A0A077Z0V9_TRITR Loading...

Uncharacterized protein

AlphaFold DB , UniProt , Accession A0A077Z0V9, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 167 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
1M28.5Very low26.9Very low197 Ų197138.7 Ų138.797%0.9780%0.799SS**  0126.90-138.3162.9167.300107.7Y3M1-Y3 HydrophobicContact CB-CE2 3.97Å; M1-Y3 WeakPolarHBondContact CE-OH 3.43Å; M1-Y3 HydrophobicContact CG-CE2 4.28Å; M1-Y3 WeakPolarHBondContact CG-OH 3.31Å; M1-Y3 PolarHBondContact SD-OH 3.09Å
2P32.6Very low26.7Very low111 Ų111138.7 Ų138.772%0.72181%0.811SS**  trans-79.3150.5-179.934.3-32.4000110.4
3Y28.3Very low26.5Very low171 Ų171135.2 Ų135.267%0.67181%0.808SS**  trans-150.5126.4162.4-61.1-71.4000113.1M1M1-Y3 HydrophobicContact CB-CE2 3.97Å; M1-Y3 WeakPolarHBondContact CE-OH 3.43Å; M1-Y3 HydrophobicContact CG-CE2 4.28Å; M1-Y3 WeakPolarHBondContact CG-OH 3.31Å; M1-Y3 PolarHBondContact SD-OH 3.09Å
4L27.2Very low26.7Very low159 Ų159130.4 Ų130.483%0.83278%0.782SS**  trans67.796.2133.9-69.8158.5000119.1
5T30.6Very low27Very low148 Ų148132.1 Ų132.191%0.90878%0.775SS**  trans-64.7122.4152.139.30000110.3
6G24.9Very low27Very low62 Ų62129.2 Ų129.264%0.63978%0.782SS**  trans-158.8123-178.700000112.9
7F25.1Very low27.3Very low213 Ų213129.2 Ų129.293%0.93477%0.769SS**  trans27.1118.2140.9-67.6-90.9000120.3
8G25.6Very low27.4Very low75 Ų75132.7 Ų132.777%0.77377%0.766SS**  trans73.6175143.700000117.7
9V24.7Very low27.7Very low117 Ų117129.1 Ų129.171%0.70975%0.754SS**  trans86.4101.7167-149.30000117.1S11V9-S11 PolarHBondContact O-N 3.2Å; V9-S11 VanDerWaalsContact O-N 3.16Å; V9-S11 PolarHBondContact O-OG 2.84Å
10N23.6Very low27.8Very low166 Ų166132.3 Ų132.389%0.88875%0.753SS**  trans3.899.2131.3-73.9-36.4000114.3
11S24.7Very low28.2Very low107 Ų107130.9 Ų130.975%0.74874%0.74SS**  trans-147.3105.2174.934.40000111.5V9 A13V9-S11 PolarHBondContact O-N 3.2Å; V9-S11 VanDerWaalsContact O-N 3.16Å; V9-S11 PolarHBondContact O-OG 2.84Å; S11-A13 PolarHBondContact O-N 3.35Å; S11-A13 VanDerWaalsContact O-N 3.13Å
12C24.9Very low28.3Very low138 Ų138125.2 Ų125.293%0.93271%0.713SS**  trans-49.4110.3158.4-660000109.9
13A23.6Very low28.3Very low94 Ų94125.2 Ų125.278%0.77770%0.702SS**  trans-145.292.7158.500000109.1S11S11-A13 PolarHBondContact O-N 3.35Å; S11-A13 VanDerWaalsContact O-N 3.13Å
14P29.4Very low28.6Very low68 Ų68122.9 Ų122.944%0.44270%0.701SS.*SBendtrans-126.7126139.334.8-22.9000109
15F31.5Very low28.7Very low156 Ų156118.8 Ų118.868%0.68470%0.697SS**  trans7290.6172-53.1-73.1000116.2F17F15-F17 HydrophobicContact CB-CD2 3.96Å; F15-F17 AromaticContact CD1-CD2 3.98Å; F15-F17 HydrophobicContact CD1-CD2 3.98Å; F15-F17 AromaticContact CD1-CE2 3.87Å; F15-F17 HydrophobicContact CD1-CE2 3.87Å; F15-F17 HydrophobicContact CG-CD2 4.38Å; F15-F17 PolarHBondContact O-N 2.9Å
16G27.7Very low28.7Very low85 Ų85115.7 Ų115.788%0.87667%0.674SS**  trans-7034162.200000114
17F30.6Very low28.9Very low130 Ų130117.9 Ų117.957%0.5768%0.68SS**  trans-79.9119.7167.9-71.8-65.9000107.8F15 A19 E21F15-F17 HydrophobicContact CB-CD2 3.96Å; F15-F17 AromaticContact CD1-CD2 3.98Å; F15-F17 HydrophobicContact CD1-CD2 3.98Å; F15-F17 AromaticContact CD1-CE2 3.87Å; F15-F17 HydrophobicContact CD1-CE2 3.87Å; F15-F17 HydrophobicContact CG-CD2 4.38Å; F15-F17 PolarHBondContact O-N 2.9Å; F17-A19 PolarHBondContact O-N 3.19Å; F17-E21 WeakPolarHBondContact CA-OE2 3.45Å
18R30.1Very low29.1Very low191 Ų191112.4 Ų112.472%0.72166%0.664SS**  trans-63.9132.6167.1-77.3-178.7165.6-177-3.1106.1R20 E21R18-R20 HydrophobicContact CB-CB 4.38Å; R18-R20 PolarHBondContact O-N 3.28Å; R18-E21 HydrophobicContact CB-CG 4.37Å; R18-E21 PolarHBondContact N-OE2 3.35Å; R18-E21 VanDerWaalsContact N-OE2 3.13Å; R18-E21 WeakPolarHBondContact O-CB 3.33Å; R18-E21 PolarHBondContact O-N 3.43Å
19A32.5Very low29.3Very low65 Ų65113.1 Ų113.154%0.53766%0.656SS.*Hα-helixtrans-46.7-30.7175.400000112.1F17 E21 L22 F23F17-A19 PolarHBondContact O-N 3.19Å; A19-E21 VanDerWaalsContact C-N 3.35Å; A19-E21 PolarHBondContact O-N 2.64Å; A19-L22 PolarHBondContact O-N 2.99Å; A19-F23 HydrophobicContact CB-CE2 4.5Å; A19-F23 WeakPolarHBondContact O-CD2 3.3Å; A19-F23 PolarHBondContact O-N 3.49Å
20R30.5Very low29.6Very low193 Ų193110.3 Ų110.373%0.72864%0.641SS**Hα-helixtrans-54.6-40.5172.6-148.2173.7-165170.93.7114.4R18 F23 D24R18-R20 HydrophobicContact CB-CB 4.38Å; R18-R20 PolarHBondContact O-N 3.28Å; R20-F23 PolarHBondContact O-N 3.47Å; R20-D24 PolarHBondContact O-N 3.22Å
21E34.8Very low30.2Very low103 Ų103107 Ų10748%0.48163%0.629SS.*Hα-helixtrans-72.4-30-178.4-64.8166.5164.500112.6F17 R18 A19 F23F17-E21 WeakPolarHBondContact CA-OE2 3.45Å; R18-E21 HydrophobicContact CB-CG 4.37Å; R18-E21 PolarHBondContact N-OE2 3.35Å; R18-E21 VanDerWaalsContact N-OE2 3.13Å; R18-E21 WeakPolarHBondContact O-CB 3.33Å; R18-E21 PolarHBondContact O-N 3.43Å; A19-E21 VanDerWaalsContact C-N 3.35Å; A19-E21 PolarHBondContact O-N 2.64Å; E21-F23 VanDerWaalsContact C-N 3.26Å; E21-F23 PolarHBondContact O-N 3.18Å
22L30.7Very low31Very low77 Ų77108.9 Ų108.940%0.40363%0.631SS.*Hα-helixtrans-69.9-24.7174-109.8145.6000112.3A19A19-L22 PolarHBondContact O-N 2.99Å
23F34Very low31.9Very low112 Ų112107.3 Ų107.349%0.49162%0.617SS.*Hα-helixtrans-100.8-20.7178.3-63.6-67.7000113.4A19 R20 E21 G25 I26A19-F23 HydrophobicContact CB-CE2 4.5Å; A19-F23 WeakPolarHBondContact O-CD2 3.3Å; A19-F23 PolarHBondContact O-N 3.49Å; R20-F23 PolarHBondContact O-N 3.47Å; E21-F23 VanDerWaalsContact C-N 3.26Å; E21-F23 PolarHBondContact O-N 3.18Å; F23-G25 VanDerWaalsContact C-N 3.28Å; F23-G25 PolarHBondContact O-N 3.44Å; F23-I26 HydrophobicContact CD1-CD1 4.32Å; F23-I26 CarbonylContact O-C 3.48Å; F23-I26 PolarHBondContact O-N 3.25Å; F23-I26 VanDerWaalsContact O-N 3.11Å
24D33.4Very low32.4Very low121 Ų121112.9 Ų112.965%0.64762%0.619SS**Hα-helixtrans-68.2-26.1175.7-76.1-23000112.5R20 I26R20-D24 PolarHBondContact O-N 3.22Å; D24-I26 VanDerWaalsContact C-N 3.34Å
25G30.9Very low32.7Very low73 Ų73112.4 Ų112.475%0.75363%0.627SS**THydrogen-bonded Turntrans-80.2-13.3171.600000114.3F23 S27F23-G25 VanDerWaalsContact C-N 3.28Å; F23-G25 PolarHBondContact O-N 3.44Å; G25-S27 PolarHBondContact O-N 3.02Å
26I30Very low33.1Very low83 Ų83115.4 Ų115.443%0.42664%0.64SS.*SBendtrans-9889.9173.3-52.1177.1000106.1F23 D24 V28F23-I26 HydrophobicContact CD1-CD1 4.32Å; F23-I26 CarbonylContact O-C 3.48Å; F23-I26 PolarHBondContact O-N 3.25Å; F23-I26 VanDerWaalsContact O-N 3.11Å; D24-I26 VanDerWaalsContact C-N 3.34Å; I26-V28 HydrophobicContact CG2-CG2 3.6Å; I26-V28 PolarHBondContact O-N 2.85Å
27S29.5Very low33.9Very low108 Ų108122.7 Ų122.776%0.75564%0.641SS**  trans-62.976.7164.4173.10000109G25 C29G25-S27 PolarHBondContact O-N 3.02Å; S27-C29 PolarHBondContact O-N 2.82Å
28V29.2Very low34.9Very low99 Ų99124.8 Ų124.860%0.665%0.652SS**  trans-70.6108.5159.2-174.20000103.8I26 S30I26-V28 HydrophobicContact CG2-CG2 3.6Å; I26-V28 PolarHBondContact O-N 2.85Å; V28-S30 PolarHBondContact O-N 2.94Å
29C28.8Very low35.9Very low90 Ų90122.1 Ų122.161%0.60866%0.66SS**  trans-48112.4173.1-64.40000108.1S27S27-C29 PolarHBondContact O-N 2.82Å
