A0A087XJZ6_POEFO Loading...

Si:dkey-28n18.9

AlphaFold DB , UniProt , Accession A0A087XJZ6, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 374 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
1M33.8Very low43.4Very low240 Ų240148.6 Ų148.6100%1.18280%0.795SS**  0100.80-66.9-172.3-54.300106
2Q29.2Very low47.2Very low197 Ų197136.7 Ų136.792%0.92173%0.731SS**  trans-79.4123.5173.2-77171.3-4700106.5E4Q2-E4 PolarHBondContact O-N 2.89Å
3E32Very low50.4Low187 Ų187128.6 Ų128.687%0.87469%0.692SS**  trans-66.7114.6166.4-77.5177.3149.200107.5V5E3-V5 PolarHBondContact O-N 3.26Å
4E31.8Very low53.3Low192 Ų192119.4 Ų119.490%0.89764%0.643SS**  trans-62.5100.5164.3-78.9-179.9150.800107.8Q2 N6Q2-E4 PolarHBondContact O-N 2.89Å; E4-N6 PolarHBondContact O-N 3.3Å
5V34Very low55.6Low126 Ų126116.9 Ų116.976%0.76462%0.621SS**  trans-64.4107161.8178.30000105.8E3 E7E3-V5 PolarHBondContact O-N 3.26Å; V5-E7 VanDerWaalsContact C-N 3.28Å; V5-E7 PolarHBondContact O-N 3.04Å
6N33.2Very low57.6Low157 Ų157110.3 Ų110.384%0.8459%0.59SS**  trans-6290.3175.2-148.3-0.9000107.7E4 A8E4-N6 PolarHBondContact O-N 3.3Å; N6-A8 VanDerWaalsContact C-N 3.3Å; N6-A8 PolarHBondContact O-N 3.46Å
7E38.3Very low59.5Low170 Ų170112 Ų11279%0.79459%0.593SS**  trans-6294.5172.1-90.3-173.2155.600107.8V5 T9V5-E7 VanDerWaalsContact C-N 3.28Å; V5-E7 PolarHBondContact O-N 3.04Å; E7-T9 PolarHBondContact O-N 3.25Å
8A45.9Very low61.3Low92 Ų92107.1 Ų107.176%0.7657%0.568SS**  trans-58.2108163.500000107.2N6 S10N6-A8 VanDerWaalsContact C-N 3.3Å; N6-A8 PolarHBondContact O-N 3.46Å; A8-S10 PolarHBondContact O-N 3.42Å
9T54.6Low63.1Low137 Ų137101.4 Ų101.484%0.8454%0.538SS*.  trans-46.6107173.315.60000109.3E7 V11E7-T9 PolarHBondContact O-N 3.25Å; T9-V11 PolarHBondContact O-N 3.08Å
10S62.3Low64.7Low47 Ų47102 Ų10233%0.32954%0.535SS..  trans-62.5124.3-179.8176.60000109.2A8 L12 V14A8-S10 PolarHBondContact O-N 3.42Å; S10-L12 VanDerWaalsContact C-N 3.29Å; S10-L12 PolarHBondContact OG-N 3.37Å; S10-L12 PolarHBondContact OG-O 3.27Å; S10-V14 PolarHBondContact OG-O 3Å
11V82Confident66.2Low90 Ų9097.4 Ų97.455%0.54551%0.512SS..SBendtrans-73.3-27.7175.9-179.10000111.1T9 K130T9-V11 PolarHBondContact O-N 3.08Å; V11-K130 HydrophobicContact CB-CG 4.49Å; V11-K130 HydrophobicContact CG1-CB 4.49Å; V11-K130 HydrophobicContact CG1-CG 4.1Å; V11-K130 HydrophobicContact CG2-CG 4.17Å
