A0A077YYC0_TRITR Loading...

Uncharacterized protein

AlphaFold DB , UniProt , Accession A0A077YYC0, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 92 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
1M44.3Very low69.8Low242 Ų242131.7 Ų131.7100%1.19267%0.674SS**  0132.9058.7-164.9179.200107.9
2V64Low71Confident118 Ų118130.8 Ų130.872%0.71567%0.671SS**  trans-97.6149.1-174.4-169.80000110L4V2-L4 PolarHBondContact O-N 2.9Å
3S58.6Low72.2Confident66 Ų66133.3 Ų133.346%0.46267%0.669SS.*  trans-7568.5-166.7-59.70000114.7K5 Q6 E7S3-K5 PolarHBondContact O-N 3.36Å; S3-Q6 WeakPolarHBondContact O-CA 3.29Å; S3-Q6 VanDerWaalsContact O-CB 3.29Å; S3-Q6 WeakPolarHBondContact O-CB 3.48Å; S3-Q6 PolarHBondContact O-N 3Å; S3-E7 PolarHBondContact O-N 2.81Å
4L72.2Confident73.3Confident140 Ų140132.5 Ų132.573%0.73366%0.659SS**Hα-helixtrans-49.9-32.1178.7-102.370.2000115V2 Q6 L8V2-L4 PolarHBondContact O-N 2.9Å; L4-Q6 VanDerWaalsContact C-N 3.28Å; L4-Q6 PolarHBondContact O-N 3.49Å; L4-L8 PolarHBondContact O-N 3.02Å
5K70.7Confident74.3Confident192 Ų192126.2 Ų126.284%0.83564%0.641SS**Hα-helixtrans-67.5-25.5175.8-75.4-168.8171.9-175.20113.8S3S3-K5 PolarHBondContact O-N 3.36Å
6Q69.8Low75.3Confident121 Ų121121.4 Ų121.457%0.56563%0.627SS**Hα-helixtrans-81.6-41.6178.7-169.9172.5-10.500110.7S3 L4 L8 Q9 V10S3-Q6 WeakPolarHBondContact O-CA 3.29Å; S3-Q6 VanDerWaalsContact O-CB 3.29Å; S3-Q6 WeakPolarHBondContact O-CB 3.48Å; S3-Q6 PolarHBondContact O-N 3Å; L4-Q6 VanDerWaalsContact C-N 3.28Å; L4-Q6 PolarHBondContact O-N 3.49Å; Q6-L8 VanDerWaalsContact C-N 3.3Å; Q6-L8 PolarHBondContact O-N 3.29Å; Q6-Q9 PolarHBondContact O-N 3.32Å; Q6-V10 WeakPolarHBondContact O-CG2 3.46Å; Q6-V10 PolarHBondContact O-N 3.15Å; Q6-V10 VanDerWaalsContact O-N 3.15Å
7E74Confident76.2Confident114 Ų114117.9 Ų117.953%0.53361%0.609SS.*Hα-helixtrans-53.8-44.5176-56.2-56.8145.300112.4S3 Q9 V10 L11S3-E7 PolarHBondContact O-N 2.81Å; E7-Q9 PolarHBondContact O-N 3.43Å; E7-V10 PolarHBondContact O-N 3.44Å; E7-L11 PolarHBondContact O-N 3.42Å
8L76.1Confident77.1Confident110 Ų110114.4 Ų114.458%0.57660%0.596SS**Hα-helixtrans-64.2-39.3-178.4-171.663.6000112.6L4 Q6 V10 L11 D12L4-L8 PolarHBondContact O-N 3.02Å; Q6-L8 VanDerWaalsContact C-N 3.3Å; Q6-L8 PolarHBondContact O-N 3.29Å; L8-V10 VanDerWaalsContact C-N 3.34Å; L8-L11 WeakPolarHBondContact O-CB 3.43Å; L8-L11 PolarHBondContact O-N 2.96Å; L8-D12 PolarHBondContact O-N 3.42Å
9Q78Confident77.9Confident149 Ų149113.6 Ų113.670%0.69660%0.596SS**Hα-helixtrans-70.1-30.9177-66.6-174.2-42.200112.5Q6 E7 Y13Q6-Q9 PolarHBondContact O-N 3.32Å; E7-Q9 PolarHBondContact O-N 3.43Å; Q9-Y13 PolarHBondContact O-N 3.23Å
10V79.5Confident78.7Confident86 Ų86115.1 Ų115.152%0.52160%0.597SS.*Hα-helixtrans-69.7-35.4173.5174.30000110.9Q6 E7 L8 Y13 F14Q6-V10 WeakPolarHBondContact O-CG2 3.46Å; Q6-V10 PolarHBondContact O-N 3.15Å; Q6-V10 VanDerWaalsContact O-N 3.15Å; E7-V10 PolarHBondContact O-N 3.44Å; L8-V10 VanDerWaalsContact C-N 3.34Å; V10-Y13 PolarHBondContact O-N 3.22Å; V10-F14 PolarHBondContact O-N 3.3Å
11L80.5Confident79.5Confident111 Ų111114 Ų11458%0.58159%0.592SS**Hα-helixtrans-63.5-44.6177.3-168.970.4000112.4E7 L8 Y13 F14 G15E7-L11 PolarHBondContact O-N 3.42Å; L8-L11 WeakPolarHBondContact O-CB 3.43Å; L8-L11 PolarHBondContact O-N 2.96Å; L11-Y13 VanDerWaalsContact C-N 3.31Å; L11-Y13 PolarHBondContact O-N 3.36Å; L11-F14 WeakPolarHBondContact O-CB 3.41Å; L11-F14 PolarHBondContact O-N 3.05Å; L11-G15 PolarHBondContact O-N 3.42Å
12D84.9Confident81.7Confident120 Ų120105.2 Ų105.264%0.64255%0.554SS**Hα-helixtrans-60.4-41.3176.4-72.3-29.7000111.7L8 G15L8-D12 PolarHBondContact O-N 3.42Å; D12-G15 PolarHBondContact O-N 3.31Å
13Y86.3Confident83.1Confident164 Ų164105.7 Ų105.764%0.64355%0.547SS*.Hα-helixtrans-66.3-38.8176.1-174.2-113.1000112.4Q9 V10 L11 G15 A16 I17Q9-Y13 PolarHBondContact O-N 3.23Å; V10-Y13 PolarHBondContact O-N 3.22Å; L11-Y13 VanDerWaalsContact C-N 3.31Å; L11-Y13 PolarHBondContact O-N 3.36Å; Y13-G15 VanDerWaalsContact C-N 3.3Å; Y13-G15 PolarHBondContact O-N 3.28Å; Y13-A16 PolarHBondContact O-N 3.31Å; Y13-I17 HydrophobicContact CD1-CD1 3.9Å; Y13-I17 HydrophobicContact CE1-CD1 3.62Å; Y13-I17 HydrophobicContact CE1-CG1 4.49Å; Y13-I17 PolarHBondContact O-N 2.9Å
14F86.9Confident84.7Confident122 Ų122108.8 Ų108.854%0.53555%0.552SS.*Hα-helixtrans-62.4-36.4174.8-169.3-103.1000112.1V10 L11 A16 I17 C18V10-F14 PolarHBondContact O-N 3.3Å; L11-F14 WeakPolarHBondContact O-CB 3.41Å; L11-F14 PolarHBondContact O-N 3.05Å; F14-A16 VanDerWaalsContact C-N 3.32Å; F14-A16 PolarHBondContact O-N 3.11Å; F14-I17 WeakPolarHBondContact O-CB 3.48Å; F14-I17 PolarHBondContact O-N 3.36Å; F14-I17 VanDerWaalsContact O-N 3.11Å; F14-C18 WeakPolarHBondContact CE1-SG 3.47Å; F14-C18 PolarHBondContact O-N 3.4Å; F14-C18 PolarHBondContact O-SG 3.21Å; F14-C18 VanDerWaalsContact O-SG 3.4Å
15G89.2Confident85.5Confident38 Ų38105.3 Ų105.339%0.39254%0.536SS..Hα-helixtrans-56.3-42.5174.700000113.4L11 D12 Y13 C18 V19L11-G15 PolarHBondContact O-N 3.42Å; D12-G15 PolarHBondContact O-N 3.31Å; Y13-G15 VanDerWaalsContact C-N 3.3Å; Y13-G15 PolarHBondContact O-N 3.28Å; G15-C18 PolarHBondContact O-N 3.37Å; G15-V19 PolarHBondContact O-N 3.29Å
16A90.1Very high86.5Confident50 Ų50101 Ų10141%0.41352%0.521SS..Hα-helixtrans-64.6-42.3174.600000112.1Y13 F14 C18 V19 F20Y13-A16 PolarHBondContact O-N 3.31Å; F14-A16 VanDerWaalsContact C-N 3.32Å; F14-A16 PolarHBondContact O-N 3.11Å; A16-C18 VanDerWaalsContact C-N 3.34Å; A16-C18 PolarHBondContact O-N 3.46Å; A16-V19 PolarHBondContact O-N 2.87Å; A16-F20 WeakPolarHBondContact O-CD2 3.38Å; A16-F20 PolarHBondContact O-N 3.46Å; A16-F20 VanDerWaalsContact O-N 3.15Å
17I91Very high87.1Confident61 Ų6198.6 Ų98.631%0.31352%0.515SS..Hα-helixtrans-61.3-41.7176.7-66.1171.2000111Y13 F14 V19 F20 I21Y13-I17 HydrophobicContact CD1-CD1 3.9Å; Y13-I17 HydrophobicContact CE1-CD1 3.62Å; Y13-I17 HydrophobicContact CE1-CG1 4.49Å; Y13-I17 PolarHBondContact O-N 2.9Å; F14-I17 WeakPolarHBondContact O-CB 3.48Å; F14-I17 PolarHBondContact O-N 3.36Å; F14-I17 VanDerWaalsContact O-N 3.11Å; I17-V19 VanDerWaalsContact C-N 3.3Å; I17-V19 PolarHBondContact O-N 3.4Å; I17-F20 PolarHBondContact O-N 2.89Å; I17-I21 HydrophobicContact CG2-CD1 3.71Å; I17-I21 HydrophobicContact CG2-CG1 4.24Å; I17-I21 WeakPolarHBondContact O-CG1 3.42Å; I17-I21 PolarHBondContact O-N 3.22Å