30S32.2Very low36.7Very low57 Ų57124 Ų12440%0.39967%0.669SS.*  trans-48130173.8161.50000108.2V28 N32 T33V28-S30 PolarHBondContact O-N 2.94Å; S30-N32 PolarHBondContact O-N 3.49Å; S30-N32 PolarHBondContact OG-N 3.45Å; S30-N32 VanDerWaalsContact OG-N 3.17Å; S30-T33 WeakPolarHBondContact CB-OG1 3.22Å; S30-T33 PolarHBondContact O-N 3.47Å; S30-T33 PolarHBondContact O-OG1 2.98Å
31P36.2Very low37.7Very low97 Ų97120.8 Ų120.863%0.6368%0.676SS**G310 helixtrans-57.7-15.3174.6-21.631.3000113
32N41.1Very low38.6Very low146 Ų146119.4 Ų119.478%0.78169%0.689SS**G310 helixtrans-95.64.4-175.6-70.2-12.6000114.5S30S30-N32 PolarHBondContact O-N 3.49Å; S30-N32 PolarHBondContact OG-N 3.45Å; S30-N32 VanDerWaalsContact OG-N 3.17Å
33T43.8Very low39.4Very low105 Ų105119.3 Ų119.364%0.64470%0.695SS**G310 helixtrans-91.2-7.1176.9-3.10000113.9S30 G35S30-T33 WeakPolarHBondContact CB-OG1 3.22Å; S30-T33 PolarHBondContact O-N 3.47Å; S30-T33 PolarHBondContact O-OG1 2.98Å; T33-G35 PolarHBondContact O-N 2.94Å; T33-G35 VanDerWaalsContact O-N 3.1Å
34Y33.8Very low40.3Very low211 Ų211123.3 Ų123.383%0.82772%0.715SS**SBendtrans-79.393.1163.4-78.5-82.4000108.1
35G36.3Very low41.1Very low59 Ų59128.6 Ų128.661%0.60873%0.726SS**  trans-48.7144.5-174.500000113.2T33 R37T33-G35 PolarHBondContact O-N 2.94Å; T33-G35 VanDerWaalsContact O-N 3.1Å; G35-R37 PolarHBondContact O-N 3.24Å
36K39Very low41.8Very low218 Ų218130.8 Ų130.895%0.94872%0.72SS**  trans-43.886.6161.3-63.3175.4178-179.70109.9
37R45.3Very low42.6Very low239 Ų239129.9 Ų129.990%0.90273%0.725SS**  trans-107.3114.7161.2-91.4-173.4174-168.1-1.5105.5G35G35-R37 PolarHBondContact O-N 3.24Å
38E50Low43.3Very low174 Ų174132 Ų13281%0.81372%0.723SS**  trans-47.6142.3173.9-66.1-162141.600110.4S40E38-S40 PolarHBondContact O-N 3.04Å
39P51.4Low44Very low134 Ų134130.7 Ų130.787%0.8772%0.719SS**  trans-71.186.1177.529.9-31.7000108.4S41P39-S41 PolarHBondContact O-N 3.48Å
40S50Low44.7Very low104 Ų104128 Ų12873%0.72771%0.706SS**  trans-69.7119.8164.155.10000108.2E38 G42E38-S40 PolarHBondContact O-N 3.04Å; S40-G42 PolarHBondContact O-N 2.83Å
41S50.8Low45.2Very low127 Ų127131.3 Ų131.389%0.88872%0.719SS**SBendtrans-33.2112.9171.9520000113.3P39P39-S41 PolarHBondContact O-N 3.48Å
42G54.5Low45.3Very low73 Ų73132.3 Ų132.375%0.75372%0.718SS**  trans1586.6173.500000117.8S40S40-G42 PolarHBondContact O-N 2.83Å
43S48.2Very low46Very low76 Ų76129.4 Ų129.453%0.53171%0.706SS.*G310 helixtrans-97.718.8-161.768.30000118R45 L46S43-R45 PolarHBondContact O-N 2.87Å; S43-L46 PolarHBondContact O-N 2.89Å; S43-L46 VanDerWaalsContact O-N 3.09Å
44E51.1Low46.4Very low195 Ų195128.9 Ų128.991%0.91170%0.699SS**G310 helixtrans-66.4-19.7178.3-74.9-173158.500113.9
45R50.3Low47.1Very low232 Ų232128.2 Ų128.288%0.87570%0.695SS**G310 helixtrans-91.8-5.4172.7-83.9-178.2159.6177.8-4.8115.1S43S43-R45 PolarHBondContact O-N 2.87Å
46L46.8Very low48.2Very low119 Ų119129.8 Ų129.862%0.62369%0.693SS**THydrogen-bonded Turntrans-93.9-15.4179.1-80.9161.7000113.1S43 S49 G50S43-L46 PolarHBondContact O-N 2.89Å; S43-L46 VanDerWaalsContact O-N 3.09Å; L46-S49 PolarHBondContact O-N 3.43Å; L46-G50 PolarHBondContact O-N 3.33Å
47A46.8Very low48.7Very low65 Ų65125 Ų12554%0.53767%0.669SS.*Hα-helixtrans-66.6-34.8179.200000113.1S49 G50 L51A47-S49 VanDerWaalsContact C-N 3.34Å; A47-G50 PolarHBondContact O-N 3.49Å; A47-L51 PolarHBondContact O-N 3.14Å
48E43.1Very low49.1Very low152 Ų152117.6 Ų117.671%0.7164%0.644SS**Hα-helixtrans-67.7-33.1173.4-80.6-175148.200112.6G50 L51 L52E48-G50 VanDerWaalsContact C-N 3.3Å; E48-G50 PolarHBondContact O-N 2.8Å; E48-L51 PolarHBondContact O-N 2.86Å; E48-L52 PolarHBondContact O-N 3.26Å
49S44.5Very low49.4Very low72 Ų72113 Ų11350%0.50362%0.623SS.*Hα-helixtrans-68.6-28.1172-83.30000112.8L46 A47 T53L46-S49 PolarHBondContact O-N 3.43Å; A47-S49 VanDerWaalsContact C-N 3.34Å; S49-T53 WeakPolarHBondContact O-CG2 3.2Å; S49-T53 PolarHBondContact O-N 2.84Å
50G44.4Very low49.7Very low33 Ų33109.9 Ų109.934%0.3460%0.604SS.*Hα-helixtrans-75.1-26.4175.800000114.7L46 A47 E48 T53 N54L46-G50 PolarHBondContact O-N 3.33Å; A47-G50 PolarHBondContact O-N 3.49Å; E48-G50 VanDerWaalsContact C-N 3.3Å; E48-G50 PolarHBondContact O-N 2.8Å; G50-T53 WeakPolarHBondContact CA-OG1 3.32Å; G50-T53 PolarHBondContact O-OG1 3.46Å; G50-N54 PolarHBondContact O-N 3.47Å
51L41.1Very low49.9Very low127 Ų127108 Ų10867%0.66559%0.588SS**Hα-helixtrans-76.2-35176.4-83.7155.2000112.1A47 E48 R55A47-L51 PolarHBondContact O-N 3.14Å; E48-L51 PolarHBondContact O-N 2.86Å; L51-R55 PolarHBondContact O-N 3.33Å
52L40Very low50.3Low117 Ų117108.8 Ų108.861%0.61357%0.571SS**Hα-helixtrans-67.1-35.7173.4-79.5162.1000112E48 T56E48-L52 PolarHBondContact O-N 3.26Å; L52-T56 VanDerWaalsContact O-CB 3.31Å; L52-T56 WeakPolarHBondContact O-CB 3.41Å; L52-T56 PolarHBondContact O-N 3.15Å; L52-T56 PolarHBondContact O-OG1 3.36Å
53T54.2Low50.5Low86 Ų86112.6 Ų112.653%0.52856%0.563SS.*Hα-helixtrans-69.3-36.8179.351.20000112.5S49 G50 T56 R57S49-T53 WeakPolarHBondContact O-CG2 3.2Å; S49-T53 PolarHBondContact O-N 2.84Å; G50-T53 WeakPolarHBondContact CA-OG1 3.32Å; G50-T53 PolarHBondContact O-OG1 3.46Å; T53-T56 PolarHBondContact O-N 3.18Å; T53-R57 VanDerWaalsContact O-CB 3.22Å; T53-R57 WeakPolarHBondContact O-CB 3.44Å; T53-R57 PolarHBondContact O-N 2.94Å
54N51.8Low50.9Low93 Ų93112.5 Ų112.550%0.49756%0.56SS.*Hα-helixtrans-67.3-43.8175.8-85.6-16.9000112.7G50 T56 R57 Q58G50-N54 PolarHBondContact O-N 3.47Å; N54-T56 VanDerWaalsContact C-N 3.34Å; N54-T56 PolarHBondContact O-N 3.33Å; N54-R57 PolarHBondContact O-N 3.39Å; N54-Q58 PolarHBondContact O-N 3.18Å
55R49.9Very low51.4Low198 Ų198105.4 Ų105.475%0.74753%0.527SS*.Hα-helixtrans-64.7-40.8176.5-166175.5-177.21771111.7L51 R57 Q58 E59L51-R55 PolarHBondContact O-N 3.33Å; R55-R57 VanDerWaalsContact C-N 3.31Å; R55-R57 PolarHBondContact O-N 3.43Å; R55-Q58 PolarHBondContact O-N 3.04Å; R55-E59 WeakPolarHBondContact O-CB 3.29Å; R55-E59 PolarHBondContact O-N 2.88Å
56T58.3Low52Low92 Ų9298.8 Ų98.856%0.56451%0.505SS*.Hα-helixtrans-66.1-35.2176.2-50.10000111.5L52 T53 N54 S60L52-T56 VanDerWaalsContact O-CB 3.31Å; L52-T56 WeakPolarHBondContact O-CB 3.41Å; L52-T56 PolarHBondContact O-N 3.15Å; L52-T56 PolarHBondContact O-OG1 3.36Å; T53-T56 PolarHBondContact O-N 3.18Å; N54-T56 VanDerWaalsContact C-N 3.34Å; N54-T56 PolarHBondContact O-N 3.33Å; T56-S60 VanDerWaalsContact O-CB 3.3Å; T56-S60 WeakPolarHBondContact O-CB 3.47Å; T56-S60 PolarHBondContact O-N 2.76Å
57R51.1Low52.7Low118 Ų11898.1 Ų98.145%0.44550%0.499SS..Hα-helixtrans-67.8-46.1176-172.1177.9-180-168.2-2.7111.9T53 N54 R55 E59 S60 V61T53-R57 VanDerWaalsContact O-CB 3.22Å; T53-R57 WeakPolarHBondContact O-CB 3.44Å; T53-R57 PolarHBondContact O-N 2.94Å; N54-R57 PolarHBondContact O-N 3.39Å; R55-R57 VanDerWaalsContact C-N 3.31Å; R55-R57 PolarHBondContact O-N 3.43Å; R57-E59 VanDerWaalsContact C-N 3.34Å; R57-E59 PolarHBondContact O-N 3.35Å; R57-S60 PolarHBondContact O-N 3.36Å; R57-V61 VanDerWaalsContact O-CG2 3.3Å; R57-V61 WeakPolarHBondContact O-CG2 3.33Å; R57-V61 PolarHBondContact O-N 3.27Å
