.300111.6K124 K169 G175K124-E173 PolarHBondContact NZ-O 3.4Å; K169-E173 VanDerWaalsContact O-CG 3.31Å; K169-E173 WeakPolarHBondContact O-CG 3.37Å; K169-E173 PolarHBondContact O-N 2.83Å; E173-G175 PolarHBondContact O-N 3.49Å
174V85.3Confident86.1Confident16 Ų1658.2 Ų58.210%0.09730%0.3CS..THydrogen-bonded Turntrans-78.12.4175.3178.60000112.6K124 Q127 L128 E131 V170 L171 E172K124-V174 HydrophobicContact CB-CG1 4.43Å; K124-V174 WeakPolarHBondContact CB-O 3.4Å; K124-V174 WeakPolarHBondContact CD-O 3.45Å; Q127-V174 HydrophobicContact CB-CG1 3.37Å; Q127-V174 HydrophobicContact CB-CG2 4.41Å; L128-V174 HydrophobicContact CB-CG1 4.03Å; L128-V174 VanDerWaalsContact N-CG1 3.26Å; E131-V174 HydrophobicContact CG-CB 4.49Å; E131-V174 HydrophobicContact CG-CG2 3.73Å; V170-V174 WeakPolarHBondContact O-CG2 3.36Å; V170-V174 PolarHBondContact O-N 2.99Å; L171-V174 CarbonylContact O-C 3.6Å; L171-V174 PolarHBondContact O-N 3.18Å; E172-V174 PolarHBondContact O-N 3.17Å
175G81.8Confident86.2Confident25 Ų2561.5 Ų61.526%0.25832%0.317SS..THydrogen-bonded Turntrans77.924.917700000114.5D121 L171 E172 E173D121-G175 PolarHBondContact N-O 2.87Å; L171-G175 PolarHBondContact O-N 3.25Å; E172-G175 WeakPolarHBondContact O-CA 3.46Å; E172-G175 PolarHBondContact O-N 3.36Å; E173-G175 PolarHBondContact O-N 3.49Å
176A87.5Confident86.1Confident9 Ų960.7 Ų60.77%0.07432%0.315CS..EExtended strand (participates in β ladder)trans-81.9153.9159.500000110.9L117 K119 L128 L171 E172L117-A176 HydrophobicContact CD1-CB 3.56Å; K119-A176 CarbonylContact O-C 3.6Å; L128-A176 HydrophobicContact CD1-CB 3.8Å; L128-A176 HydrophobicContact CD2-CB 4.27Å; L171-A176 HydrophobicContact CB-CB 4.12Å; L171-A176 VanDerWaalsContact O-CB 3.25Å; L171-A176 WeakPolarHBondContact O-CB 3.44Å; L171-A176 PolarHBondContact O-N 2.79Å; E172-A176 WeakPolarHBondContact CA-O 3.32Å; E172-A176 WeakPolarHBondContact CG-O 3.48Å
177S85.9Confident85.9Confident59 Ų5956.5 Ų56.541%0.41330%0.297SS..EExtended strand (participates in β ladder)trans-109.3121169.5179.10000108V118 K119V118-S177 PolarHBondContact N-O 3.2Å; K119-S177 PolarHBondContact N-O 2.9Å; K119-S177 PolarHBondContact O-N 2.79Å
178I86.7Confident85.8Confident11 Ų1159.4 Ų59.46%0.05631%0.312CS..EExtended strand (participates in β ladder)trans-116.4132.6-174.1-72.6173000110.7V115 K116 I155 K168 L171 I180V115-I178 HydrophobicContact CG1-CD1 4.39Å; V115-I178 HydrophobicContact CG1-CG2 3.55Å; K116-I178 WeakPolarHBondContact O-CA 3.37Å; I155-I178 HydrophobicContact CD1-CD1 4.47Å; K168-I178 HydrophobicContact CB-CG2 4.14Å; K168-I178 HydrophobicContact CG-CB 4.16Å; K168-I178 HydrophobicContact CG-CG2 4.07Å; L171-I178 HydrophobicContact CB-CD1 3.22Å; L171-I178 HydrophobicContact CB-CG1 4.39Å; L171-I178 HydrophobicContact CD1-CD1 3.35Å; L171-I178 HydrophobicContact CG-CD1 3.88Å; I178-I180 HydrophobicContact CG2-CG1 4.26Å
179A84.1Confident85.7Confident32 Ų3258.5 Ų58.526%0.26431%0.313SS..EExtended strand (participates in β ladder)trans-102.2128.6165.200000108.4K116 V118K116-A179 PolarHBondContact N-O 3.11Å; K116-A179 PolarHBondContact O-N 2.93Å; V118-A179 HydrophobicContact CG2-CB 3.49Å; V118-A179 VanDerWaalsContact CG2-CB 3.49Å
180I80.7Confident85.3Confident56 Ų5653.2 Ų53.229%0.28730%0.295SS..EExtended strand (participates in β ladder)trans-98.4122.2166.9-57.4176.2000105.6F113 A164 K168 I178F113-I180 HydrophobicContact CB-CG2 3.85Å; F113-I180 HydrophobicContact CD1-CG2 3.62Å; F113-I180 HydrophobicContact CG-CG2 4.08Å; A164-I180 HydrophobicContact CB-CD1 4.1Å; A164-I180 HydrophobicContact CB-CG2 4.28Å; K168-I180 HydrophobicContact CB-CD1 4.04Å; K168-I180 HydrophobicContact CD-CD1 3.6Å; K168-I180 HydrophobicContact CD-CG1 4.09Å; K168-I180 HydrophobicContact CG-CD1 4.4Å; I178-I180 HydrophobicContact CG2-CG1 4.26Å
181E79.1Confident85Confident147 Ų14753.1 Ų53.169%0.68729%0.292SS*.  trans-114.50174.1-72.4179.3-150.100111.5F113 S114 K116F113-E181 CarbonylContact C-O 3.59Å; F113-E181 VanDerWaalsContact CA-O 3.29Å; F113-E181 WeakPolarHBondContact CA-O 3.27Å; S114-E181 PolarHBondContact N-O 3.13Å; S114-E181 PolarHBondContact O-N 3.18Å; K116-E181 WeakPolarHBondContact CE-OE2 3.44Å; K116-E181 IonicContact NZ-OE1 2.6Å; K116-E181 PolarHBondContact NZ-OE1 3.36Å; K116-E181 IonicContact NZ-OE2 2.62Å; K116-E181 PolarHBondContact NZ-OE2 3.3Å

Retrieved 181 of 181 residues in 53.2 ms (Link to these results)