18C91.6Very high87.6Confident56 Ų5697.9 Ų97.938%0.37851%0.514SS..Hα-helixtrans-58-40.7175.3-70.40000112.5F14 G15 A16 I21 S22F14-C18 WeakPolarHBondContact CE1-SG 3.47Å; F14-C18 PolarHBondContact O-N 3.4Å; F14-C18 PolarHBondContact O-SG 3.21Å; F14-C18 VanDerWaalsContact O-SG 3.4Å; G15-C18 PolarHBondContact O-N 3.37Å; A16-C18 VanDerWaalsContact C-N 3.34Å; A16-C18 PolarHBondContact O-N 3.46Å; C18-I21 PolarHBondContact O-N 3.15Å; C18-S22 WeakPolarHBondContact O-CB 3.35Å; C18-S22 PolarHBondContact O-N 2.75Å; C18-S22 PolarHBondContact O-OG 3.26Å
19V93.4Very high87.9Confident98 Ų9897.4 Ų97.459%0.59451%0.511SS*.Hα-helixtrans-63.9-46.6175.9177.40000111G15 A16 I17 I21 S22 F23G15-V19 PolarHBondContact O-N 3.29Å; A16-V19 PolarHBondContact O-N 2.87Å; I17-V19 VanDerWaalsContact C-N 3.3Å; I17-V19 PolarHBondContact O-N 3.4Å; V19-I21 PolarHBondContact O-N 3.45Å; V19-S22 PolarHBondContact O-N 2.99Å; V19-S22 PolarHBondContact O-OG 3.49Å; V19-F23 PolarHBondContact O-N 2.83Å
20F93.8Very high88.1Confident143 Ų14394.3 Ų94.363%0.62750%0.502SS*.Hα-helixtrans-58.3-45.9174.3-82.2-74.8000112.7A16 I17 S22 F23 F24A16-F20 WeakPolarHBondContact O-CD2 3.38Å; A16-F20 PolarHBondContact O-N 3.46Å; A16-F20 VanDerWaalsContact O-N 3.15Å; I17-F20 PolarHBondContact O-N 2.89Å; F20-S22 PolarHBondContact O-N 3.28Å; F20-F23 PolarHBondContact O-N 3.2Å; F20-F24 VanDerWaalsContact O-CD2 3.26Å; F20-F24 WeakPolarHBondContact O-CD2 3.36Å; F20-F24 PolarHBondContact O-N 3.2Å; F20-F24 VanDerWaalsContact O-N 3.1Å
21I93.7Very high88Confident94 Ų9492.4 Ų92.448%0.48249%0.492SS..Hα-helixtrans-61.4-45.5177-67.7170.7000110.3I17 C18 V19 F23 F24 V25I17-I21 HydrophobicContact CG2-CD1 3.71Å; I17-I21 HydrophobicContact CG2-CG1 4.24Å; I17-I21 WeakPolarHBondContact O-CG1 3.42Å; I17-I21 PolarHBondContact O-N 3.22Å; C18-I21 PolarHBondContact O-N 3.15Å; V19-I21 PolarHBondContact O-N 3.45Å; I21-F23 VanDerWaalsContact C-N 3.29Å; I21-F23 PolarHBondContact O-N 3.1Å; I21-F24 PolarHBondContact O-N 3.42Å; I21-V25 HydrophobicContact CG2-CG2 4.22Å; I21-V25 WeakPolarHBondContact O-CG2 3.24Å; I21-V25 PolarHBondContact O-N 3.35Å
22S92.3Very high87.7Confident56 Ų5690.2 Ų90.239%0.39248%0.484SS..Hα-helixtrans-61-36.6178.274.80000112.8C18 V19 F20 V25 I26C18-S22 WeakPolarHBondContact O-CB 3.35Å; C18-S22 PolarHBondContact O-N 2.75Å; C18-S22 PolarHBondContact O-OG 3.26Å; V19-S22 PolarHBondContact O-N 2.99Å; V19-S22 PolarHBondContact O-OG 3.49Å; F20-S22 PolarHBondContact O-N 3.28Å; S22-V25 PolarHBondContact O-N 3.31Å; S22-I26 VanDerWaalsContact O-CG1 3.28Å; S22-I26 WeakPolarHBondContact O-CG1 3.28Å; S22-I26 PolarHBondContact O-N 2.84Å
23F92.6Very high87.1Confident129 Ų12987 Ų8757%0.56647%0.468SS*.Hα-helixtrans-63.8-47.5174.4178.8-95.6000111.4V19 F20 I21 V25 I26 V27V19-F23 PolarHBondContact O-N 2.83Å; F20-F23 PolarHBondContact O-N 3.2Å; I21-F23 VanDerWaalsContact C-N 3.29Å; I21-F23 PolarHBondContact O-N 3.1Å; F23-V25 VanDerWaalsContact C-N 3.32Å; F23-V25 PolarHBondContact O-N 3.23Å; F23-I26 PolarHBondContact O-N 2.75Å; F23-V27 HydrophobicContact CD1-CG2 4.37Å; F23-V27 HydrophobicContact CE1-CG2 4.01Å; F23-V27 HydrophobicContact CZ-CG2 4.12Å; F23-V27 WeakPolarHBondContact O-CG2 3.26Å; F23-V27 PolarHBondContact O-N 3.38Å
24F91.3Very high85.9Confident131 Ų13180.4 Ų80.458%0.57545%0.446SS*.Hα-helixtrans-61.7-38.3173.6-78.9-68.4000112.5F20 I21 V27 L28F20-F24 VanDerWaalsContact O-CD2 3.26Å; F20-F24 WeakPolarHBondContact O-CD2 3.36Å; F20-F24 PolarHBondContact O-N 3.2Å; F20-F24 VanDerWaalsContact O-N 3.1Å; I21-F24 PolarHBondContact O-N 3.42Å; F24-V27 PolarHBondContact O-N 2.8Å; F24-L28 VanDerWaalsContact O-CB 3.31Å; F24-L28 WeakPolarHBondContact O-CB 3.39Å; F24-L28 VanDerWaalsContact O-CG 3.27Å; F24-L28 WeakPolarHBondContact O-CG 3.38Å; F24-L28 PolarHBondContact O-N 3.4Å
25V90.8Very high85Confident66 Ų6677.9 Ų77.940%0.444%0.437SS..Hα-helixtrans-66.8-37.8175.6170.10000111.6I21 S22 F23 L28 I29I21-V25 HydrophobicContact CG2-CG2 4.22Å; I21-V25 WeakPolarHBondContact O-CG2 3.24Å; I21-V25 PolarHBondContact O-N 3.35Å; S22-V25 PolarHBondContact O-N 3.31Å; F23-V25 VanDerWaalsContact C-N 3.32Å; F23-V25 PolarHBondContact O-N 3.23Å; V25-L28 CarbonylContact O-C 3.58Å; V25-L28 PolarHBondContact O-N 2.92Å; V25-I29 HydrophobicContact CG1-CD1 3.77Å; V25-I29 HydrophobicContact CG1-CG1 4.37Å; V25-I29 WeakPolarHBondContact O-CB 3.28Å; V25-I29 VanDerWaalsContact O-CG1 3.24Å; V25-I29 WeakPolarHBondContact O-CG1 3.44Å; V25-I29 PolarHBondContact O-N 3.25Å
26I89.9Confident83.5Confident102 Ų10278.5 Ų78.552%0.52343%0.432SS..Hα-helixtrans-67.6-43.1174.1-69162.2000110.6S22 F23 L28 I29 V30S22-I26 VanDerWaalsContact O-CG1 3.28Å; S22-I26 WeakPolarHBondContact O-CG1 3.28Å; S22-I26 PolarHBondContact O-N 2.84Å; F23-I26 PolarHBondContact O-N 2.75Å; I26-L28 VanDerWaalsContact C-N 3.3Å; I26-L28 PolarHBondContact O-N 2.84Å; I26-I29 PolarHBondContact O-N 3.43Å; I26-V30 WeakPolarHBondContact O-CG2 3.43Å; I26-V30 PolarHBondContact O-N 3.45Å
27V83.4Confident82.3Confident70 Ų7082.3 Ų82.342%0.42444%0.435SS..Hα-helixtrans-61.6-40.2174171.30000110.9F23 F24 V30 S31F23-V27 HydrophobicContact CD1-CG2 4.37Å; F23-V27 HydrophobicContact CE1-CG2 4.01Å; F23-V27 HydrophobicContact CZ-CG2 4.12Å; F23-V27 WeakPolarHBondContact O-CG2 3.26Å; F23-V27 PolarHBondContact O-N 3.38Å; F24-V27 PolarHBondContact O-N 2.8Å; V27-V30 PolarHBondContact O-N 3.1Å; V27-S31 WeakPolarHBondContact O-CB 3.36Å; V27-S31 PolarHBondContact O-N 3.38Å; V27-S31 PolarHBondContact O-OG 2.94Å
28L83.6Confident80.4Confident100 Ų10081.6 Ų81.652%0.52443%0.43SS..Hα-helixtrans-67.8-39173.6-76.5170.9000112.3F24 V25 I26 V30 S31 V32F24-L28 VanDerWaalsContact O-CB 3.31Å; F24-L28 WeakPolarHBondContact O-CB 3.39Å; F24-L28 VanDerWaalsContact O-CG 3.27Å; F24-L28 WeakPolarHBondContact O-CG 3.38Å; F24-L28 PolarHBondContact O-N 3.4Å; V25-L28 CarbonylContact O-C 3.58Å; V25-L28 PolarHBondContact O-N 2.92Å; I26-L28 VanDerWaalsContact C-N 3.3Å; I26-L28 PolarHBondContact O-N 2.84Å; L28-V30 VanDerWaalsContact C-N 3.35Å; L28-S31 WeakPolarHBondContact CA-OG 3.2Å; L28-S31 PolarHBondContact O-N 3.16Å; L28-S31 PolarHBondContact O-OG 2.89Å; L28-V32 WeakPolarHBondContact O-CA 3.1Å; L28-V32 WeakPolarHBondContact O-CB 3.31Å; L28-V32 WeakPolarHBondContact O-CG2 3.27Å; L28-V32 PolarHBondContact O-N 2.75Å