58Q53.8Low53.5Low82 Ų8298.7 Ų98.738%0.38349%0.489SS..Hα-helixtrans-63.1-40.7175.7-73.4-175.4-1500111.8N54 R55 V61 R62N54-Q58 PolarHBondContact O-N 3.18Å; R55-Q58 PolarHBondContact O-N 3.04Å; Q58-V61 PolarHBondContact O-N 3.41Å; Q58-R62 WeakPolarHBondContact O-CB 3.4Å; Q58-R62 VanDerWaalsContact O-CG 3.29Å; Q58-R62 WeakPolarHBondContact O-CG 3.3Å; Q58-R62 PolarHBondContact O-N 3.2Å
59E56.1Low54.5Low79 Ų7993.6 Ų93.637%0.36946%0.464SS..Hα-helixtrans-63.6-42.4175.1-178.361-164.300111.9R55 R57 V61 R62 R63R55-E59 WeakPolarHBondContact O-CB 3.29Å; R55-E59 PolarHBondContact O-N 2.88Å; R57-E59 VanDerWaalsContact C-N 3.34Å; R57-E59 PolarHBondContact O-N 3.35Å; E59-V61 PolarHBondContact O-N 3.47Å; E59-R62 PolarHBondContact O-N 2.92Å; E59-R63 WeakPolarHBondContact O-CG 3.21Å; E59-R63 PolarHBondContact O-N 2.92Å; E59-R63 IonicContact OE1-CZ 3.37Å; E59-R63 IonicContact OE1-NE 2.83Å; E59-R63 PolarHBondContact OE1-NE 3.1Å; E59-R63 IonicContact OE1-NH2 3.04Å; E59-R63 PolarHBondContact OE1-NH2 2.9Å
60S56.5Low55.6Low67 Ų6797 Ų9747%0.46947%0.466SS..Hα-helixtrans-62.1-42.4175.5-174.60000112T56 R57 R63 T64T56-S60 VanDerWaalsContact O-CB 3.3Å; T56-S60 WeakPolarHBondContact O-CB 3.47Å; T56-S60 PolarHBondContact O-N 2.76Å; R57-S60 PolarHBondContact O-N 3.36Å; S60-R63 PolarHBondContact O-N 3.4Å; S60-T64 WeakPolarHBondContact O-CB 3.45Å; S60-T64 PolarHBondContact O-N 3.18Å; S60-T64 PolarHBondContact O-OG1 2.86Å
61V55Low56.5Low64 Ų6499.1 Ų99.139%0.38847%0.472SS..Hα-helixtrans-63.5-47.7175.5168.20000110.6R57 Q58 E59 R63 T64 I65 V106R57-V61 VanDerWaalsContact O-CG2 3.3Å; R57-V61 WeakPolarHBondContact O-CG2 3.33Å; R57-V61 PolarHBondContact O-N 3.27Å; Q58-V61 PolarHBondContact O-N 3.41Å; E59-V61 PolarHBondContact O-N 3.47Å; V61-R63 PolarHBondContact O-N 3.49Å; V61-T64 PolarHBondContact O-N 2.92Å; V61-I65 HydrophobicContact CG1-CD1 3.75Å; V61-I65 HydrophobicContact CG1-CG1 4.41Å; V61-I65 WeakPolarHBondContact O-CD1 3.49Å; V61-I65 WeakPolarHBondContact O-CG1 3.41Å; V61-I65 PolarHBondContact O-N 3.35Å; V61-V106 HydrophobicContact CG1-CG1 4.08Å
62R59.6Low57.7Low145 Ų14594.5 Ų94.555%0.54745%0.449SS..Hα-helixtrans-57-46.1176-75.1175.3-179.1-167.1-2.4112.3Q58 E59 I65 F66Q58-R62 WeakPolarHBondContact O-CB 3.4Å; Q58-R62 VanDerWaalsContact O-CG 3.29Å; Q58-R62 WeakPolarHBondContact O-CG 3.3Å; Q58-R62 PolarHBondContact O-N 3.2Å; E59-R62 PolarHBondContact O-N 2.92Å; R62-I65 PolarHBondContact O-N 3.18Å; R62-F66 WeakPolarHBondContact O-CB 3.46Å; R62-F66 PolarHBondContact O-N 3.44Å
63R57.4Low58.7Low152 Ų15290.8 Ų90.857%0.57443%0.434SS*.Hα-helixtrans-63.1-43.1176.5-72.5177.9-172.6-165.30.8112.1E59 S60 V61 I65 F66 H67E59-R63 WeakPolarHBondContact O-CG 3.21Å; E59-R63 PolarHBondContact O-N 2.92Å; E59-R63 IonicContact OE1-CZ 3.37Å; E59-R63 IonicContact OE1-NE 2.83Å; E59-R63 PolarHBondContact OE1-NE 3.1Å; E59-R63 IonicContact OE1-NH2 3.04Å; E59-R63 PolarHBondContact OE1-NH2 2.9Å; S60-R63 PolarHBondContact O-N 3.4Å; V61-R63 PolarHBondContact O-N 3.49Å; R63-I65 VanDerWaalsContact C-N 3.34Å; R63-I65 PolarHBondContact O-N 2.94Å; R63-F66 PolarHBondContact O-N 2.77Å; R63-H67 WeakPolarHBondContact O-CB 3.48Å; R63-H67 PolarHBondContact O-CD2 2.71Å; R63-H67 PolarHBondContact O-N 3.3Å
64T58Low59.1Low75 Ų7591.1 Ų91.146%0.4643%0.433SS..Hα-helixtrans-61.8-44.2179-57.80000111S60 V61 H67 F68S60-T64 WeakPolarHBondContact O-CB 3.45Å; S60-T64 PolarHBondContact O-N 3.18Å; S60-T64 PolarHBondContact O-OG1 2.86Å; V61-T64 PolarHBondContact O-N 2.92Å; T64-H67 PolarHBondContact O-N 3.49Å; T64-F68 WeakPolarHBondContact O-CB 2.99Å; T64-F68 PolarHBondContact O-N 2.74Å
65I60.7Low59.5Low45 Ų4591.3 Ų91.323%0.23143%0.433CS..Hα-helixtrans-61.8-46.4175.4-64.5160.6000111V61 R62 R63 H67 F68 F69 V106V61-I65 HydrophobicContact CG1-CD1 3.75Å; V61-I65 HydrophobicContact CG1-CG1 4.41Å; V61-I65 WeakPolarHBondContact O-CD1 3.49Å; V61-I65 WeakPolarHBondContact O-CG1 3.41Å; V61-I65 PolarHBondContact O-N 3.35Å; R62-I65 PolarHBondContact O-N 3.18Å; R63-I65 VanDerWaalsContact C-N 3.34Å; R63-I65 PolarHBondContact O-N 2.94Å; I65-H67 PolarHBondContact O-N 3.49Å; I65-F68 WeakPolarHBondContact O-CB 3.4Å; I65-F68 PolarHBondContact O-N 2.93Å; I65-F69 HydrophobicContact CG2-CD2 3.51Å; I65-F69 HydrophobicContact CG2-CE2 3.22Å; I65-F69 HydrophobicContact CG2-CZ 4.3Å; I65-F69 VanDerWaalsContact O-CD2 3.25Å; I65-F69 WeakPolarHBondContact O-CD2 3.16Å; I65-F69 PolarHBondContact O-N 2.9Å; I65-V106 HydrophobicContact CD1-CB 4.1Å; I65-V106 HydrophobicContact CD1-CG1 3.21Å; I65-V106 HydrophobicContact CD1-CG2 4.4Å; I65-V106 HydrophobicContact CG1-CG1 4.05Å; I65-V106 HydrophobicContact CG1-CG2 4.41Å
66F62.1Low60Low93 Ų9382.8 Ų82.841%0.40840%0.403SS..Hα-helixtrans-60.6-45.4178.1-179-95.4000111.6R62 R63 F68 F69 R70 V144R62-F66 WeakPolarHBondContact O-CB 3.46Å; R62-F66 PolarHBondContact O-N 3.44Å; R63-F66 PolarHBondContact O-N 2.77Å; F66-F68 VanDerWaalsContact C-N 3.35Å; F66-F68 PolarHBondContact O-N 2.91Å; F66-F69 PolarHBondContact O-N 3.29Å; F66-R70 VanDerWaalsContact O-CB 3.23Å; F66-R70 WeakPolarHBondContact O-CB 3.46Å; F66-R70 PolarHBondContact O-N 2.89Å; F66-V144 HydrophobicContact CD2-CG2 4.24Å
67H61.9Low59.9Low106 Ų10686.3 Ų86.349%0.49141%0.406SS..Hα-helixtrans-63.3-40.1175.2-84.9-71.4000112.3R63 T64 I65 R70 T71R63-H67 WeakPolarHBondContact O-CB 3.48Å; R63-H67 PolarHBondContact O-CD2 2.71Å; R63-H67 PolarHBondContact O-N 3.3Å; T64-H67 PolarHBondContact O-N 3.49Å; I65-H67 PolarHBondContact O-N 3.49Å; H67-R70 PolarHBondContact O-N 3.34Å; H67-T71 WeakPolarHBondContact O-CB 3.4Å; H67-T71 PolarHBondContact O-N 3.38Å; H67-T71 PolarHBondContact O-OG1 3.26Å
68F64.6Low60.2Low76 Ų7683.6 Ų83.633%0.33341%0.405SS..Hα-helixtrans-60.5-50.9175.3179.3-94.6000111.3T64 I65 F66 R70 T71 L72 F98T64-F68 WeakPolarHBondContact O-CB 2.99Å; T64-F68 PolarHBondContact O-N 2.74Å; I65-F68 WeakPolarHBondContact O-CB 3.4Å; I65-F68 PolarHBondContact O-N 2.93Å; F66-F68 VanDerWaalsContact C-N 3.35Å; F66-F68 PolarHBondContact O-N 2.91Å; F68-R70 VanDerWaalsContact C-N 3.35Å; F68-R70 PolarHBondContact O-N 3.41Å; F68-T71 PolarHBondContact O-N 3.42Å; F68-L72 HydrophobicContact CE1-CD2 4.24Å; F68-L72 WeakPolarHBondContact O-CB 3.21Å; F68-L72 PolarHBondContact O-N 3.46Å; F68-F98 AromaticContact CZ-CE1 4Å; F68-F98 HydrophobicContact CZ-CE1 4Å
69F63.7Low60.2Low45 Ų4585.3 Ų85.320%0.19741%0.413CS..Hα-helixtrans-65.9-36.7178.3-73-51.6000113I65 F66 L72 A73 T99 T103I65-F69 HydrophobicContact CG2-CD2 3.51Å; I65-F69 HydrophobicContact CG2-CE2 3.22Å; I65-F69 HydrophobicContact CG2-CZ 4.3Å; I65-F69 VanDerWaalsContact O-CD2 3.25Å; I65-F69 WeakPolarHBondContact O-CD2 3.16Å; I65-F69 PolarHBondContact O-N 2.9Å; F66-F69 PolarHBondContact O-N 3.29Å; F69-L72 PolarHBondContact O-N 3.23Å; F69-A73 VanDerWaalsContact O-CB 3.29Å; F69-A73 WeakPolarHBondContact O-CB 3.28Å; F69-A73 PolarHBondContact O-N 3.34Å; F69-T99 HydrophobicContact CD1-CG2 3.64Å; F69-T99 HydrophobicContact CE1-CG2 3.2Å; F69-T99 HydrophobicContact CZ-CG2 4.15Å; F69-T103 WeakPolarHBondContact CZ-OG1 3.43Å