12L89Confident68.8Low5 Ų588.4 Ų88.43%0.02647%0.47CS..SBendtrans-83.2150.6177-63.3173.1000110.5S10 V14 A123 S129 V134 E135 L138S10-L12 VanDerWaalsContact C-N 3.29Å; S10-L12 PolarHBondContact OG-N 3.37Å; S10-L12 PolarHBondContact OG-O 3.27Å; L12-V14 HydrophobicContact CB-CG2 4Å; L12-V14 HydrophobicContact CD1-CG2 4.35Å; L12-V14 PolarHBondContact O-N 3.49Å; L12-V14 VanDerWaalsContact O-N 3.07Å; L12-A123 HydrophobicContact CD1-CB 3.76Å; L12-S129 VanDerWaalsContact CD2-O 3.26Å; L12-S129 WeakPolarHBondContact CD2-O 3.26Å; L12-V134 HydrophobicContact CD1-CG1 3.94Å; L12-V134 HydrophobicContact CD2-CB 4.26Å; L12-V134 HydrophobicContact CD2-CG1 3.89Å; L12-E135 VanDerWaalsContact CA-OE2 3.3Å; L12-E135 WeakPolarHBondContact CA-OE2 3.43Å; L12-E135 HydrophobicContact CD2-CB 4.05Å; L12-E135 WeakPolarHBondContact CD2-OE2 3.38Å; L12-L138 HydrophobicContact CD1-CD1 4.36Å
13S89.8Confident71.5Confident32 Ų3284.5 Ų84.522%0.22445%0.452CS..SBendtrans-75.111.3172.176.90000113.5L40 Y46 E135S13-L40 WeakPolarHBondContact O-CB 3.42Å; S13-L40 PolarHBondContact O-N 3.09Å; S13-Y46 PolarHBondContact OG-OH 2.93Å; S13-E135 WeakPolarHBondContact CB-OE1 3.22Å; S13-E135 PolarHBondContact N-OE2 3.31Å; S13-E135 PolarHBondContact OG-OE1 3.29Å
14V90.8Very high74.2Confident0 Ų076.3 Ų76.30%042%0.415CS..BIsolated β-bridgetrans-130.7151.8179.8-59.40000111.7S10 L12 G16 Q38 Y46 L138 T139S10-V14 PolarHBondContact OG-O 3Å; L12-V14 HydrophobicContact CB-CG2 4Å; L12-V14 HydrophobicContact CD1-CG2 4.35Å; L12-V14 PolarHBondContact O-N 3.49Å; L12-V14 VanDerWaalsContact O-N 3.07Å; V14-G16 PolarHBondContact O-N 3.04Å; V14-Q38 CarbonylContact C-O 3.52Å; V14-Q38 WeakPolarHBondContact CA-O 3.38Å; V14-Q38 WeakPolarHBondContact CB-O 3.49Å; V14-Y46 HydrophobicContact CG1-CD2 3.41Å; V14-Y46 VanDerWaalsContact CG1-CD2 3.41Å; V14-Y46 HydrophobicContact CG1-CE2 3.5Å; V14-L138 HydrophobicContact CG2-CB 4.47Å; V14-L138 HydrophobicContact CG2-CD1 3.89Å; V14-T139 HydrophobicContact CG1-CG2 3.86Å
15Y87.9Confident76.8Confident81 Ų8170.1 Ų70.132%0.31839%0.393SS..  trans-75.7104.6169.4-69.1-77.5000109.9H17 T18 Q38 K39 L40Y15-H17 AromaticContact CD1-CE1 3.93Å; Y15-H17 PolarHBondContact O-N 3.48Å; Y15-H17 VanDerWaalsContact O-N 3.1Å; Y15-T18 HydrophobicContact CG-CG2 4.39Å; Y15-T18 WeakPolarHBondContact O-CB 3.39Å; Y15-T18 PolarHBondContact O-N 3.14Å; Y15-T18 PolarHBondContact O-OG1 3.08Å; Y15-Q38 HydrophobicContact CD2-CB 4.15Å; Y15-Q38 HydrophobicContact CD2-CG 3.99Å; Y15-Q38 HydrophobicContact CE2-CG 4.48Å; Y15-Q38 PolarHBondContact N-O 3.07Å; Y15-K39 WeakPolarHBondContact CE2-O 3.21Å; Y15-L40 HydrophobicContact CD1-CD1 3.82Å; Y15-L40 HydrophobicContact CD2-CD1 4.42Å; Y15-L40 HydrophobicContact CE1-CD1 3.45Å; Y15-L40 VanDerWaalsContact CE1-CD1 3.45Å; Y15-L40 HydrophobicContact CE2-CD1 4.1Å; Y15-L40 HydrophobicContact CG-CD1 4.3Å
16G87.4Confident79.2Confident12 Ų1267.7 Ų67.712%0.12437%0.373CS..G310 helixtrans-53-36.4-174.600000115V14 T18 V19V14-G16 PolarHBondContact O-N 3.04Å; G16-T18 PolarHBondContact O-N 2.82Å; G16-V19 WeakPolarHBondContact O-CG2 3.44Å; G16-V19 PolarHBondContact O-N 2.75Å