29I83.7Confident78.7Confident99 Ų9980.9 Ų80.951%0.50843%0.425SS..Hα-helixtrans-66.8-39.2174.7-71.9164.7000109.9V25 I26 T33V25-I29 HydrophobicContact CG1-CD1 3.77Å; V25-I29 HydrophobicContact CG1-CG1 4.37Å; V25-I29 WeakPolarHBondContact O-CB 3.28Å; V25-I29 VanDerWaalsContact O-CG1 3.24Å; V25-I29 WeakPolarHBondContact O-CG1 3.44Å; V25-I29 PolarHBondContact O-N 3.25Å; I26-I29 PolarHBondContact O-N 3.43Å; I29-T33 VanDerWaalsContact O-CB 3.23Å; I29-T33 WeakPolarHBondContact O-CB 3.23Å; I29-T33 PolarHBondContact O-N 3.17Å; I29-T33 PolarHBondContact O-OG1 3.36Å
30V81.6Confident76.8Confident84 Ų8478.6 Ų78.651%0.50941%0.411SS..Hα-helixtrans-69.5-38.1174.9173.30000111.7I26 V27 L28 C34I26-V30 WeakPolarHBondContact O-CG2 3.43Å; I26-V30 PolarHBondContact O-N 3.45Å; V27-V30 PolarHBondContact O-N 3.1Å; L28-V30 VanDerWaalsContact C-N 3.35Å; V30-C34 VanDerWaalsContact O-CB 3.28Å; V30-C34 WeakPolarHBondContact O-CB 3.44Å; V30-C34 PolarHBondContact O-N 2.9Å; V30-C34 PolarHBondContact O-SG 3.4Å
31S77.7Confident75Confident46 Ų4673.4 Ų73.432%0.32239%0.392SS..Hα-helixtrans-72.1-44.1176.974.60000111.3V27 L28 C34 I35V27-S31 WeakPolarHBondContact O-CB 3.36Å; V27-S31 PolarHBondContact O-N 3.38Å; V27-S31 PolarHBondContact O-OG 2.94Å; L28-S31 WeakPolarHBondContact CA-OG 3.2Å; L28-S31 PolarHBondContact O-N 3.16Å; L28-S31 PolarHBondContact O-OG 2.89Å; S31-C34 WeakPolarHBondContact O-CB 3.45Å; S31-C34 PolarHBondContact O-N 2.97Å; S31-I35 WeakPolarHBondContact O-CB 3.48Å; S31-I35 VanDerWaalsContact O-CD1 3.31Å; S31-I35 WeakPolarHBondContact O-CD1 3.28Å; S31-I35 WeakPolarHBondContact O-CG1 3.28Å; S31-I35 PolarHBondContact O-N 3.39Å
32V73Confident73.2Confident65 Ų6574.5 Ų74.539%0.39440%0.396SS..Hα-helixtrans-56.4-56170167.40000109.5L28 C34 I35 L36L28-V32 WeakPolarHBondContact O-CA 3.1Å; L28-V32 WeakPolarHBondContact O-CB 3.31Å; L28-V32 WeakPolarHBondContact O-CG2 3.27Å; L28-V32 PolarHBondContact O-N 2.75Å; V32-C34 VanDerWaalsContact C-N 3.32Å; V32-C34 PolarHBondContact O-N 2.73Å; V32-I35 CarbonylContact O-C 3.59Å; V32-I35 WeakPolarHBondContact O-CA 3.45Å; V32-I35 WeakPolarHBondContact O-CB 3.38Å; V32-I35 PolarHBondContact O-N 2.81Å; V32-L36 HydrophobicContact CG1-CD1 3.86Å; V32-L36 HydrophobicContact CG1-CD2 3.94Å; V32-L36 HydrophobicContact CG1-CG 4.35Å; V32-L36 WeakPolarHBondContact O-CA 3.27Å; V32-L36 WeakPolarHBondContact O-CB 3.46Å; V32-L36 WeakPolarHBondContact O-CD1 3.45Å; V32-L36 PolarHBondContact O-N 3.11Å
33T72.9Confident71.4Confident53 Ų5378.6 Ų78.633%0.32541%0.413SS..Hα-helixtrans-65.5-28.3178.6-52.10000113.5I29 L36 F59I29-T33 VanDerWaalsContact O-CB 3.23Å; I29-T33 WeakPolarHBondContact O-CB 3.23Å; I29-T33 PolarHBondContact O-N 3.17Å; I29-T33 PolarHBondContact O-OG1 3.36Å; T33-L36 CarbonylContact O-C 3.45Å; T33-L36 WeakPolarHBondContact O-CA 3.32Å; T33-L36 PolarHBondContact O-N 2.8Å; T33-F59 HydrophobicContact CG2-CD2 3.85Å; T33-F59 HydrophobicContact CG2-CE2 3.65Å; T33-F59 HydrophobicContact CG2-CZ 4.3Å; T33-F59 VanDerWaalsContact O-CB 3.32Å; T33-F59 WeakPolarHBondContact O-CB 3.42Å; T33-F59 WeakPolarHBondContact O-CD2 3.25Å; T33-F59 WeakPolarHBondContact O-CG 3.26Å
34C61.6Low69.6Low25 Ų2578.6 Ų78.617%0.16942%0.419CS..Hα-helixtrans-60.4-52.4164.4-760000109.8V30 S31 V32 L36 E56 F59 K63V30-C34 VanDerWaalsContact O-CB 3.28Å; V30-C34 WeakPolarHBondContact O-CB 3.44Å; V30-C34 PolarHBondContact O-N 2.9Å; V30-C34 PolarHBondContact O-SG 3.4Å; S31-C34 WeakPolarHBondContact O-CB 3.45Å; S31-C34 PolarHBondContact O-N 2.97Å; V32-C34 VanDerWaalsContact C-N 3.32Å; V32-C34 PolarHBondContact O-N 2.73Å; C34-L36 PolarHBondContact O-N 2.87Å; C34-L36 VanDerWaalsContact O-N 3.09Å; C34-E56 WeakPolarHBondContact O-CA 3.3Å; C34-E56 WeakPolarHBondContact O-CG 3.07Å; C34-F59 HydrophobicContact CB-CD1 4.28Å; C34-F59 WeakPolarHBondContact O-CB 3.17Å; C34-K63 PolarHBondContact SG-NZ 2.82Å
35I66.9Low67.6Low69 Ų6977.9 Ų77.935%0.35442%0.421SS..THydrogen-bonded Turntrans-67.23.8170.1-49.4154.6000111.4S31 V32 V52 F55 E56S31-I35 WeakPolarHBondContact O-CB 3.48Å; S31-I35 VanDerWaalsContact O-CD1 3.31Å; S31-I35 WeakPolarHBondContact O-CD1 3.28Å; S31-I35 WeakPolarHBondContact O-CG1 3.28Å; S31-I35 PolarHBondContact O-N 3.39Å; V32-I35 CarbonylContact O-C 3.59Å; V32-I35 WeakPolarHBondContact O-CA 3.45Å; V32-I35 WeakPolarHBondContact O-CB 3.38Å; V32-I35 PolarHBondContact O-N 2.81Å; I35-V52 HydrophobicContact CG2-CG1 3.48Å; I35-V52 VanDerWaalsContact CG2-CG1 3.48Å; I35-V52 WeakPolarHBondContact CG2-O 3.38Å; I35-F55 CarbonylContact C-O 3.13Å; I35-F55 CarbonylContact O-C 3.21Å; I35-F55 VanDerWaalsContact O-CA 3.3Å; I35-F55 WeakPolarHBondContact O-CA 3.37Å; I35-F55 WeakPolarHBondContact O-CB 3.2Å; I35-E56 PolarHBondContact O-N 3.44Å; I35-E56 VanDerWaalsContact O-N 3.08Å
36L58.1Low65.9Low52 Ų5281.8 Ų81.827%0.27244%0.437SS..SBendtrans-14168.9-174.8-90.975.3000116.3V32 T33 C34 V52 F55V32-L36 HydrophobicContact CG1-CD1 3.86Å; V32-L36 HydrophobicContact CG1-CD2 3.94Å; V32-L36 HydrophobicContact CG1-CG 4.35Å; V32-L36 WeakPolarHBondContact O-CA 3.27Å; V32-L36 WeakPolarHBondContact O-CB 3.46Å; V32-L36 WeakPolarHBondContact O-CD1 3.45Å; V32-L36 PolarHBondContact O-N 3.11Å; T33-L36 CarbonylContact O-C 3.45Å; T33-L36 WeakPolarHBondContact O-CA 3.32Å; T33-L36 PolarHBondContact O-N 2.8Å; C34-L36 PolarHBondContact O-N 2.87Å; C34-L36 VanDerWaalsContact O-N 3.09Å; L36-V52 HydrophobicContact CD1-CG2 4.49Å; L36-F55 CarbonylContact C-O 3.25Å; L36-F55 VanDerWaalsContact C-O 3.25Å; L36-F55 WeakPolarHBondContact CA-O 3.45Å; L36-F55 HydrophobicContact CB-CB 4.24Å; L36-F55 HydrophobicContact CB-CD2 3.6Å; L36-F55 HydrophobicContact CB-CE2 3.86Å; L36-F55 HydrophobicContact CB-CG 4.04Å; L36-F55 HydrophobicContact CD1-CB 4.07Å; L36-F55 HydrophobicContact CD1-CG 4.38Å; L36-F55 HydrophobicContact CD2-CE1 4.47Å; L36-F55 HydrophobicContact CD2-CE2 4.38Å; L36-F55 HydrophobicContact CD2-CZ 4.32Å; L36-F55 HydrophobicContact CG-CB 3.79Å; L36-F55 HydrophobicContact CG-CD1 4.01Å; L36-F55 HydrophobicContact CG-CD2 3.67Å; L36-F55 HydrophobicContact CG-CE1 4.32Å; L36-F55 HydrophobicContact CG-CE2 3.95Å; L36-F55 HydrophobicContact CG-CG 3.6Å; L36-F55 HydrophobicContact CG-CZ 4.25Å; L36-F55 PolarHBondContact N-O 2.8Å