70R67.6Low60Low145 Ų14586 Ų8655%0.54742%0.419SS..Hα-helixtrans-61.2-47.7173.7-178.1177.3177.7177.10.4111.1F66 H67 F68 L72 A73 L74F66-R70 VanDerWaalsContact O-CB 3.23Å; F66-R70 WeakPolarHBondContact O-CB 3.46Å; F66-R70 PolarHBondContact O-N 2.89Å; H67-R70 PolarHBondContact O-N 3.34Å; F68-R70 VanDerWaalsContact C-N 3.35Å; F68-R70 PolarHBondContact O-N 3.41Å; R70-L72 VanDerWaalsContact C-N 3.35Å; R70-A73 PolarHBondContact O-N 2.97Å; R70-L74 HydrophobicContact CG-CD1 4.25Å; R70-L74 WeakPolarHBondContact O-CB 3.35Å; R70-L74 VanDerWaalsContact O-CG 3.28Å; R70-L74 WeakPolarHBondContact O-CG 3.23Å; R70-L74 PolarHBondContact O-N 3.17Å
71T63.5Low59.9Low76 Ų7688.6 Ų88.647%0.46643%0.428SS..Hα-helixtrans-63.5-42.7177.9-60.40000111.1H67 F68 A73 L74 L75H67-T71 WeakPolarHBondContact O-CB 3.4Å; H67-T71 PolarHBondContact O-N 3.38Å; H67-T71 PolarHBondContact O-OG1 3.26Å; F68-T71 PolarHBondContact O-N 3.42Å; T71-A73 PolarHBondContact O-N 2.84Å; T71-L74 PolarHBondContact O-N 2.94Å; T71-L75 HydrophobicContact CG2-CD1 4.13Å; T71-L75 HydrophobicContact CG2-CG 4.46Å; T71-L75 WeakPolarHBondContact O-CB 3.46Å; T71-L75 WeakPolarHBondContact O-CG 3.5Å; T71-L75 PolarHBondContact O-N 2.9Å
72L65.6Low59.9Low31 Ų3191 Ų9116%0.16244%0.438CS..Hα-helixtrans-63.1-42.7177.2-169.965.4000111.8F68 F69 R70 L74 L75 V76 I95 T99F68-L72 HydrophobicContact CE1-CD2 4.24Å; F68-L72 WeakPolarHBondContact O-CB 3.21Å; F68-L72 PolarHBondContact O-N 3.46Å; F69-L72 PolarHBondContact O-N 3.23Å; R70-L72 VanDerWaalsContact C-N 3.35Å; L72-L74 VanDerWaalsContact C-N 3.34Å; L72-L74 PolarHBondContact O-N 3.37Å; L72-L75 PolarHBondContact O-N 3.41Å; L72-V76 WeakPolarHBondContact O-CB 3.36Å; L72-V76 VanDerWaalsContact O-CG2 3.29Å; L72-V76 WeakPolarHBondContact O-CG2 3.17Å; L72-V76 PolarHBondContact O-N 3.01Å; L72-I95 HydrophobicContact CD1-CG2 4.03Å; L72-I95 HydrophobicContact CD2-CG2 3.97Å; L72-I95 HydrophobicContact CG-CG2 4.08Å; L72-T99 WeakPolarHBondContact CD2-OG1 3.42Å
73A61.2Low59.4Low38 Ų3891.5 Ų91.531%0.31445%0.452SS..Hα-helixtrans-64.1-38.6175.300000112.2F69 R70 T71 R77 F151F69-A73 VanDerWaalsContact O-CB 3.29Å; F69-A73 WeakPolarHBondContact O-CB 3.28Å; F69-A73 PolarHBondContact O-N 3.34Å; R70-A73 PolarHBondContact O-N 2.97Å; T71-A73 PolarHBondContact O-N 2.84Å; A73-R77 VanDerWaalsContact O-CB 3.3Å; A73-R77 WeakPolarHBondContact O-CB 3.41Å; A73-R77 PolarHBondContact O-N 3.3Å; A73-F151 HydrophobicContact CB-CE2 4.43Å; A73-F151 HydrophobicContact CB-CZ 4.45Å
74L62.7Low58.7Low94 Ų9486.5 Ų86.549%0.49244%0.436SS..Hα-helixtrans-67.6-39.9174.5-71.1173.2000112R70 T71 L72 R77 S78R70-L74 HydrophobicContact CG-CD1 4.25Å; R70-L74 WeakPolarHBondContact O-CB 3.35Å; R70-L74 VanDerWaalsContact O-CG 3.28Å; R70-L74 WeakPolarHBondContact O-CG 3.23Å; R70-L74 PolarHBondContact O-N 3.17Å; T71-L74 PolarHBondContact O-N 2.94Å; L72-L74 VanDerWaalsContact C-N 3.34Å; L72-L74 PolarHBondContact O-N 3.37Å; L74-R77 PolarHBondContact O-N 3.28Å; L74-S78 WeakPolarHBondContact O-CB 3.5Å; L74-S78 PolarHBondContact O-N 2.86Å
75L61.3Low58.2Low97 Ų9787 Ų8751%0.50844%0.44SS..Hα-helixtrans-62.9-47.7174.1-76.4169.4000110.9T71 L72 R77 S78 Q79T71-L75 HydrophobicContact CG2-CD1 4.13Å; T71-L75 HydrophobicContact CG2-CG 4.46Å; T71-L75 WeakPolarHBondContact O-CB 3.46Å; T71-L75 WeakPolarHBondContact O-CG 3.5Å; T71-L75 PolarHBondContact O-N 2.9Å; L72-L75 PolarHBondContact O-N 3.41Å; L75-R77 VanDerWaalsContact C-N 3.31Å; L75-R77 PolarHBondContact O-N 3.44Å; L75-S78 PolarHBondContact O-N 3.46Å; L75-Q79 WeakPolarHBondContact O-CB 3.47Å; L75-Q79 VanDerWaalsContact O-CG 3.24Å; L75-Q79 WeakPolarHBondContact O-CG 3.34Å; L75-Q79 PolarHBondContact O-N 2.94Å
76V58.8Low57.5Low19 Ų1996.7 Ų96.712%0.11547%0.474CS..Hα-helixtrans-60.4-41.6175.6171.70000110.8L72 Q79 L80 I95 F151L72-V76 WeakPolarHBondContact O-CB 3.36Å; L72-V76 VanDerWaalsContact O-CG2 3.29Å; L72-V76 WeakPolarHBondContact O-CG2 3.17Å; L72-V76 PolarHBondContact O-N 3.01Å; V76-Q79 PolarHBondContact O-N 2.9Å; V76-L80 HydrophobicContact CG1-CD1 3.77Å; V76-L80 HydrophobicContact CG1-CG 4.34Å; V76-L80 WeakPolarHBondContact O-CB 3.02Å; V76-L80 VanDerWaalsContact O-CG 3.27Å; V76-L80 WeakPolarHBondContact O-CG 3.19Å; V76-L80 PolarHBondContact O-N 3.5Å; V76-I95 HydrophobicContact CG2-CD1 4.15Å; V76-I95 HydrophobicContact CG2-CG2 4.06Å; V76-F151 HydrophobicContact CG1-CE1 4.48Å
77R56.3Low56.6Low165 Ų16595.3 Ų95.362%0.62349%0.486SS*.Hα-helixtrans-64.7-41.7175.6-176.4178.7177.9179.1-0.4112.6A73 L74 L75 Q79 L80 N81A73-R77 VanDerWaalsContact O-CB 3.3Å; A73-R77 WeakPolarHBondContact O-CB 3.41Å; A73-R77 PolarHBondContact O-N 3.3Å; L74-R77 PolarHBondContact O-N 3.28Å; L75-R77 VanDerWaalsContact C-N 3.31Å; L75-R77 PolarHBondContact O-N 3.44Å; R77-Q79 VanDerWaalsContact C-N 3.35Å; R77-L80 PolarHBondContact O-N 3.23Å; R77-N81 PolarHBondContact O-N 3.48Å
78S58.6Low56Low61 Ų6194.4 Ų94.443%0.42748%0.482SS..Hα-helixtrans-62.3-46.2176.5-169.10000110.4L74 L75 L80 N81 D82L74-S78 WeakPolarHBondContact O-CB 3.5Å; L74-S78 PolarHBondContact O-N 2.86Å; L75-S78 PolarHBondContact O-N 3.46Å; S78-L80 PolarHBondContact O-N 2.85Å; S78-N81 PolarHBondContact O-N 3.39Å; S78-D82 PolarHBondContact O-N 3.22Å; S78-D82 VanDerWaalsContact O-N 3.13Å
79Q52.4Low55Low118 Ų11895.2 Ų95.255%0.55150%0.496SS*.Hα-helixtrans-62.1-43.7176-65.6-71.2-45.300110.6L75 V76 R77 N81 D82 I84L75-Q79 WeakPolarHBondContact O-CB 3.47Å; L75-Q79 VanDerWaalsContact O-CG 3.24Å; L75-Q79 WeakPolarHBondContact O-CG 3.34Å; L75-Q79 PolarHBondContact O-N 2.94Å; V76-Q79 PolarHBondContact O-N 2.9Å; R77-Q79 VanDerWaalsContact C-N 3.35Å; Q79-N81 VanDerWaalsContact C-N 3.27Å; Q79-N81 PolarHBondContact O-N 2.91Å; Q79-D82 CarbonylContact O-C 3.53Å; Q79-D82 PolarHBondContact O-N 3.41Å; Q79-D82 VanDerWaalsContact O-O 3.06Å; Q79-I84 VanDerWaalsContact C-CG1 3.45Å; Q79-I84 HydrophobicContact CB-CD1 3.95Å; Q79-I84 HydrophobicContact CB-CG1 4.42Å; Q79-I84 WeakPolarHBondContact O-CG1 3.28Å
80L51.8Low54.3Low95 Ų9597.1 Ų97.150%0.49752%0.515SS..Hα-helixtrans-63.5-28.9178.6-79167.1000113.8V76 R77 S78 I84 I92V76-L80 HydrophobicContact CG1-CD1 3.77Å; V76-L80 HydrophobicContact CG1-CG 4.34Å; V76-L80 WeakPolarHBondContact O-CB 3.02Å; V76-L80 VanDerWaalsContact O-CG 3.27Å; V76-L80 WeakPolarHBondContact O-CG 3.19Å; V76-L80 PolarHBondContact O-N 3.5Å; R77-L80 PolarHBondContact O-N 3.23Å; S78-L80 PolarHBondContact O-N 2.85Å; L80-I84 HydrophobicContact CB-CD1 4.43Å; L80-I84 HydrophobicContact CD2-CD1 3.78Å; L80-I84 HydrophobicContact CG-CD1 3.97Å; L80-I92 HydrophobicContact CD2-CD1 4.32Å
81N55.2Low53.5Low121 Ų12191.8 Ų91.865%0.64750%0.498SS*.Hα-helixtrans-81.1-28.6176.8-83.3-12.6000112.8R77 S78 Q79 D83R77-N81 PolarHBondContact O-N 3.48Å; S78-N81 PolarHBondContact O-N 3.39Å; Q79-N81 VanDerWaalsContact C-N 3.27Å; Q79-N81 PolarHBondContact O-N 2.91Å; N81-D83 PolarHBondContact O-N 2.94Å
82D55.1Low53Low114 Ų11490.5 Ų90.561%0.6149%0.488SS*.SBendtrans-9180174.1-68.8-29.7000108.9S78 Q79 I84S78-D82 PolarHBondContact O-N 3.22Å; S78-D82 VanDerWaalsContact O-N 3.13Å; Q79-D82 CarbonylContact O-C 3.53Å; Q79-D82 PolarHBondContact O-N 3.41Å; Q79-D82 VanDerWaalsContact O-O 3.06Å; D82-I84 PolarHBondContact O-N 2.86Å
83D48.6Very low52.3Low156 Ų15690.9 Ų90.983%0.83449%0.493SS*.  trans20.968.3169.5-81-33.7000114.5N81 P85N81-D83 PolarHBondContact O-N 2.94Å; D83-P85 WeakPolarHBondContact O-CD 3.47Å
84I43.6Very low52Low46 Ų4691.3 Ų91.324%0.23650%0.497CS..  trans-62.1114.7172.2-57.6-169.3000106.3Q79 L80 D82 R86 H88Q79-I84 VanDerWaalsContact C-CG1 3.45Å; Q79-I84 HydrophobicContact CB-CD1 3.95Å; Q79-I84 HydrophobicContact CB-CG1 4.42Å; Q79-I84 WeakPolarHBondContact O-CG1 3.28Å; L80-I84 HydrophobicContact CB-CD1 4.43Å; L80-I84 HydrophobicContact CD2-CD1 3.78Å; L80-I84 HydrophobicContact CG-CD1 3.97Å; D82-I84 PolarHBondContact O-N 2.86Å; I84-R86 PolarHBondContact O-N 2.98Å; I84-H88 HydrophobicContact CG2-CB 3.55Å
85P46.1Very low51.5Low85 Ų8589.2 Ų89.255%0.55249%0.486SS*.  trans-59.3132.1173.420.5-25.1000107D83 G87 H88D83-P85 WeakPolarHBondContact O-CD 3.47Å; P85-G87 PolarHBondContact O-N 3.17Å; P85-H88 PolarHBondContact O-CD2 3.22Å; P85-H88 PolarHBondContact O-N 2.92Å
86R46.1Very low51.2Low250 Ų25086.9 Ų86.994%0.94347%0.472SS*.THydrogen-bonded Turntrans-52.23.2-171.2-69.4179.5171.9-179.9-3.1116I84I84-R86 PolarHBondContact O-N 2.98Å
87G44.9Very low51Low64 Ų6493.7 Ų93.766%0.6650%0.496SS*.THydrogen-bonded Turntrans-91.70174.800000117P85P85-G87 PolarHBondContact O-N 3.17Å
88H48.7Very low51Low86 Ų8690.1 Ų90.140%0.39849%0.485SS..THydrogen-bonded Turntrans-9518.2-178.5-71.2-78.2000115.5I84 P85 S90 T91 I92I84-H88 HydrophobicContact CG2-CB 3.55Å; P85-H88 PolarHBondContact O-CD2 3.22Å; P85-H88 PolarHBondContact O-N 2.92Å; H88-S90 PolarHBondContact O-N 3.42Å; H88-S90 VanDerWaalsContact O-N 3.09Å; H88-T91 PolarHBondContact ND1-OG1 2.83Å; H88-T91 WeakPolarHBondContact O-CA 3.24Å; H88-T91 WeakPolarHBondContact O-CB 3.25Å; H88-T91 PolarHBondContact O-N 3.35Å; H88-I92 PolarHBondContact O-N 3.47Å
89C43.7Very low50.9Low93 Ų9388.2 Ų88.263%0.62847%0.471SS*.Hα-helixtrans-54.9-29.3173.4-65.80000112.5T91 I92 S93C89-T91 VanDerWaalsContact C-N 3.34Å; C89-T91 PolarHBondContact O-N 2.97Å; C89-I92 PolarHBondContact O-N 3.45Å; C89-S93 WeakPolarHBondContact O-CB 3.29Å; C89-S93 PolarHBondContact O-N 3.05Å
90S49.4Very low51.2Low86 Ų8687.5 Ų87.560%0.60147%0.47SS*.Hα-helixtrans-64-36.3172.661.90000112.9H88 A94H88-S90 PolarHBondContact O-N 3.42Å; H88-S90 VanDerWaalsContact O-N 3.09Å; S90-A94 VanDerWaalsContact O-CB 3.23Å; S90-A94 WeakPolarHBondContact O-CB 3.41Å; S90-A94 PolarHBondContact O-N 2.92Å
91T50.7Low51.5Low32 Ų3292.1 Ų92.120%0.19648%0.481CS..Hα-helixtrans-70.6-43.8177.9-50.70000111H88 C89 A94 I95H88-T91 PolarHBondContact ND1-OG1 2.83Å; H88-T91 WeakPolarHBondContact O-CA 3.24Å; H88-T91 WeakPolarHBondContact O-CB 3.25Å; H88-T91 PolarHBondContact O-N 3.35Å; C89-T91 VanDerWaalsContact C-N 3.34Å; C89-T91 PolarHBondContact O-N 2.97Å; T91-A94 PolarHBondContact O-N 3.42Å; T91-I95 HydrophobicContact CG2-CD1 4.03Å; T91-I95 WeakPolarHBondContact O-CB 2.97Å; T91-I95 VanDerWaalsContact O-CG1 3.23Å; T91-I95 WeakPolarHBondContact O-CG1 3.38Å; T91-I95 PolarHBondContact O-N 2.9Å
92I51.7Low51.5Low50 Ų5087.6 Ų87.626%0.25646%0.459SS..Hα-helixtrans-62.7-46.3175.6-62.3176.2000110L80 H88 C89 A94 I95 Q96L80-I92 HydrophobicContact CD2-CD1 4.32Å; H88-I92 PolarHBondContact O-N 3.47Å; C89-I92 PolarHBondContact O-N 3.45Å; I92-A94 VanDerWaalsContact C-N 3.33Å; I92-A94 PolarHBondContact O-N 3.45Å; I92-I95 PolarHBondContact O-N 3.49Å; I92-Q96 WeakPolarHBondContact O-CG 3.29Å; I92-Q96 PolarHBondContact O-N 3.46Å
93S52.4Low51.5Low38 Ų3883.1 Ų83.127%0.26644%0.436SS..Hα-helixtrans-62.2-38.8176.1-168.80000112.4C89 Q96 R97C89-S93 WeakPolarHBondContact O-CB 3.29Å; C89-S93 PolarHBondContact O-N 3.05Å; S93-Q96 PolarHBondContact O-N 2.67Å; S93-R97 VanDerWaalsContact O-CG 3.32Å; S93-R97 WeakPolarHBondContact O-CG 3.36Å; S93-R97 PolarHBondContact O-N 3.33Å
94A53Low52Low48 Ų4878.5 Ų78.540%0.39742%0.419SS..Hα-helixtrans-64.1-43.817500000111.9S90 T91 I92 Q96 R97 F98S90-A94 VanDerWaalsContact O-CB 3.23Å; S90-A94 WeakPolarHBondContact O-CB 3.41Å; S90-A94 PolarHBondContact O-N 2.92Å; T91-A94 PolarHBondContact O-N 3.42Å; I92-A94 VanDerWaalsContact C-N 3.33Å; I92-A94 PolarHBondContact O-N 3.45Å; A94-Q96 VanDerWaalsContact C-N 3.34Å; A94-Q96 PolarHBondContact O-N 2.91Å; A94-R97 PolarHBondContact O-N 3Å; A94-F98 WeakPolarHBondContact O-CB 3.25Å; A94-F98 PolarHBondContact O-N 3.38Å
95I53.4Low52.6Low49 Ų4981.6 Ų81.625%0.25143%0.431SS..Hα-helixtrans-62.7-41.9176.2-68.9166.4000110.3L72 V76 T91 I92 F98 T99L72-I95 HydrophobicContact CD1-CG2 4.03Å; L72-I95 HydrophobicContact CD2-CG2 3.97Å; L72-I95 HydrophobicContact CG-CG2 4.08Å; V76-I95 HydrophobicContact CG2-CD1 4.15Å; V76-I95 HydrophobicContact CG2-CG2 4.06Å; T91-I95 HydrophobicContact CG2-CD1 4.03Å; T91-I95 WeakPolarHBondContact O-CB 2.97Å; T91-I95 VanDerWaalsContact O-CG1 3.23Å; T91-I95 WeakPolarHBondContact O-CG1 3.38Å; T91-I95 PolarHBondContact O-N 2.9Å; I92-I95 PolarHBondContact O-N 3.49Å; I95-F98 PolarHBondContact O-N 2.88Å; I95-T99 VanDerWaalsContact O-CB 3.27Å; I95-T99 WeakPolarHBondContact O-CB 3.41Å; I95-T99 PolarHBondContact O-N 3.34Å; I95-T99 PolarHBondContact O-OG1 2.88Å
96Q54.7Low52.9Low48 Ų4879.2 Ų79.222%0.22442%0.415CS..Hα-helixtrans-61.7-48.4175.5-74.4176.1-27.700112.3I92 S93 A94 F98 T99 L100 C155I92-Q96 WeakPolarHBondContact O-CG 3.29Å; I92-Q96 PolarHBondContact O-N 3.46Å; S93-Q96 PolarHBondContact O-N 2.67Å; A94-Q96 VanDerWaalsContact C-N 3.34Å; A94-Q96 PolarHBondContact O-N 2.91Å; Q96-F98 VanDerWaalsContact C-N 3.31Å; Q96-F98 PolarHBondContact O-N 3.41Å; Q96-T99 WeakPolarHBondContact O-CB 3.33Å; Q96-T99 PolarHBondContact O-N 2.9Å; Q96-L100 WeakPolarHBondContact O-CB 3.3Å; Q96-L100 WeakPolarHBondContact O-CG 3.29Å; Q96-L100 PolarHBondContact O-N 3.19Å; Q96-C155 PolarHBondContact NE2-SG 2.96Å
97R54.5Low53.4Low163 Ų16373.4 Ų73.462%0.61540%0.397SS*.Hα-helixtrans-62.2-40.9178.1-71.5175.6-171.2-172.42.2111.5S93 A94 R101S93-R97 VanDerWaalsContact O-CG 3.32Å; S93-R97 WeakPolarHBondContact O-CG 3.36Å; S93-R97 PolarHBondContact O-N 3.33Å; A94-R97 PolarHBondContact O-N 3Å; R97-R101 WeakPolarHBondContact O-CB 3.22Å; R97-R101 VanDerWaalsContact O-CG 3.23Å; R97-R101 WeakPolarHBondContact O-CG 3.49Å; R97-R101 PolarHBondContact O-N 2.85Å
98F55.9Low54Low90 Ų9078.5 Ų78.540%0.39540%0.396SS..Hα-helixtrans-63.1-46.6175.6-177-95.9000111.3F68 A94 I95 Q96 R101 S102F68-F98 AromaticContact CZ-CE1 4Å; F68-F98 HydrophobicContact CZ-CE1 4Å; A94-F98 WeakPolarHBondContact O-CB 3.25Å; A94-F98 PolarHBondContact O-N 3.38Å; I95-F98 PolarHBondContact O-N 2.88Å; Q96-F98 VanDerWaalsContact C-N 3.31Å; Q96-F98 PolarHBondContact O-N 3.41Å; F98-R101 PolarHBondContact O-N 2.87Å; F98-S102 WeakPolarHBondContact O-CB 3.47Å; F98-S102 PolarHBondContact O-N 2.88Å; F98-S102 PolarHBondContact O-OG 3.49Å
99T57.8Low54.2Low20 Ų2079.1 Ų79.112%0.12340%0.399CS..Hα-helixtrans-57.2-52176.4-60.90000111.2F69 L72 I95 Q96 R101 S102 T103F69-T99 HydrophobicContact CD1-CG2 3.64Å; F69-T99 HydrophobicContact CE1-CG2 3.2Å; F69-T99 HydrophobicContact CZ-CG2 4.15Å; L72-T99 WeakPolarHBondContact CD2-OG1 3.42Å; I95-T99 VanDerWaalsContact O-CB 3.27Å; I95-T99 WeakPolarHBondContact O-CB 3.41Å; I95-T99 PolarHBondContact O-N 3.34Å; I95-T99 PolarHBondContact O-OG1 2.88Å; Q96-T99 WeakPolarHBondContact O-CB 3.33Å; Q96-T99 PolarHBondContact O-N 2.9Å; T99-R101 PolarHBondContact O-N 3.31Å; T99-S102 PolarHBondContact O-N 3.25Å; T99-T103 WeakPolarHBondContact O-CB 3.33Å; T99-T103 PolarHBondContact O-N 2.83Å; T99-T103 PolarHBondContact O-OG1 2.89Å