37W65.7Low64.2Low130 Ų13081.5 Ų81.549%0.49244%0.44SS..SBendtrans-140.10.2136.5-167.2-123.8000119.1V40 F55 R58 F59W37-V40 HydrophobicContact CE3-CG1 4.38Å; W37-V40 WeakPolarHBondContact O-CG1 3.47Å; W37-F55 CarbonylContact C-O 3.51Å; W37-F55 HydrophobicContact CE3-CE2 4.27Å; W37-F55 PolarHBondContact N-O 2.92Å; W37-R58 HydrophobicContact CB-CB 4.49Å; W37-R58 HydrophobicContact CG-CB 4.43Å; W37-R58 WeakPolarHBondContact O-CB 3.29Å; W37-R58 PolarHBondContact O-NE 3.45Å; W37-R58 PolarHBondContact O-NH2 3.28Å; W37-F59 HydrophobicContact CB-CB 4.11Å; W37-F59 HydrophobicContact CB-CD2 4.34Å
38F51.1Low62.9Low46 Ų4683.4 Ų83.420%0.20245%0.452CS..SBendtrans-59.8-128.9-168.3-160.28000120.2V40 S41 F53 F55 E56 N57 R58F38-V40 CarbonylContact O-C 3.52Å; F38-V40 VanDerWaalsContact O-CG1 3.28Å; F38-V40 WeakPolarHBondContact O-CG1 3.18Å; F38-V40 PolarHBondContact O-N 2.93Å; F38-S41 VanDerWaalsContact O-CB 3.28Å; F38-S41 WeakPolarHBondContact O-CB 3.39Å; F38-S41 PolarHBondContact O-N 2.9Å; F38-F53 VanDerWaalsContact CD2-O 3.23Å; F38-F53 WeakPolarHBondContact CD2-O 3.35Å; F38-F53 HydrophobicContact CE2-CZ 4.32Å; F38-F55 VanDerWaalsContact CB-CA 3.45Å; F38-F55 WeakPolarHBondContact CB-O 3.49Å; F38-F55 VanDerWaalsContact N-C 3.33Å; F38-F55 PolarHBondContact N-O 3.27Å; F38-E56 VanDerWaalsContact CB-N 3.3Å; F38-N57 HydrophobicContact CD1-CB 3.84Å; F38-N57 VanDerWaalsContact CD1-O 3.24Å; F38-N57 WeakPolarHBondContact CD1-O 3.46Å; F38-N57 HydrophobicContact CD2-CB 3.82Å; F38-N57 HydrophobicContact CE1-CB 3.78Å; F38-N57 HydrophobicContact CE2-CB 3.79Å; F38-N57 VanDerWaalsContact CG-C 3.47Å; F38-N57 HydrophobicContact CG-CB 3.87Å; F38-N57 HydrophobicContact CZ-CB 3.77Å; F38-R58 HydrophobicContact CD1-CG 4.17Å; F38-R58 WeakPolarHBondContact O-CD 3.39Å; F38-R58 PolarHBondContact O-NE 3.47Å
39C55.7Low61.5Low41 Ų4186.5 Ų86.528%0.27746%0.461SS..G310 helixtrans-6815.4-177.8-68.50000113.4S41 E42 S54C39-S41 PolarHBondContact O-N 3.23Å; C39-S41 VanDerWaalsContact O-N 3.16Å; C39-E42 CarbonylContact O-C 3.44Å; C39-E42 WeakPolarHBondContact O-CA 3.43Å; C39-E42 PolarHBondContact O-N 3.08Å; C39-E42 VanDerWaalsContact O-O 3.1Å; C39-S54 CarbonylContact C-O 2.94Å; C39-S54 PolarHBondContact O-OG 3.28Å
40V54.6Low60Low50 Ų5083.3 Ų83.330%0.30345%0.45SS..G310 helixtrans-55.6-11.914165.40000110.1W37 F38 S54 F55W37-V40 HydrophobicContact CE3-CG1 4.38Å; W37-V40 WeakPolarHBondContact O-CG1 3.47Å; F38-V40 CarbonylContact O-C 3.52Å; F38-V40 VanDerWaalsContact O-CG1 3.28Å; F38-V40 WeakPolarHBondContact O-CG1 3.18Å; F38-V40 PolarHBondContact O-N 2.93Å; V40-S54 WeakPolarHBondContact CB-O 3.11Å; V40-S54 PolarHBondContact N-O 3.3Å; V40-S54 PolarHBondContact N-OG 3.25Å; V40-F55 HydrophobicContact CB-CD1 3.93Å; V40-F55 HydrophobicContact CB-CD2 3.82Å; V40-F55 HydrophobicContact CB-CE1 3.84Å; V40-F55 HydrophobicContact CB-CE2 3.78Å; V40-F55 HydrophobicContact CB-CG 4.02Å; V40-F55 HydrophobicContact CB-CZ 3.81Å; V40-F55 HydrophobicContact CG1-CD1 4.41Å; V40-F55 HydrophobicContact CG1-CD2 3.38Å; V40-F55 HydrophobicContact CG1-CE1 4.36Å; V40-F55 HydrophobicContact CG1-CE2 3.37Å; V40-F55 HydrophobicContact CG1-CG 4.04Å; V40-F55 HydrophobicContact CG1-CZ 3.91Å; V40-F55 HydrophobicContact CG2-CD1 4.38Å; V40-F55 HydrophobicContact CG2-CE1 3.78Å; V40-F55 HydrophobicContact CG2-CE2 3.99Å; V40-F55 HydrophobicContact CG2-CZ 3.61Å
41S55.1Low58.5Low33 Ų3383 Ų8323%0.23144%0.442CS..G310 helixtrans-58.1-37.4157.3-152.70000114.8F38 C39 R58F38-S41 VanDerWaalsContact O-CB 3.28Å; F38-S41 WeakPolarHBondContact O-CB 3.39Å; F38-S41 PolarHBondContact O-N 2.9Å; C39-S41 PolarHBondContact O-N 3.23Å; C39-S41 VanDerWaalsContact O-N 3.16Å; S41-R58 VanDerWaalsContact CB-CZ 3.5Å; S41-R58 PolarHBondContact OG-NH1 3.05Å
42E55.3Low57.5Low118 Ų11884.1 Ų84.155%0.55145%0.446SS*.SBendtrans-149.486.7-167.3-89.6127.5113.500111.8C39 D44C39-E42 CarbonylContact O-C 3.44Å; C39-E42 WeakPolarHBondContact O-CA 3.43Å; C39-E42 PolarHBondContact O-N 3.08Å; C39-E42 VanDerWaalsContact O-O 3.1Å; E42-D44 VanDerWaalsContact C-N 3.31Å; E42-D44 PolarHBondContact O-N 3.46Å
43N54.3Low56.4Low141 Ų14188.7 Ų88.775%0.75446%0.461SS*.  55.39.2118.3-57.8-14.2000122.5
44D54.5Low55.4Low130 Ų13086.5 Ų86.570%0.69545%0.448SS*.  trans-84131.3162.7-75.5-43.6000111.4E42 K51E42-D44 VanDerWaalsContact C-N 3.31Å; E42-D44 PolarHBondContact O-N 3.46Å; D44-K51 PolarHBondContact O-NZ 2.99Å
45D50.6Low55Low115 Ų11587.1 Ų87.162%0.61545%0.448SS*.  trans-94.6172.8-173.7-88.6-36.9000113.7
46M55.1Low54.5Low148 Ų14886.4 Ų86.473%0.72944%0.443SS*.SBendtrans73.2123171.8-41.2-52.6170.400116.3A50M46-A50 WeakPolarHBondContact O-CB 3.44Å
47T54.5Low54.4Low96 Ų9686.9 Ų86.959%0.58945%0.446SS*.SBendtrans74.8145.917782.70000117.5F49 A50 K51T47-F49 VanDerWaalsContact C-N 3.26Å; T47-F49 PolarHBondContact O-N 3.45Å; T47-A50 WeakPolarHBondContact O-CB 3.14Å; T47-A50 PolarHBondContact O-N 3.48Å; T47-A50 PolarHBondContact OG1-N 3.22Å; T47-K51 PolarHBondContact O-N 3.49Å
48V54.6Low53.8Low111 Ų11182.6 Ų82.667%0.67343%0.43SS*.THydrogen-bonded Turntrans-66.9-24.4173.3-67.50000113K51 V52V48-K51 CarbonylContact O-C 3.05Å; V48-K51 WeakPolarHBondContact O-CA 3.49Å; V48-K51 PolarHBondContact O-N 3.43Å; V48-V52 WeakPolarHBondContact O-CG2 3.32Å; V48-V52 PolarHBondContact O-N 2.85Å
49F55.1Low54.2Low164 Ų16482.1 Ų82.172%0.71943%0.427SS*.THydrogen-bonded Turntrans-64.5-47.4172.9-59.8-78.8000111T47 K51 V52 F53T47-F49 VanDerWaalsContact C-N 3.26Å; T47-F49 PolarHBondContact O-N 3.45Å; F49-K51 PolarHBondContact O-N 3.01Å; F49-V52 PolarHBondContact O-N 3.49Å; F49-F53 PolarHBondContact O-N 3.09Å