100L58.2Low54.6Low104 Ų10476.7 Ų76.755%0.54539%0.386SS..Hα-helixtrans-61.9-43.5179.6-73.5171.3000111.9Q96 T103 A104Q96-L100 WeakPolarHBondContact O-CB 3.3Å; Q96-L100 WeakPolarHBondContact O-CG 3.29Å; Q96-L100 PolarHBondContact O-N 3.19Å; L100-T103 PolarHBondContact O-N 3.49Å; L100-A104 WeakPolarHBondContact O-CB 3.48Å; L100-A104 PolarHBondContact O-N 2.7Å
101R58.1Low54.8Low191 Ų19180 Ų8072%0.72139%0.385SS*.Hα-helixtrans-65.3-43.6177.9-75.4177178.8-170.8-0.3112.2R97 F98 T99 A104 F105R97-R101 WeakPolarHBondContact O-CB 3.22Å; R97-R101 VanDerWaalsContact O-CG 3.23Å; R97-R101 WeakPolarHBondContact O-CG 3.49Å; R97-R101 PolarHBondContact O-N 2.85Å; F98-R101 PolarHBondContact O-N 2.87Å; T99-R101 PolarHBondContact O-N 3.31Å; R101-A104 PolarHBondContact O-N 3.49Å; R101-F105 WeakPolarHBondContact O-CB 3.42Å; R101-F105 PolarHBondContact O-N 3.15Å
102S54.2Low54.8Low27 Ų2782.3 Ų82.319%0.18940%0.396CS..Hα-helixtrans-64.8-41.6176.9-64.30000111.2F98 T99 F105 V106F98-S102 WeakPolarHBondContact O-CB 3.47Å; F98-S102 PolarHBondContact O-N 2.88Å; F98-S102 PolarHBondContact O-OG 3.49Å; T99-S102 PolarHBondContact O-N 3.25Å; S102-F105 PolarHBondContact O-N 3.45Å; S102-V106 WeakPolarHBondContact O-CG2 3.45Å; S102-V106 PolarHBondContact O-N 3.37Å
103T56.4Low54.6Low20 Ų2084.1 Ų84.112%0.12341%0.407CS..Hα-helixtrans-59.4-51.2174.2-52.20000111F69 T99 L100 F105 V106 F107F69-T103 WeakPolarHBondContact CZ-OG1 3.43Å; T99-T103 WeakPolarHBondContact O-CB 3.33Å; T99-T103 PolarHBondContact O-N 2.83Å; T99-T103 PolarHBondContact O-OG1 2.89Å; L100-T103 PolarHBondContact O-N 3.49Å; T103-F105 VanDerWaalsContact C-N 3.31Å; T103-F105 PolarHBondContact O-N 2.88Å; T103-V106 PolarHBondContact O-N 3.41Å; T103-F107 HydrophobicContact CG2-CD2 3.56Å; T103-F107 HydrophobicContact CG2-CE2 3.37Å; T103-F107 WeakPolarHBondContact O-CD2 3.34Å; T103-F107 PolarHBondContact O-N 2.98Å
104A58.7Low54.3Low59 Ų5988.8 Ų88.849%0.48842%0.424SS..Hα-helixtrans-61.2-38.8178.800000112.4L100 R101 R108L100-A104 WeakPolarHBondContact O-CB 3.48Å; L100-A104 PolarHBondContact O-N 2.7Å; R101-A104 PolarHBondContact O-N 3.49Å; A104-R108 VanDerWaalsContact O-CB 3.29Å; A104-R108 WeakPolarHBondContact O-CB 3.38Å; A104-R108 PolarHBondContact O-N 3.42Å
105F54.9Low54Low111 Ų11190.8 Ų90.849%0.48744%0.436SS..Hα-helixtrans-62-45.2175.1179-97.9000111.7R101 S102 T103 R108 Q109R101-F105 WeakPolarHBondContact O-CB 3.42Å; R101-F105 PolarHBondContact O-N 3.15Å; S102-F105 PolarHBondContact O-N 3.45Å; T103-F105 VanDerWaalsContact C-N 3.31Å; T103-F105 PolarHBondContact O-N 2.88Å; F105-R108 PolarHBondContact O-N 3Å; F105-Q109 VanDerWaalsContact CE1-CD 3.47Å; F105-Q109 HydrophobicContact CE1-CG 4.17Å; F105-Q109 HydrophobicContact CZ-CG 4.28Å; F105-Q109 PolarHBondContact O-N 3.43Å
106V52.4Low53.8Low35 Ų3592.9 Ų92.921%0.21245%0.454CS..Hα-helixtrans-69.5-40.5179.3-177.20000111.9V61 I65 S102 T103 R108 Q109 A110V61-V106 HydrophobicContact CG1-CG1 4.08Å; I65-V106 HydrophobicContact CD1-CB 4.1Å; I65-V106 HydrophobicContact CD1-CG1 3.21Å; I65-V106 HydrophobicContact CD1-CG2 4.4Å; I65-V106 HydrophobicContact CG1-CG1 4.05Å; I65-V106 HydrophobicContact CG1-CG2 4.41Å; S102-V106 WeakPolarHBondContact O-CG2 3.45Å; S102-V106 PolarHBondContact O-N 3.37Å; T103-V106 PolarHBondContact O-N 3.41Å; V106-R108 VanDerWaalsContact C-N 3.28Å; V106-R108 PolarHBondContact O-N 3.36Å; V106-Q109 PolarHBondContact O-N 3.33Å; V106-A110 PolarHBondContact O-N 3.26Å
107F56.8Low53.2Low128 Ų12895.8 Ų95.856%0.56148%0.475SS*.Hα-helixtrans-63-36.7173.7-82.2-67.4000112.4T103 A110 R111T103-F107 HydrophobicContact CG2-CD2 3.56Å; T103-F107 HydrophobicContact CG2-CE2 3.37Å; T103-F107 WeakPolarHBondContact O-CD2 3.34Å; T103-F107 PolarHBondContact O-N 2.98Å; F107-A110 PolarHBondContact O-N 2.86Å; F107-R111 WeakPolarHBondContact O-CB 3.35Å; F107-R111 PolarHBondContact O-N 3.47Å
108R58.4Low52.7Low171 Ų17192.8 Ų92.865%0.64548%0.479SS*.Hα-helixtrans-64.2-44.7173.7-175.1176.7176.5172.41.8111.5A104 F105 V106 A110 R111 D112A104-R108 VanDerWaalsContact O-CB 3.29Å; A104-R108 WeakPolarHBondContact O-CB 3.38Å; A104-R108 PolarHBondContact O-N 3.42Å; F105-R108 PolarHBondContact O-N 3Å; V106-R108 VanDerWaalsContact C-N 3.28Å; V106-R108 PolarHBondContact O-N 3.36Å; R108-A110 VanDerWaalsContact C-N 3.34Å; R108-A110 PolarHBondContact O-N 2.98Å; R108-R111 PolarHBondContact O-N 3.36Å; R108-D112 IonicContact NE-OD2 3.89Å; R108-D112 VanDerWaalsContact O-CG 3.3Å; R108-D112 PolarHBondContact O-N 2.85Å
109Q52.6Low51.8Low98 Ų9893.9 Ų93.946%0.45850%0.498SS..Hα-helixtrans-61.1-42.3175.2-75.9-169.3-20.100112.3F105 V106 R111 D112 D113F105-Q109 VanDerWaalsContact CE1-CD 3.47Å; F105-Q109 HydrophobicContact CE1-CG 4.17Å; F105-Q109 HydrophobicContact CZ-CG 4.28Å; F105-Q109 PolarHBondContact O-N 3.43Å; V106-Q109 PolarHBondContact O-N 3.33Å; Q109-R111 VanDerWaalsContact C-N 3.27Å; Q109-R111 PolarHBondContact O-N 3.43Å; Q109-D112 PolarHBondContact O-N 3.38Å; Q109-D113 PolarHBondContact O-N 3.02Å
110A52.4Low50.9Low43 Ų4398.4 Ų98.436%0.35553%0.531SS..Hα-helixtrans-61.1-38.1175.500000112.1V106 F107 R108 E114V106-A110 PolarHBondContact O-N 3.26Å; F107-A110 PolarHBondContact O-N 2.86Å; R108-A110 VanDerWaalsContact C-N 3.34Å; R108-A110 PolarHBondContact O-N 2.98Å; A110-E114 PolarHBondContact O-N 3.28Å
111R52.5Low49.9Very low155 Ų15598.2 Ų98.259%0.58554%0.538SS*.Hα-helixtrans-71.1-41.7176.5-175.1-179.9176.4177.7-0.4112.8F107 R108 Q109 D113 E114 S115F107-R111 WeakPolarHBondContact O-CB 3.35Å; F107-R111 PolarHBondContact O-N 3.47Å; R108-R111 PolarHBondContact O-N 3.36Å; Q109-R111 VanDerWaalsContact C-N 3.27Å; Q109-R111 PolarHBondContact O-N 3.43Å; R111-D113 VanDerWaalsContact C-N 3.29Å; R111-D113 PolarHBondContact O-N 2.68Å; R111-E114 PolarHBondContact O-N 3.4Å; R111-S115 WeakPolarHBondContact O-CB 3.33Å; R111-S115 PolarHBondContact O-N 2.84Å
112D50.8Low48.7Very low80 Ų8094.2 Ų94.243%0.42855%0.546SS..Hα-helixtrans-65.1-37.7179.1-69.6-17.9000110.1R108 Q109 S115 S116R108-D112 IonicContact NE-OD2 3.89Å; R108-D112 VanDerWaalsContact O-CG 3.3Å; R108-D112 PolarHBondContact O-N 2.85Å; Q109-D112 PolarHBondContact O-N 3.38Å; D112-S115 WeakPolarHBondContact CA-OG 3.11Å; D112-S115 PolarHBondContact O-N 3.49Å; D112-S115 PolarHBondContact O-OG 2.82Å; D112-S116 PolarHBondContact O-N 3.42Å
113D48.4Very low48Very low89 Ų89101.9 Ų101.948%0.47658%0.576SS.*Hα-helixtrans-63.6-42.7172.5-78.6-12.1000112.2Q109 R111 S115 S116Q109-D113 PolarHBondContact O-N 3.02Å; R111-D113 VanDerWaalsContact C-N 3.29Å; R111-D113 PolarHBondContact O-N 2.68Å; D113-S115 VanDerWaalsContact C-N 3.35Å; D113-S115 PolarHBondContact O-N 3.23Å; D113-S116 PolarHBondContact O-N 2.89Å; D113-S116 PolarHBondContact O-OG 3.31Å
114E46.5Very low47Very low135 Ų135109 Ų10963%0.63161%0.608SS**Hα-helixtrans-65.4-35.6173.9-82.5-174167.100112.7A110 R111 S116 V117A110-E114 PolarHBondContact O-N 3.28Å; R111-E114 PolarHBondContact O-N 3.4Å; E114-S116 PolarHBondContact O-N 3.01Å; E114-V117 PolarHBondContact O-N 3.34Å; E114-V117 VanDerWaalsContact O-N 3.15Å
115S46.8Very low46Very low91 Ų91109.4 Ų109.464%0.63661%0.605SS**Hα-helixtrans-68.9-18.1179.6750000113.9R111 D112 D113R111-S115 WeakPolarHBondContact O-CB 3.33Å; R111-S115 PolarHBondContact O-N 2.84Å; D112-S115 WeakPolarHBondContact CA-OG 3.11Å; D112-S115 PolarHBondContact O-N 3.49Å; D112-S115 PolarHBondContact O-OG 2.82Å; D113-S115 VanDerWaalsContact C-N 3.35Å; D113-S115 PolarHBondContact O-N 3.23Å
116S48.3Very low45.1Very low92 Ų92113.5 Ų113.564%0.64362%0.623SS**THydrogen-bonded Turntrans-85.4-9.2175.274.30000113.8D112 D113 E114 S118D112-S116 PolarHBondContact O-N 3.42Å; D113-S116 PolarHBondContact O-N 2.89Å; D113-S116 PolarHBondContact O-OG 3.31Å; E114-S116 PolarHBondContact O-N 3.01Å; S116-S118 PolarHBondContact O-N 3.35Å
117V41.9Very low44Very low109 Ų109120.5 Ų120.566%0.66165%0.651SS**SBendtrans-92.999.4172.6-173.20000108.2E114 S119E114-V117 PolarHBondContact O-N 3.34Å; E114-V117 VanDerWaalsContact O-N 3.15Å; V117-S119 PolarHBondContact O-N 3.43Å
118S43.6Very low42.8Very low100 Ų100119.4 Ų119.470%0.69965%0.65SS**  trans-51.2122-177.752.80000114.2S116S116-S118 PolarHBondContact O-N 3.35Å
119S38.3Very low41.4Very low113 Ų113117.3 Ų117.379%0.7966%0.656SS**  trans51.978.5137.367.30000118.4V117V117-S119 PolarHBondContact O-N 3.43Å
120S38.6Very low40.2Very low116 Ų116115.7 Ų115.781%0.81167%0.665SS**SBendtrans-163.9131.7136.459.30000109.8
121S37.1Very low39.2Very low100 Ų100119 Ų11970%0.69969%0.686SS**  trans69.487.1177.4-171.20000116K123S121-K123 PolarHBondContact O-N 3.13Å
122A32.4Very low38.4Very low107 Ų107118.4 Ų118.488%0.88470%0.699SS**  trans-46108.9160.200000111.2
123K40.3Very low37.6Very low187 Ų187120.7 Ų120.781%0.81371%0.711SS**  trans-114.2122.1158.1-80.5-176.2176.2-179.90106.7S121S121-K123 PolarHBondContact O-N 3.13Å
124E35.9Very low36.9Very low171 Ų171123.8 Ų123.880%0.79973%0.728SS**  trans-56.1145.2-174.3-65.7174.1142.900111.3F126E124-F126 PolarHBondContact O-N 3.33Å; E124-F126 VanDerWaalsContact O-N 3.14Å
125P37.5Very low36.4Very low67 Ų67120.8 Ų120.844%0.43573%0.733SS.*  trans-61.6119.7173.525.9-31.9000108.6F127P125-F127 WeakPolarHBondContact O-CD2 3.27Å; P125-F127 PolarHBondContact O-N 2.9Å
126F35Very low35.8Very low197 Ų197122.4 Ų122.486%0.86474%0.74SS**  trans-50.7105.8177.1-90.6-98.3000110.6E124 I128E124-F126 PolarHBondContact O-N 3.33Å; E124-F126 VanDerWaalsContact O-N 3.14Å; F126-I128 PolarHBondContact O-N 3.44Å
127F29.7Very low35.5Very low181 Ų181127.2 Ų127.279%0.79475%0.749SS**  trans-69.9102.7160.3-77.9-90.9000107P125 V129P125-F127 WeakPolarHBondContact O-CD2 3.27Å; P125-F127 PolarHBondContact O-N 2.9Å; F127-V129 PolarHBondContact O-N 3.47Å
128I32.3Very low35.1Very low105 Ų105129.6 Ų129.654%0.53875%0.753SS.*  trans-77.675.3170.6-57.4-179.6000107.3F126 H145F126-I128 PolarHBondContact O-N 3.44Å; I128-H145 WeakPolarHBondContact CG2-NE2 3.24Å
129V29.5Very low35Very low127 Ų127128.7 Ų128.777%0.7774%0.743SS**  trans-139.4105.2166.7-179.10000107F127F127-V129 PolarHBondContact O-N 3.47Å
130G26.5Very low35Very low64 Ų64129.7 Ų129.766%0.6674%0.74SS**  trans74.2102.1155.400000118.3
131S32.1Very low35.1Very low112 Ų112130.5 Ų130.578%0.78373%0.731SS**  trans-171.7105.3135.234.80000106.2
132V34.6Very low35Very low143 Ų143127.5 Ų127.587%0.86771%0.71SS**  50.6109.185.5-170.40000110.5
133D33.3Very low35.2Very low128 Ų128124.4 Ų124.468%0.68468%0.684SS**  trans-56.3120.4-171.1-141.4-21.7000112.5
134D35.2Very low35.2Very low155 Ų155118.2 Ų118.283%0.82966%0.662SS**  trans-119.762.8164.8-99.4-20.2000109.7T136D134-T136 VanDerWaalsContact C-N 3.34Å; D134-T136 PolarHBondContact O-N 3.23Å; D134-T136 PolarHBondContact O-OG1 3.29Å
135G34.9Very low35.6Very low71 Ų71114.5 Ų114.573%0.73264%0.644SS**SBendtrans64.35.3139.100000120.9
136T35Very low35.6Very low126 Ų126117 Ų11777%0.77365%0.645SS**SBendtrans-145.5123.2-177.149.50000114.7D134D134-T136 VanDerWaalsContact C-N 3.34Å; D134-T136 PolarHBondContact O-N 3.23Å; D134-T136 PolarHBondContact O-OG1 3.29Å
137K41Very low35.8Very low192 Ų192111 Ų11184%0.83563%0.627SS**  trans58.398173.7-63.3-177.1-178.5178.80115.7T139K137-T139 PolarHBondContact O-N 2.89Å
138Q34Very low36.5Very low160 Ų160105.7 Ų105.775%0.74861%0.606SS**  trans-6097.2166.4-69.8-179.1400110.1
139T41.3Very low36.8Very low80 Ų80107.2 Ų107.249%0.49161%0.609SS.*  trans-81.1148.3165.351.30000108.9K137 E141 S142K137-T139 PolarHBondContact O-N 2.89Å; T139-E141 PolarHBondContact O-N 3.41Å; T139-S142 WeakPolarHBondContact O-CB 3.35Å; T139-S142 PolarHBondContact O-N 3.11Å; T139-S142 PolarHBondContact O-OG 3.38Å
140D39.6Very low37.1Very low135 Ų135105.7 Ų105.772%0.72260%0.596SS**Hα-helixtrans-53.7-20.2179.8-69.5-47.4000113.4S142 A143 V144D140-S142 VanDerWaalsContact C-N 3.3Å; D140-S142 PolarHBondContact O-N 2.94Å; D140-A143 PolarHBondContact O-N 2.98Å; D140-V144 PolarHBondContact O-N 3.41Å
141E40Very low37.6Very low133 Ų133106.6 Ų106.662%0.62158%0.582SS**Hα-helixtrans-60.7-36.6172.5-63.8178.3168.700112.1T139 A143 V144 H145T139-E141 PolarHBondContact O-N 3.41Å; E141-A143 VanDerWaalsContact C-N 3.3Å; E141-A143 PolarHBondContact O-N 2.89Å; E141-V144 PolarHBondContact O-N 3.49Å; E141-H145 WeakPolarHBondContact O-CB 2.96Å; E141-H145 PolarHBondContact O-N 2.99Å
142S35.5Very low37.7Very low37 Ų37104.6 Ų104.626%0.25957%0.568SS.*Hα-helixtrans-66.1-30.3175.572.60000112.9T139 D140 R146T139-S142 WeakPolarHBondContact O-CB 3.35Å; T139-S142 PolarHBondContact O-N 3.11Å; T139-S142 PolarHBondContact O-OG 3.38Å; D140-S142 VanDerWaalsContact C-N 3.3Å; D140-S142 PolarHBondContact O-N 2.94Å; S142-R146 VanDerWaalsContact O-CB 3.32Å; S142-R146 WeakPolarHBondContact O-CB 3.27Å; S142-R146 WeakPolarHBondContact O-CG 3.23Å; S142-R146 PolarHBondContact O-N 3.37Å
143A35.9Very low37.7Very low41 Ų41103.5 Ų103.534%0.33955%0.551SS.*Hα-helixtrans-74.5-41.6179.800000111.5D140 E141 H145 R146 C147D140-A143 PolarHBondContact O-N 2.98Å; E141-A143 VanDerWaalsContact C-N 3.3Å; E141-A143 PolarHBondContact O-N 2.89Å; A143-H145 VanDerWaalsContact C-N 3.31Å; A143-R146 PolarHBondContact O-N 2.88Å; A143-C147 WeakPolarHBondContact O-CB 3.23Å; A143-C147 PolarHBondContact O-N 3.28Å; A143-C147 PolarHBondContact O-SG 3.23Å; A143-C147 VanDerWaalsContact O-SG 3.41Å
144V41.4Very low37.8Very low58 Ų58102.7 Ų102.735%0.35255%0.546SS..Hα-helixtrans-63.8-41.2173.2179.10000110.1F66 D140 E141 C147 L148F66-V144 HydrophobicContact CD2-CG2 4.24Å; D140-V144 PolarHBondContact O-N 3.41Å; E141-V144 PolarHBondContact O-N 3.49Å; V144-C147 PolarHBondContact O-N 3.49Å; V144-L148 HydrophobicContact CG1-CD1 3.97Å; V144-L148 WeakPolarHBondContact O-CB 3.34Å; V144-L148 WeakPolarHBondContact O-CG 3.5Å; V144-L148 PolarHBondContact O-N 2.9Å
145H42.6Very low37.7Very low93 Ų9397.2 Ų97.243%0.43152%0.52SS..Hα-helixtrans-64-42.1176.3-142.1-79.9000112.2I128 E141 A143 F149I128-H145 WeakPolarHBondContact CG2-NE2 3.24Å; E141-H145 WeakPolarHBondContact O-CB 2.96Å; E141-H145 PolarHBondContact O-N 2.99Å; A143-H145 VanDerWaalsContact C-N 3.31Å; H145-F149 WeakPolarHBondContact O-CB 3.34Å; H145-F149 PolarHBondContact O-N 3.2Å