50A52.1Low54.3Low32 Ų3283.6 Ų83.626%0.26443%0.43SS..Hα-helixtrans-56.1-40.4173.500000110M46 T47 V52 S54M46-A50 WeakPolarHBondContact O-CB 3.44Å; T47-A50 WeakPolarHBondContact O-CB 3.14Å; T47-A50 PolarHBondContact O-N 3.48Å; T47-A50 PolarHBondContact OG1-N 3.22Å; A50-V52 PolarHBondContact O-N 3.09Å; A50-S54 VanDerWaalsContact O-CA 3.3Å; A50-S54 WeakPolarHBondContact O-CA 3.05Å; A50-S54 WeakPolarHBondContact O-CB 3.35Å; A50-S54 PolarHBondContact O-N 3.35Å
51K50.1Low55Low79 Ų7987.1 Ų87.134%0.34344%0.442SS..Hα-helixtrans-92.631.4171.9-80.3177.8174.471.60116.3D44 T47 V48 F49 F55D44-K51 PolarHBondContact O-NZ 2.99Å; T47-K51 PolarHBondContact O-N 3.49Å; V48-K51 CarbonylContact O-C 3.05Å; V48-K51 WeakPolarHBondContact O-CA 3.49Å; V48-K51 PolarHBondContact O-N 3.43Å; F49-K51 PolarHBondContact O-N 3.01Å; K51-F55 HydrophobicContact CB-CD1 4.22Å; K51-F55 WeakPolarHBondContact O-CD1 3.11Å
52V56.6Low55.6Low69 Ų6990.7 Ų90.742%0.41845%0.453SS..Hα-helixtrans-118.7-36.5156.8165.60000108.1I35 L36 V48 F49 A50 F55I35-V52 HydrophobicContact CG2-CG1 3.48Å; I35-V52 VanDerWaalsContact CG2-CG1 3.48Å; I35-V52 WeakPolarHBondContact CG2-O 3.38Å; L36-V52 HydrophobicContact CD1-CG2 4.49Å; V48-V52 WeakPolarHBondContact O-CG2 3.32Å; V48-V52 PolarHBondContact O-N 2.85Å; F49-V52 PolarHBondContact O-N 3.49Å; A50-V52 PolarHBondContact O-N 3.09Å; V52-F55 WeakPolarHBondContact O-CA 3.02Å; V52-F55 WeakPolarHBondContact O-CB 3.28Å; V52-F55 PolarHBondContact O-N 2.91Å
53F49.7Very low56.4Low161 Ų16189.5 Ų89.571%0.70645%0.446SS*.Hα-helixtrans-76.8-34.1167.5-174.3-98.6000114.1F38 F49 F55F38-F53 VanDerWaalsContact CD2-O 3.23Å; F38-F53 WeakPolarHBondContact CD2-O 3.35Å; F38-F53 HydrophobicContact CE2-CZ 4.32Å; F49-F53 PolarHBondContact O-N 3.09Å; F53-F55 PolarHBondContact O-N 3.17Å
54S52.6Low57.4Low7 Ų788.3 Ų88.35%0.04943%0.434CS..THydrogen-bonded Turntrans-70.235.3161.4171.60000108.5C39 V40 A50C39-S54 CarbonylContact C-O 2.94Å; C39-S54 PolarHBondContact O-OG 3.28Å; V40-S54 WeakPolarHBondContact CB-O 3.11Å; V40-S54 PolarHBondContact N-O 3.3Å; V40-S54 PolarHBondContact N-OG 3.25Å; A50-S54 VanDerWaalsContact O-CA 3.3Å; A50-S54 WeakPolarHBondContact O-CA 3.05Å; A50-S54 WeakPolarHBondContact O-CB 3.35Å; A50-S54 PolarHBondContact O-N 3.35Å
55F52.7Low58.4Low38 Ų3884.7 Ų84.717%0.16742%0.423CS..THydrogen-bonded Turntrans-152.9-18.3-177.7-106.2133000118.9I35 L36 W37 F38 V40 K51 V52 F53I35-F55 CarbonylContact C-O 3.13Å; I35-F55 CarbonylContact O-C 3.21Å; I35-F55 VanDerWaalsContact O-CA 3.3Å; I35-F55 WeakPolarHBondContact O-CA 3.37Å; I35-F55 WeakPolarHBondContact O-CB 3.2Å; L36-F55 CarbonylContact C-O 3.25Å; L36-F55 VanDerWaalsContact C-O 3.25Å; L36-F55 WeakPolarHBondContact CA-O 3.45Å; L36-F55 HydrophobicContact CB-CB 4.24Å; L36-F55 HydrophobicContact CB-CD2 3.6Å; L36-F55 HydrophobicContact CB-CE2 3.86Å; L36-F55 HydrophobicContact CB-CG 4.04Å; L36-F55 HydrophobicContact CD1-CB 4.07Å; L36-F55 HydrophobicContact CD1-CG 4.38Å; L36-F55 HydrophobicContact CD2-CE1 4.47Å; L36-F55 HydrophobicContact CD2-CE2 4.38Å; L36-F55 HydrophobicContact CD2-CZ 4.32Å; L36-F55 HydrophobicContact CG-CB 3.79Å; L36-F55 HydrophobicContact CG-CD1 4.01Å; L36-F55 HydrophobicContact CG-CD2 3.67Å; L36-F55 HydrophobicContact CG-CE1 4.32Å; L36-F55 HydrophobicContact CG-CE2 3.95Å; L36-F55 HydrophobicContact CG-CG 3.6Å; L36-F55 HydrophobicContact CG-CZ 4.25Å; L36-F55 PolarHBondContact N-O 2.8Å; W37-F55 CarbonylContact C-O 3.51Å; W37-F55 HydrophobicContact CE3-CE2 4.27Å; W37-F55 PolarHBondContact N-O 2.92Å; F38-F55 VanDerWaalsContact CB-CA 3.45Å; F38-F55 WeakPolarHBondContact CB-O 3.49Å; F38-F55 VanDerWaalsContact N-C 3.33Å; F38-F55 PolarHBondContact N-O 3.27Å; V40-F55 HydrophobicContact CB-CD1 3.93Å; V40-F55 HydrophobicContact CB-CD2 3.82Å; V40-F55 HydrophobicContact CB-CE1 3.84Å; V40-F55 HydrophobicContact CB-CE2 3.78Å; V40-F55 HydrophobicContact CB-CG 4.02Å; V40-F55 HydrophobicContact CB-CZ 3.81Å; V40-F55 HydrophobicContact CG1-CD1 4.41Å; V40-F55 HydrophobicContact CG1-CD2 3.38Å; V40-F55 HydrophobicContact CG1-CE1 4.36Å; V40-F55 HydrophobicContact CG1-CE2 3.37Å; V40-F55 HydrophobicContact CG1-CG 4.04Å; V40-F55 HydrophobicContact CG1-CZ 3.91Å; V40-F55 HydrophobicContact CG2-CD1 4.38Å; V40-F55 HydrophobicContact CG2-CE1 3.78Å; V40-F55 HydrophobicContact CG2-CE2 3.99Å; V40-F55 HydrophobicContact CG2-CZ 3.61Å; K51-F55 HydrophobicContact CB-CD1 4.22Å; K51-F55 WeakPolarHBondContact O-CD1 3.11Å; V52-F55 WeakPolarHBondContact O-CA 3.02Å; V52-F55 WeakPolarHBondContact O-CB 3.28Å; V52-F55 PolarHBondContact O-N 2.91Å; F53-F55 PolarHBondContact O-N 3.17Å
56E57Low59.6Low54 Ų5484.8 Ų84.825%0.25242%0.421SS..SBendtrans-71.2-77.1172.1-155.1-47.7-30.500116.3C34 I35 F38 R58 F59 Q60 K63C34-E56 WeakPolarHBondContact O-CA 3.3Å; C34-E56 WeakPolarHBondContact O-CG 3.07Å; I35-E56 PolarHBondContact O-N 3.44Å; I35-E56 VanDerWaalsContact O-N 3.08Å; F38-E56 VanDerWaalsContact CB-N 3.3Å; E56-R58 PolarHBondContact O-N 2.97Å; E56-F59 PolarHBondContact O-N 2.71Å; E56-Q60 PolarHBondContact OE1-N 3.09Å; E56-K63 IonicContact OE2-NZ 2.82Å; E56-K63 PolarHBondContact OE2-NZ 3.29Å
57N54.8Low60.8Low62 Ų6283.2 Ų83.233%0.33241%0.41SS..THydrogen-bonded Turntrans-6839.3-163.8-157.490000118.4F38 Q60F38-N57 HydrophobicContact CD1-CB 3.84Å; F38-N57 VanDerWaalsContact CD1-O 3.24Å; F38-N57 WeakPolarHBondContact CD1-O 3.46Å; F38-N57 HydrophobicContact CD2-CB 3.82Å; F38-N57 HydrophobicContact CE1-CB 3.78Å; F38-N57 HydrophobicContact CE2-CB 3.79Å; F38-N57 VanDerWaalsContact CG-C 3.47Å; F38-N57 HydrophobicContact CG-CB 3.87Å; F38-N57 HydrophobicContact CZ-CB 3.77Å; N57-Q60 HydrophobicContact CB-CB 4.24Å; N57-Q60 VanDerWaalsContact CG-CD 3.48Å; N57-Q60 VanDerWaalsContact ND2-CD 3.26Å; N57-Q60 PolarHBondContact ND2-OE1 3.23Å; N57-Q60 VanDerWaalsContact OD1-CB 3.31Å; N57-Q60 WeakPolarHBondContact OD1-CB 3.42Å; N57-Q60 WeakPolarHBondContact OD1-CG 3.44Å; N57-Q60 PolarHBondContact OD1-NE2 2.92Å; N57-Q60 VanDerWaalsContact OD1-NE2 3.16Å; N57-Q60 PolarHBondContact OD1-OE1 2.83Å
58R53.4Low62.2Low40 Ų4082.8 Ų82.815%0.15141%0.407CS..THydrogen-bonded Turntrans-125-4.4142.5-59.4-172.5-48.1179.710.9111.9W37 F38 S41 E56 K61 F62W37-R58 HydrophobicContact CB-CB 4.49Å; W37-R58 HydrophobicContact CG-CB 4.43Å; W37-R58 WeakPolarHBondContact O-CB 3.29Å; W37-R58 PolarHBondContact O-NE 3.45Å; W37-R58 PolarHBondContact O-NH2 3.28Å; F38-R58 HydrophobicContact CD1-CG 4.17Å; F38-R58 WeakPolarHBondContact O-CD 3.39Å; F38-R58 PolarHBondContact O-NE 3.47Å; S41-R58 VanDerWaalsContact CB-CZ 3.5Å; S41-R58 PolarHBondContact OG-NH1 3.05Å; E56-R58 PolarHBondContact O-N 2.97Å; R58-K61 HydrophobicContact CB-CB 4.03Å; R58-K61 HydrophobicContact CB-CD 4.01Å; R58-K61 HydrophobicContact CB-CG 3.93Å; R58-K61 HydrophobicContact CG-CD 3.67Å; R58-K61 HydrophobicContact CG-CG 4.01Å; R58-K61 CarbonylContact O-C 2.71Å; R58-K61 VanDerWaalsContact O-CA 3.26Å; R58-K61 WeakPolarHBondContact O-CA 3.16Å; R58-K61 VanDerWaalsContact O-CB 3.25Å; R58-K61 WeakPolarHBondContact O-CB 3.31Å; R58-K61 PolarHBondContact O-N 2.74Å; R58-F62 PolarHBondContact O-N 2.61Å
59F60.6Low63.4Low36 Ų3681.7 Ų81.716%0.15840%0.4CS..Hα-helixtrans-68.6-23.2152.9-157.6-100.8000109.3T33 C34 W37 E56 F62 K63T33-F59 HydrophobicContact CG2-CD2 3.85Å; T33-F59 HydrophobicContact CG2-CE2 3.65Å; T33-F59 HydrophobicContact CG2-CZ 4.3Å; T33-F59 VanDerWaalsContact O-CB 3.32Å; T33-F59 WeakPolarHBondContact O-CB 3.42Å; T33-F59 WeakPolarHBondContact O-CD2 3.25Å; T33-F59 WeakPolarHBondContact O-CG 3.26Å; C34-F59 HydrophobicContact CB-CD1 4.28Å; C34-F59 WeakPolarHBondContact O-CB 3.17Å; W37-F59 HydrophobicContact CB-CB 4.11Å; W37-F59 HydrophobicContact CB-CD2 4.34Å; E56-F59 PolarHBondContact O-N 2.71Å; F59-F62 HydrophobicContact CD2-CB 3.71Å; F59-F62 HydrophobicContact CD2-CD1 4.08Å; F59-F62 HydrophobicContact CD2-CG 4.08Å; F59-F62 HydrophobicContact CE2-CB 3.91Å; F59-F62 AromaticContact CE2-CD1 3.37Å; F59-F62 HydrophobicContact CE2-CD1 3.37Å; F59-F62 HydrophobicContact CE2-CE1 4.1Å; F59-F62 AromaticContact CE2-CG 3.85Å; F59-F62 HydrophobicContact CE2-CG 3.85Å; F59-F62 HydrophobicContact CG-CB 4.19Å; F59-F62 AromaticContact CZ-CD1 3.8Å; F59-F62 HydrophobicContact CZ-CD1 3.8Å; F59-F62 CarbonylContact O-C 3.14Å; F59-F62 WeakPolarHBondContact O-CB 3.31Å; F59-F62 PolarHBondContact O-N 2.94Å; F59-K63 HydrophobicContact CD1-CD 4.08Å; F59-K63 HydrophobicContact CD1-CG 4.09Å; F59-K63 HydrophobicContact CE1-CD 4.46Å; F59-K63 HydrophobicContact CE1-CG 4.15Å; F59-K63 WeakPolarHBondContact O-CB 3.36Å; F59-K63 VanDerWaalsContact O-CG 3.28Å; F59-K63 WeakPolarHBondContact O-CG 3.32Å; F59-K63 PolarHBondContact O-N 2.87Å
60Q57.7Low64.8Low72 Ų7279.7 Ų79.734%0.33639%0.392SS..Hα-helixtrans-51.6-48.3152.2-158.9-144.440.900113.2E56 N57 F62 K63 F64E56-Q60 PolarHBondContact OE1-N 3.09Å; N57-Q60 HydrophobicContact CB-CB 4.24Å; N57-Q60 VanDerWaalsContact CG-CD 3.48Å; N57-Q60 VanDerWaalsContact ND2-CD 3.26Å; N57-Q60 PolarHBondContact ND2-OE1 3.23Å; N57-Q60 VanDerWaalsContact OD1-CB 3.31Å; N57-Q60 WeakPolarHBondContact OD1-CB 3.42Å; N57-Q60 WeakPolarHBondContact OD1-CG 3.44Å; N57-Q60 PolarHBondContact OD1-NE2 2.92Å; N57-Q60 VanDerWaalsContact OD1-NE2 3.16Å; N57-Q60 PolarHBondContact OD1-OE1 2.83Å; Q60-F62 VanDerWaalsContact C-N 3.31Å; Q60-F62 PolarHBondContact O-N 2.81Å; Q60-K63 PolarHBondContact O-N 2.88Å; Q60-F64 HydrophobicContact CG-CD2 3.97Å; Q60-F64 HydrophobicContact CG-CE2 4.07Å; Q60-F64 WeakPolarHBondContact O-CB 3.02Å; Q60-F64 WeakPolarHBondContact O-CD2 3.24Å; Q60-F64 PolarHBondContact O-N 2.98Å
61K69.7Low66.2Low124 Ų12482.9 Ų82.954%0.53940%0.401SS..Hα-helixtrans-62.5-33.8172.8-63-173.5-173171.70112.3R58 A65R58-K61 HydrophobicContact CB-CB 4.03Å; R58-K61 HydrophobicContact CB-CD 4.01Å; R58-K61 HydrophobicContact CB-CG 3.93Å; R58-K61 HydrophobicContact CG-CD 3.67Å; R58-K61 HydrophobicContact CG-CG 4.01Å; R58-K61 CarbonylContact O-C 2.71Å; R58-K61 VanDerWaalsContact O-CA 3.26Å; R58-K61 WeakPolarHBondContact O-CA 3.16Å; R58-K61 VanDerWaalsContact O-CB 3.25Å; R58-K61 WeakPolarHBondContact O-CB 3.31Å; R58-K61 PolarHBondContact O-N 2.74Å; K61-A65 VanDerWaalsContact O-CB 3.31Å; K61-A65 WeakPolarHBondContact O-CB 3.48Å; K61-A65 PolarHBondContact O-N 3.08Å
62F66.4Low67.7Low107 Ų10787.7 Ų87.747%0.46942%0.417SS..Hα-helixtrans-68.4-46.3174.5-150.4-108000111.6R58 F59 Q60 F64 A65 M66R58-F62 PolarHBondContact O-N 2.61Å; F59-F62 HydrophobicContact CD2-CB 3.71Å; F59-F62 HydrophobicContact CD2-CD1 4.08Å; F59-F62 HydrophobicContact CD2-CG 4.08Å; F59-F62 HydrophobicContact CE2-CB 3.91Å; F59-F62 AromaticContact CE2-CD1 3.37Å; F59-F62 HydrophobicContact CE2-CD1 3.37Å; F59-F62 HydrophobicContact CE2-CE1 4.1Å; F59-F62 AromaticContact CE2-CG 3.85Å; F59-F62 HydrophobicContact CE2-CG 3.85Å; F59-F62 HydrophobicContact CG-CB 4.19Å; F59-F62 AromaticContact CZ-CD1 3.8Å; F59-F62 HydrophobicContact CZ-CD1 3.8Å; F59-F62 CarbonylContact O-C 3.14Å; F59-F62 WeakPolarHBondContact O-CB 3.31Å; F59-F62 PolarHBondContact O-N 2.94Å; Q60-F62 VanDerWaalsContact C-N 3.31Å; Q60-F62 PolarHBondContact O-N 2.81Å; F62-F64 PolarHBondContact O-N 3.34Å; F62-A65 PolarHBondContact O-N 3.3Å; F62-M66 HydrophobicContact CD1-CE 4.01Å; F62-M66 HydrophobicContact CE1-CE 3.92Å; F62-M66 VanDerWaalsContact O-CB 3.24Å; F62-M66 WeakPolarHBondContact O-CB 3.28Å; F62-M66 PolarHBondContact O-N 2.74Å
63K72.2Confident69.3Low94 Ų9488.4 Ų88.441%0.40942%0.419SS..Hα-helixtrans-58.6-42.9171.4-72.5163.2177.6160.20111.4C34 E56 F59 Q60 M66 F67C34-K63 PolarHBondContact SG-NZ 2.82Å; E56-K63 IonicContact OE2-NZ 2.82Å; E56-K63 PolarHBondContact OE2-NZ 3.29Å; F59-K63 HydrophobicContact CD1-CD 4.08Å; F59-K63 HydrophobicContact CD1-CG 4.09Å; F59-K63 HydrophobicContact CE1-CD 4.46Å; F59-K63 HydrophobicContact CE1-CG 4.15Å; F59-K63 WeakPolarHBondContact O-CB 3.36Å; F59-K63 VanDerWaalsContact O-CG 3.28Å; F59-K63 WeakPolarHBondContact O-CG 3.32Å; F59-K63 PolarHBondContact O-N 2.87Å; Q60-K63 PolarHBondContact O-N 2.88Å; K63-M66 PolarHBondContact O-N 3.35Å; K63-F67 WeakPolarHBondContact O-CB 3.37Å; K63-F67 PolarHBondContact O-N 3.18Å