146R38.9Very low37.7Very low119 Ų119100 Ų10045%0.44952%0.518SS..Hα-helixtrans-63.8-42.9173.9-78.3171.7179.9177.21111.8S142 A143 F149 I150S142-R146 VanDerWaalsContact O-CB 3.32Å; S142-R146 WeakPolarHBondContact O-CB 3.27Å; S142-R146 WeakPolarHBondContact O-CG 3.23Å; S142-R146 PolarHBondContact O-N 3.37Å; A143-R146 PolarHBondContact O-N 2.88Å; R146-F149 PolarHBondContact O-N 3.22Å; R146-I150 WeakPolarHBondContact O-CB 3.32Å; R146-I150 WeakPolarHBondContact O-CD1 3.46Å; R146-I150 WeakPolarHBondContact O-CG1 3.45Å; R146-I150 PolarHBondContact O-N 2.78Å
147C38.5Very low37.7Very low72 Ų7298.8 Ų98.849%0.48651%0.507SS..Hα-helixtrans-62.9-49.1176.7-76.50000111.5A143 V144 F149 I150 F151A143-C147 WeakPolarHBondContact O-CB 3.23Å; A143-C147 PolarHBondContact O-N 3.28Å; A143-C147 PolarHBondContact O-SG 3.23Å; A143-C147 VanDerWaalsContact O-SG 3.41Å; V144-C147 PolarHBondContact O-N 3.49Å; C147-F149 VanDerWaalsContact C-N 3.35Å; C147-F149 PolarHBondContact O-N 3.38Å; C147-I150 PolarHBondContact O-N 2.86Å; C147-F151 VanDerWaalsContact O-CD2 3.24Å; C147-F151 WeakPolarHBondContact O-CD2 3.39Å; C147-F151 PolarHBondContact O-N 2.88Å
148L44.4Very low37.5Very low69 Ų6994 Ų9436%0.36149%0.494SS..Hα-helixtrans-62.6-40.3177.6-73.6167.7000112.1V144 F151 S152V144-L148 HydrophobicContact CG1-CD1 3.97Å; V144-L148 WeakPolarHBondContact O-CB 3.34Å; V144-L148 WeakPolarHBondContact O-CG 3.5Å; V144-L148 PolarHBondContact O-N 2.9Å; L148-F151 PolarHBondContact O-N 2.86Å; L148-S152 WeakPolarHBondContact O-CB 3.48Å; L148-S152 PolarHBondContact O-N 3.4Å; L148-S152 PolarHBondContact O-OG 2.91Å
149F38Very low37.5Very low137 Ų13792.4 Ų92.460%0.60149%0.49SS*.Hα-helixtrans-66.6-44.2177.6-169.1-92.3000112.4H145 R146 C147 F151 S152 F153H145-F149 WeakPolarHBondContact O-CB 3.34Å; H145-F149 PolarHBondContact O-N 3.2Å; R146-F149 PolarHBondContact O-N 3.22Å; C147-F149 VanDerWaalsContact C-N 3.35Å; C147-F149 PolarHBondContact O-N 3.38Å; F149-F151 VanDerWaalsContact C-N 3.35Å; F149-F151 PolarHBondContact O-N 3.34Å; F149-S152 PolarHBondContact O-N 2.92Å; F149-F153 VanDerWaalsContact O-CB 3.28Å; F149-F153 WeakPolarHBondContact O-CB 3.45Å; F149-F153 PolarHBondContact O-N 3.26Å
150I36.1Very low37.1Very low95 Ų9596.2 Ų96.249%0.48751%0.508SS..Hα-helixtrans-62.4-42.5177.2-69.8164.8000110.5R146 C147 F153 L154R146-I150 WeakPolarHBondContact O-CB 3.32Å; R146-I150 WeakPolarHBondContact O-CD1 3.46Å; R146-I150 WeakPolarHBondContact O-CG1 3.45Å; R146-I150 PolarHBondContact O-N 2.78Å; C147-I150 PolarHBondContact O-N 2.86Å; I150-F153 PolarHBondContact O-N 2.63Å; I150-L154 HydrophobicContact CG2-CD1 3.89Å; I150-L154 HydrophobicContact CG2-CG 4.45Å; I150-L154 WeakPolarHBondContact O-CB 2.92Å; I150-L154 VanDerWaalsContact O-CG 3.25Å; I150-L154 WeakPolarHBondContact O-CG 3.06Å; I150-L154 PolarHBondContact O-N 3.49Å
151F36.9Very low36.8Very low83 Ų8394.4 Ų94.436%0.36450%0.502SS..Hα-helixtrans-68.1-37.6177.4-86.8-72.9000113.1A73 V76 C147 L148 F149 C155A73-F151 HydrophobicContact CB-CE2 4.43Å; A73-F151 HydrophobicContact CB-CZ 4.45Å; V76-F151 HydrophobicContact CG1-CE1 4.48Å; C147-F151 VanDerWaalsContact O-CD2 3.24Å; C147-F151 WeakPolarHBondContact O-CD2 3.39Å; C147-F151 PolarHBondContact O-N 2.88Å; L148-F151 PolarHBondContact O-N 2.86Å; F149-F151 VanDerWaalsContact C-N 3.35Å; F149-F151 PolarHBondContact O-N 3.34Å; F151-C155 PolarHBondContact O-N 2.85Å
152S34.8Very low36.2Very low70 Ų7093.5 Ų93.549%0.4951%0.507SS..Hα-helixtrans-69.6-37.6173.2-78.90000112.7L148 F149 C155 N156L148-S152 WeakPolarHBondContact O-CB 3.48Å; L148-S152 PolarHBondContact O-N 3.4Å; L148-S152 PolarHBondContact O-OG 2.91Å; F149-S152 PolarHBondContact O-N 2.92Å; S152-C155 PolarHBondContact O-N 3.09Å; S152-N156 WeakPolarHBondContact O-CB 3.49Å; S152-N156 PolarHBondContact O-N 3.46Å
153F34.4Very low35.8Very low120 Ų12099.3 Ų99.353%0.52654%0.535SS..Hα-helixtrans-68-39.6177.5-172.5-93.5000112.3F149 I150 C155 N156 N157F149-F153 VanDerWaalsContact O-CB 3.28Å; F149-F153 WeakPolarHBondContact O-CB 3.45Å; F149-F153 PolarHBondContact O-N 3.26Å; I150-F153 PolarHBondContact O-N 2.63Å; F153-C155 PolarHBondContact O-N 3.19Å; F153-N156 PolarHBondContact O-N 3.37Å; F153-N157 WeakPolarHBondContact CE1-ND2 3.42Å; F153-N157 WeakPolarHBondContact CE2-ND2 3.23Å; F153-N157 WeakPolarHBondContact CZ-ND2 3.32Å; F153-N157 PolarHBondContact O-N 2.93Å; F153-N157 VanDerWaalsContact O-N 3.15Å; F153-N157 PolarHBondContact O-ND2 3.13Å
154L35Very low35.4Very low110 Ų110103.1 Ų103.158%0.57656%0.557SS**Hα-helixtrans-66.1-25.5175.7-73.5170.5000112.8I150I150-L154 HydrophobicContact CG2-CD1 3.89Å; I150-L154 HydrophobicContact CG2-CG 4.45Å; I150-L154 WeakPolarHBondContact O-CB 2.92Å; I150-L154 VanDerWaalsContact O-CG 3.25Å; I150-L154 WeakPolarHBondContact O-CG 3.06Å; I150-L154 PolarHBondContact O-N 3.49Å
155C33.9Very low34.7Very low40 Ų40103.1 Ų103.127%0.2757%0.569SS.*Hα-helixtrans-93.3-26.8174.6-86.10000114.7Q96 F151 S152 F153 T158Q96-C155 PolarHBondContact NE2-SG 2.96Å; F151-C155 PolarHBondContact O-N 2.85Å; S152-C155 PolarHBondContact O-N 3.09Å; F153-C155 PolarHBondContact O-N 3.19Å; C155-T158 PolarHBondContact O-OG1 3.49Å
156N35.3Very low33.9Very low131 Ų131105.4 Ų105.470%0.70159%0.592SS**Hα-helixtrans-81.9-13.9175.6-98.65.8000113.9S152 F153S152-N156 WeakPolarHBondContact O-CB 3.49Å; S152-N156 PolarHBondContact O-N 3.46Å; F153-N156 PolarHBondContact O-N 3.37Å
157N33.6Very low33.7Very low99 Ų99108.8 Ų108.853%0.52963%0.634SS.*THydrogen-bonded Turntrans-97.910.3173.8-84.1-63.2000113.9F153F153-N157 WeakPolarHBondContact CE1-ND2 3.42Å; F153-N157 WeakPolarHBondContact CE2-ND2 3.23Å; F153-N157 WeakPolarHBondContact CZ-ND2 3.32Å; F153-N157 PolarHBondContact O-N 2.93Å; F153-N157 VanDerWaalsContact O-N 3.15Å; F153-N157 PolarHBondContact O-ND2 3.13Å
158T36.8Very low33.5Very low93 Ų93110.7 Ų110.757%0.57164%0.642SS**SBendtrans-103.14174.746.70000113.9C155C155-T158 PolarHBondContact O-OG1 3.49Å
159D34.5Very low32.9Very low126 Ų126112.8 Ų112.867%0.67466%0.656SS**SBendtrans-102.66.5-173-83.5-25.6000115.8
160D33.6Very low32.6Very low159 Ų159111.5 Ų111.585%0.8566%0.659SS**SBendtrans-138.614.4179.7-83.6-42.4000116.6P162D160-P162 WeakPolarHBondContact O-CD 3.36Å
161T33.6Very low32.4Very low98 Ų98112.5 Ų112.560%0.60167%0.67SS**  trans-110.3104.1169.939.70000111.9L163T161-L163 PolarHBondContact O-N 2.93Å
162P27.2Very low32.1Very low113 Ų113114.3 Ų114.373%0.73469%0.689SS**  trans-72.984.9161.232.1-28.9000106.8D160 C164D160-P162 WeakPolarHBondContact O-CD 3.36Å; P162-C164 PolarHBondContact O-N 3.13Å
163L27Very low32Very low160 Ų160117.3 Ų117.384%0.83870%0.702SS**  trans-76.768.3161.8-76.1171.4000108.2T161 G165T161-L163 PolarHBondContact O-N 2.93Å; L163-G165 PolarHBondContact O-N 3.16Å
164C26.6Very low31.8Very low120 Ų120117.1 Ų117.181%0.81172%0.715SS**  trans-57119.6149.1-66.60000108.1P162P162-C164 PolarHBondContact O-N 3.13Å
165G28Very low31.5Very low58 Ų58117.6 Ų117.660%0.59873%0.725SS**  trans-150.6122.2152.600000105.6L163 S167L163-G165 PolarHBondContact O-N 3.16Å; G165-S167 PolarHBondContact O-N 3.06Å
166P25.4Very low31.3Very low141 Ų141124.1 Ų124.192%0.91676%0.763SS**  trans-71.9133.6-169.430.2-32.6000110.5
167S34.6Very low31Very low191 Ų191123.5 Ų123.5100%1.33677%0.769SS**  trans-1490152630000108.5G165G165-S167 PolarHBondContact O-N 3.06Å

Retrieved 167 of 167 residues in 131.6 ms (Link to these results)