64F75.2Confident70.7Confident115 Ų11584 Ų8450%0.50440%0.402SS..Hα-helixtrans-65.6-46.5174.9-98.1-73.8000112.4Q60 F62 M66 F67 V68Q60-F64 HydrophobicContact CG-CD2 3.97Å; Q60-F64 HydrophobicContact CG-CE2 4.07Å; Q60-F64 WeakPolarHBondContact O-CB 3.02Å; Q60-F64 WeakPolarHBondContact O-CD2 3.24Å; Q60-F64 PolarHBondContact O-N 2.98Å; F62-F64 PolarHBondContact O-N 3.34Å; F64-M66 VanDerWaalsContact C-N 3.32Å; F64-M66 PolarHBondContact O-N 3.49Å; F64-F67 PolarHBondContact O-N 3.41Å; F64-V68 WeakPolarHBondContact O-CB 3.38Å; F64-V68 VanDerWaalsContact O-CG2 3.31Å; F64-V68 WeakPolarHBondContact O-CG2 3.27Å; F64-V68 PolarHBondContact O-N 2.77Å
65A75.4Confident72Confident55 Ų5585.2 Ų85.246%0.45542%0.416SS..Hα-helixtrans-59.7-45.4175.700000110.9K61 F62 F67 V68 V69K61-A65 VanDerWaalsContact O-CB 3.31Å; K61-A65 WeakPolarHBondContact O-CB 3.48Å; K61-A65 PolarHBondContact O-N 3.08Å; F62-A65 PolarHBondContact O-N 3.3Å; A65-F67 PolarHBondContact O-N 2.85Å; A65-V68 PolarHBondContact O-N 3.34Å; A65-V69 WeakPolarHBondContact O-CB 3.31Å; A65-V69 VanDerWaalsContact O-CG2 3.27Å; A65-V69 WeakPolarHBondContact O-CG2 3.43Å; A65-V69 PolarHBondContact O-N 2.87Å
66M77Confident73.1Confident117 Ų11791.9 Ų91.958%0.57644%0.44SS*.Hα-helixtrans-63-39.6176-166.3-179.7-64.100112.2F62 K63 F64 F70F62-M66 HydrophobicContact CD1-CE 4.01Å; F62-M66 HydrophobicContact CE1-CE 3.92Å; F62-M66 VanDerWaalsContact O-CB 3.24Å; F62-M66 WeakPolarHBondContact O-CB 3.28Å; F62-M66 PolarHBondContact O-N 2.74Å; K63-M66 PolarHBondContact O-N 3.35Å; F64-M66 VanDerWaalsContact C-N 3.32Å; F64-M66 PolarHBondContact O-N 3.49Å; M66-F70 VanDerWaalsContact O-CB 3.27Å; M66-F70 WeakPolarHBondContact O-CB 3.21Å; M66-F70 PolarHBondContact O-N 2.89Å
67F78.9Confident73.9Confident114 Ų11496.2 Ų96.250%0.545%0.454SS..Hα-helixtrans-69.9-40.1176.3-179.2-98.9000112.9K63 F64 A65 F70 Q71K63-F67 WeakPolarHBondContact O-CB 3.37Å; K63-F67 PolarHBondContact O-N 3.18Å; F64-F67 PolarHBondContact O-N 3.41Å; A65-F67 PolarHBondContact O-N 2.85Å; F67-F70 PolarHBondContact O-N 3.4Å; F67-Q71 HydrophobicContact CD1-CG 4.23Å; F67-Q71 HydrophobicContact CE1-CG 3.83Å; F67-Q71 HydrophobicContact CE2-CG 4.42Å; F67-Q71 HydrophobicContact CZ-CG 3.95Å; F67-Q71 WeakPolarHBondContact O-CB 3.27Å; F67-Q71 WeakPolarHBondContact O-CG 3.44Å; F67-Q71 PolarHBondContact O-N 3.48Å
68V84.2Confident74.8Confident87 Ų87101 Ų10153%0.52747%0.472SS..Hα-helixtrans-65.8-43.3174.2169.70000110.5F64 A65 F70 Q71 W72F64-V68 WeakPolarHBondContact O-CB 3.38Å; F64-V68 VanDerWaalsContact O-CG2 3.31Å; F64-V68 WeakPolarHBondContact O-CG2 3.27Å; F64-V68 PolarHBondContact O-N 2.77Å; A65-V68 PolarHBondContact O-N 3.34Å; V68-F70 VanDerWaalsContact C-N 3.32Å; V68-F70 PolarHBondContact O-N 2.81Å; V68-Q71 PolarHBondContact O-N 3.24Å; V68-W72 VanDerWaalsContact O-CB 3.27Å; V68-W72 WeakPolarHBondContact O-CB 3.45Å; V68-W72 PolarHBondContact O-N 2.82Å
69V80.4Confident75.5Confident88 Ų88108 Ų10853%0.53350%0.498SS..Hα-helixtrans-59.5-42.3171.5166.80000111.1A65 W72 N73A65-V69 WeakPolarHBondContact O-CB 3.31Å; A65-V69 VanDerWaalsContact O-CG2 3.27Å; A65-V69 WeakPolarHBondContact O-CG2 3.43Å; A65-V69 PolarHBondContact O-N 2.87Å; V69-W72 PolarHBondContact O-N 3.46Å; V69-N73 VanDerWaalsContact O-CB 3.28Å; V69-N73 WeakPolarHBondContact O-CB 3.1Å; V69-N73 PolarHBondContact O-N 3.49Å
70F85.2Confident75.9Confident122 Ų122109.3 Ų109.354%0.53551%0.512SS..Hα-helixtrans-65.6-47177.7-173.4-104.9000112.5M66 F67 V68 W72 N73 L74M66-F70 VanDerWaalsContact O-CB 3.27Å; M66-F70 WeakPolarHBondContact O-CB 3.21Å; M66-F70 PolarHBondContact O-N 2.89Å; F67-F70 PolarHBondContact O-N 3.4Å; V68-F70 VanDerWaalsContact C-N 3.32Å; V68-F70 PolarHBondContact O-N 2.81Å; F70-W72 PolarHBondContact O-N 2.86Å; F70-N73 WeakPolarHBondContact O-CB 3.3Å; F70-N73 PolarHBondContact O-N 3.26Å; F70-L74 HydrophobicContact CD1-CD1 3.96Å; F70-L74 HydrophobicContact CD1-CG 4.5Å; F70-L74 HydrophobicContact CE1-CD1 3.57Å; F70-L74 HydrophobicContact CE1-CG 4.27Å; F70-L74 HydrophobicContact CZ-CD1 4.11Å; F70-L74 HydrophobicContact CZ-CG 4.49Å; F70-L74 WeakPolarHBondContact O-CG 3.49Å; F70-L74 PolarHBondContact O-N 3.32Å
71Q80Confident76.1Confident99 Ų99113.3 Ų113.346%0.46353%0.525SS..Hα-helixtrans-60.3-43.6173.9-79.3-70.6-0.500112.1F67 V68 N73 L74 G75F67-Q71 HydrophobicContact CD1-CG 4.23Å; F67-Q71 HydrophobicContact CE1-CG 3.83Å; F67-Q71 HydrophobicContact CE2-CG 4.42Å; F67-Q71 HydrophobicContact CZ-CG 3.95Å; F67-Q71 WeakPolarHBondContact O-CB 3.27Å; F67-Q71 WeakPolarHBondContact O-CG 3.44Å; F67-Q71 PolarHBondContact O-N 3.48Å; V68-Q71 PolarHBondContact O-N 3.24Å; Q71-N73 VanDerWaalsContact C-N 3.31Å; Q71-N73 PolarHBondContact O-N 2.84Å; Q71-L74 PolarHBondContact O-N 3.41Å; Q71-G75 PolarHBondContact O-N 3.43Å
72W83Confident75.8Confident181 Ų181112.6 Ų112.669%0.68653%0.527SS*.Hα-helixtrans-62.8-38.9176.3-170.815.3000111.5V68 V69 F70 G75 R76V68-W72 VanDerWaalsContact O-CB 3.27Å; V68-W72 WeakPolarHBondContact O-CB 3.45Å; V68-W72 PolarHBondContact O-N 2.82Å; V69-W72 PolarHBondContact O-N 3.46Å; F70-W72 PolarHBondContact O-N 2.86Å; W72-G75 PolarHBondContact O-N 2.82Å; W72-R76 VanDerWaalsContact O-CB 3.29Å; W72-R76 WeakPolarHBondContact O-CB 3.42Å; W72-R76 WeakPolarHBondContact O-CG 2.84Å; W72-R76 PolarHBondContact O-N 2.85Å
73N88.9Confident76Confident83 Ų83111.7 Ų111.744%0.44453%0.531SS..Hα-helixtrans-65.8-39.9174.4-162.3-32.2000112V69 F70 Q71 R76 R77V69-N73 VanDerWaalsContact O-CB 3.28Å; V69-N73 WeakPolarHBondContact O-CB 3.1Å; V69-N73 PolarHBondContact O-N 3.49Å; F70-N73 WeakPolarHBondContact O-CB 3.3Å; F70-N73 PolarHBondContact O-N 3.26Å; Q71-N73 VanDerWaalsContact C-N 3.31Å; Q71-N73 PolarHBondContact O-N 2.84Å; N73-R76 WeakPolarHBondContact O-CB 3.43Å; N73-R76 PolarHBondContact O-N 3.27Å; N73-R77 WeakPolarHBondContact O-CG 3.48Å; N73-R77 PolarHBondContact O-N 3.3Å; N73-R77 VanDerWaalsContact O-N 3.08Å
74L78.9Confident75.9Confident68 Ų68113.8 Ų113.836%0.35654%0.54SS..Hα-helixtrans-67.7-42.5173.3-69.1179.3000112.8F70 Q71 R76 R77 K78F70-L74 HydrophobicContact CD1-CD1 3.96Å; F70-L74 HydrophobicContact CD1-CG 4.5Å; F70-L74 HydrophobicContact CE1-CD1 3.57Å; F70-L74 HydrophobicContact CE1-CG 4.27Å; F70-L74 HydrophobicContact CZ-CD1 4.11Å; F70-L74 HydrophobicContact CZ-CG 4.49Å; F70-L74 WeakPolarHBondContact O-CG 3.49Å; F70-L74 PolarHBondContact O-N 3.32Å; Q71-L74 PolarHBondContact O-N 3.41Å; L74-R76 VanDerWaalsContact C-N 3.32Å; L74-R76 PolarHBondContact O-N 2.98Å; L74-R77 WeakPolarHBondContact O-CB 3.45Å; L74-R77 PolarHBondContact O-N 2.75Å; L74-R77 VanDerWaalsContact O-N 3.09Å; L74-K78 PolarHBondContact O-N 3Å
75G79.9Confident75.4Confident34 Ų34112.6 Ų112.635%0.35154%0.542SS..Hα-helixtrans-64.8-34.7174.500000113.1Q71 W72 R77 R79Q71-G75 PolarHBondContact O-N 3.43Å; W72-G75 PolarHBondContact O-N 2.82Å; G75-R77 VanDerWaalsContact C-N 3.34Å; G75-R79 PolarHBondContact O-N 3Å
76R77.4Confident74.7Confident177 Ų177118.3 Ų118.367%0.66856%0.559SS**Hα-helixtrans-58.4-42.1167.4-91.6-78.2-58.7-176.35.6111.8W72 N73 L74W72-R76 VanDerWaalsContact O-CB 3.29Å; W72-R76 WeakPolarHBondContact O-CB 3.42Å; W72-R76 WeakPolarHBondContact O-CG 2.84Å; W72-R76 PolarHBondContact O-N 2.85Å; N73-R76 WeakPolarHBondContact O-CB 3.43Å; N73-R76 PolarHBondContact O-N 3.27Å; L74-R76 VanDerWaalsContact C-N 3.32Å; L74-R76 PolarHBondContact O-N 2.98Å
77R72.6Confident74.2Confident146 Ų146120.1 Ų120.155%0.55157%0.566SS**Hα-helixtrans-67.9-47.5176.8-68.8-174.1-161.4-1587.3112.3N73 L74 G75 R79 S80 Y81N73-R77 WeakPolarHBondContact O-CG 3.48Å; N73-R77 PolarHBondContact O-N 3.3Å; N73-R77 VanDerWaalsContact O-N 3.08Å; L74-R77 WeakPolarHBondContact O-CB 3.45Å; L74-R77 PolarHBondContact O-N 2.75Å; L74-R77 VanDerWaalsContact O-N 3.09Å; G75-R77 VanDerWaalsContact C-N 3.34Å; R77-R79 PolarHBondContact O-N 2.7Å; R77-S80 WeakPolarHBondContact O-CA 3.28Å; R77-S80 VanDerWaalsContact O-CB 3.28Å; R77-S80 WeakPolarHBondContact O-CB 3.48Å; R77-S80 PolarHBondContact O-N 2.65Å; R77-Y81 HydrophobicContact CB-CE2 4.35Å; R77-Y81 WeakPolarHBondContact O-CD2 3.45Å
78K74.1Confident73.6Confident161 Ų161124.1 Ų124.170%0.758%0.578SS**Hα-helixtrans-53.9-49.8-176.9-76.2-167.8174.7-1730113.1L74 S80 Y81L74-K78 PolarHBondContact O-N 3Å; K78-S80 PolarHBondContact O-N 3.5Å; K78-S80 VanDerWaalsContact O-N 3.09Å; K78-Y81 PolarHBondContact O-N 3.27Å
79R67.4Low72.9Confident187 Ų187125.7 Ų125.771%0.70659%0.59SS**Hα-helixtrans-60.8-18.7176-80.5-169.6-76.9-177.4-7.4114.5G75 R77 Y81G75-R79 PolarHBondContact O-N 3Å; R77-R79 PolarHBondContact O-N 2.7Å; R79-Y81 VanDerWaalsContact C-N 3.34Å
80S69.8Low72.6Confident64 Ų64129.6 Ų129.645%0.44861%0.607SS.*Hα-helixtrans-84.1-4.1175.3-171.20000114.2R77 K78 K84R77-S80 WeakPolarHBondContact O-CA 3.28Å; R77-S80 VanDerWaalsContact O-CB 3.28Å; R77-S80 WeakPolarHBondContact O-CB 3.48Å; R77-S80 PolarHBondContact O-N 2.65Å; K78-S80 PolarHBondContact O-N 3.5Å; K78-S80 VanDerWaalsContact O-N 3.09Å; S80-K84 WeakPolarHBondContact O-CE 3.41Å
81Y61.1Low72Confident156 Ų156131.7 Ų131.761%0.61262%0.624SS**Hα-helixtrans-101.9-43.7174.6-68.4-79.6000112.2R77 K78 R79 V83 K84 T85R77-Y81 HydrophobicContact CB-CE2 4.35Å; R77-Y81 WeakPolarHBondContact O-CD2 3.45Å; K78-Y81 PolarHBondContact O-N 3.27Å; R79-Y81 VanDerWaalsContact C-N 3.34Å; Y81-V83 VanDerWaalsContact C-N 3.34Å; Y81-V83 PolarHBondContact O-N 2.83Å; Y81-K84 WeakPolarHBondContact O-CA 3.23Å; Y81-K84 WeakPolarHBondContact O-CB 3.18Å; Y81-K84 PolarHBondContact O-N 2.79Å; Y81-T85 PolarHBondContact O-N 2.76Å; Y81-T85 PolarHBondContact O-OG1 3.16Å
82D63.7Low71.1Confident109 Ų109141 Ų14158%0.58366%0.655SS**Hα-helixtrans-52.2-49.4-178.6-105-52000113K84 T85 E86D82-K84 PolarHBondContact O-N 2.95Å; D82-K84 VanDerWaalsContact O-N 3.1Å; D82-T85 WeakPolarHBondContact CA-OG1 3.24Å; D82-T85 PolarHBondContact O-N 2.72Å; D82-T85 PolarHBondContact O-OG1 2.93Å; D82-E86 PolarHBondContact O-N 2.71Å
83V70.1Confident70.5Confident89 Ų89139.1 Ų139.154%0.53965%0.653SS.*Hα-helixtrans-58.5-25.8178.1-178.90000112.4Y81 Q87Y81-V83 VanDerWaalsContact C-N 3.34Å; Y81-V83 PolarHBondContact O-N 2.83Å; V83-Q87 WeakPolarHBondContact O-CG 3.31Å
84K71.4Confident69.5Low137 Ų137142 Ų14260%0.59666%0.664SS**Hα-helixtrans-86.1-18.9177-59.2-175.6177.9-174.50113.2S80 Y81 D82S80-K84 WeakPolarHBondContact O-CE 3.41Å; Y81-K84 WeakPolarHBondContact O-CA 3.23Å; Y81-K84 WeakPolarHBondContact O-CB 3.18Å; Y81-K84 PolarHBondContact O-N 2.79Å; D82-K84 PolarHBondContact O-N 2.95Å; D82-K84 VanDerWaalsContact O-N 3.1Å
85T63.5Low69Low90 Ų90146.1 Ų146.155%0.55268%0.681SS**Hα-helixtrans-84.3-39.1175.320.30000112.4Y81 D82 Q87 R88Y81-T85 PolarHBondContact O-N 2.76Å; Y81-T85 PolarHBondContact O-OG1 3.16Å; D82-T85 WeakPolarHBondContact CA-OG1 3.24Å; D82-T85 PolarHBondContact O-N 2.72Å; D82-T85 PolarHBondContact O-OG1 2.93Å; T85-Q87 VanDerWaalsContact C-N 3.28Å; T85-Q87 PolarHBondContact O-N 2.78Å; T85-R88 WeakPolarHBondContact O-CB 3.4Å; T85-R88 PolarHBondContact O-N 3.49Å
86E61.3Low68.3Low175 Ų175152.7 Ų152.782%0.81870%0.701SS**Hα-helixtrans-61.1-35.8172-92.4-172.385.600112.6D82 R88D82-E86 PolarHBondContact O-N 2.71Å; E86-R88 PolarHBondContact O-N 2.86Å; E86-R88 VanDerWaalsContact O-N 3.16Å
87Q66.4Low67.8Low155 Ų155151.2 Ų151.272%0.72470%0.703SS**THydrogen-bonded Turntrans-75.67179.5-71.8-168.8-35.700114.9V83 T85 P89V83-Q87 WeakPolarHBondContact O-CG 3.31Å; T85-Q87 VanDerWaalsContact C-N 3.28Å; T85-Q87 PolarHBondContact O-N 2.78Å; Q87-P89 WeakPolarHBondContact O-CD 3.32Å
88R67Low67.4Low199 Ų199151.5 Ų151.575%0.75171%0.713SS**SBendtrans-84.1107.6175.9-69.8-95-84.8-159-8.5109T85 E86 L90T85-R88 WeakPolarHBondContact O-CB 3.4Å; T85-R88 PolarHBondContact O-N 3.49Å; E86-R88 PolarHBondContact O-N 2.86Å; E86-R88 VanDerWaalsContact O-N 3.16Å; R88-L90 PolarHBondContact O-N 2.87Å
89P69.5Low67Low119 Ų119150.9 Ų150.977%0.77371%0.714SS**  trans-60136.1174.626.4-34.4000109.7Q87 N91Q87-P89 WeakPolarHBondContact O-CD 3.32Å; P89-N91 PolarHBondContact O-N 3.16Å
90L73.8Confident66.9Low171 Ų171148.1 Ų148.190%0.89572%0.715SS**  trans-71.992.7-177.8-161.285.1000109.3R88 R92R88-L90 PolarHBondContact O-N 2.87Å; L90-R92 PolarHBondContact O-N 3.46Å
91N72.9Confident66.7Low165 Ų165155.1 Ų155.188%0.88274%0.737SS**  trans-77.186.7-175.5-172.330.1000112.2P89P89-N91 PolarHBondContact O-N 3.16Å
92R59.8Low67.2Low296 Ų296155 Ų155100%1.11775%0.748SS**  trans-147.70158.4171177.6-82.5-156.3-3.7108.8L90L90-R92 PolarHBondContact O-N 3.46Å

Retrieved 92 of 92 residues in 28.5 ms (Link to these results)

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