17H89.6Confident81.5Confident139 Ų13966.4 Ų66.464%0.64437%0.366SS*.G310 helixtrans-68.8-18.4177.967.2-88.3000113.8Y15 R120Y15-H17 AromaticContact CD1-CE1 3.93Å; Y15-H17 PolarHBondContact O-N 3.48Å; Y15-H17 VanDerWaalsContact O-N 3.1Å; H17-R120 PolarHBondContact O-NE 3.36Å
18T91.9Very high83.5Confident23 Ų2360.7 Ų60.714%0.14135%0.353CS..G310 helixtrans-87.6-11.6-178.770.80000113.5Y15 G16 K20 Q38Y15-T18 HydrophobicContact CG-CG2 4.39Å; Y15-T18 WeakPolarHBondContact O-CB 3.39Å; Y15-T18 PolarHBondContact O-N 3.14Å; Y15-T18 PolarHBondContact O-OG1 3.08Å; G16-T18 PolarHBondContact O-N 2.82Å; T18-K20 PolarHBondContact O-N 3.32Å; T18-Q38 HydrophobicContact CG2-CB 3.99Å; T18-Q38 VanDerWaalsContact OG1-CB 3.3Å; T18-Q38 WeakPolarHBondContact OG1-CB 3.3Å; T18-Q38 PolarHBondContact OG1-N 3.34Å
19V96Very high85.1Confident0 Ų061.6 Ų61.60%035%0.345CS..  trans-56.8127.1-179.9178.60000109.6G16 I35 V36 L119 R120 L138G16-V19 WeakPolarHBondContact O-CG2 3.44Å; G16-V19 PolarHBondContact O-N 2.75Å; V19-I35 HydrophobicContact CG1-CG2 3.93Å; V19-V36 CarbonylContact C-O 3.57Å; V19-V36 WeakPolarHBondContact CA-O 3.42Å; V19-L119 HydrophobicContact CG1-CB 3.89Å; V19-L119 HydrophobicContact CG1-CD1 4.03Å; V19-R120 HydrophobicContact CB-CG 4.24Å; V19-R120 PolarHBondContact O-NE 3.36Å; V19-R120 PolarHBondContact O-NH2 2.99Å; V19-L138 HydrophobicContact CG1-CD2 4.03Å; V19-L138 HydrophobicContact CG2-CD1 4.24Å; V19-L138 HydrophobicContact CG2-CD2 4.24Å
20K95.6Very high86.5Confident112 Ų11258.5 Ų58.549%0.48733%0.326SS..EExtended strand (participates in β ladder)trans-132.5140.6179-73.9176.6-176.4176.70111T18 T22 I35 V36 E116T18-K20 PolarHBondContact O-N 3.32Å; K20-T22 HydrophobicContact CB-CG2 3.82Å; K20-I35 CarbonylContact O-C 3.59Å; K20-I35 VanDerWaalsContact O-CA 3.31Å; K20-I35 WeakPolarHBondContact O-CA 3.24Å; K20-V36 PolarHBondContact N-O 2.9Å; K20-V36 PolarHBondContact O-N 3.41Å; K20-E116 VanDerWaalsContact CA-OE2 3.24Å; K20-E116 WeakPolarHBondContact CA-OE2 3.45Å
21V94.6Very high87.8Confident6 Ų656.7 Ų56.74%0.03631%0.312CS..EExtended strand (participates in β ladder)trans-101.5100.5167.5-176.20000106.4F33 I35 C112 L115 E116 L119V21-F33 HydrophobicContact CG1-CB 3.93Å; V21-F33 HydrophobicContact CG1-CD1 4.17Å; V21-F33 HydrophobicContact CG1-CG 4.41Å; V21-I35 HydrophobicContact CG2-CG1 4.36Å; V21-C112 HydrophobicContact CB-CB 4.11Å; V21-C112 WeakPolarHBondContact CB-O 3.45Å; V21-C112 HydrophobicContact CG1-CB 3.75Å; V21-L115 HydrophobicContact CG2-CB 4.18Å; V21-E116 HydrophobicContact CB-CB 4.16Å; V21-E116 HydrophobicContact CG2-CB 3.82Å; V21-E116 PolarHBondContact N-OE2 3.42Å; V21-E116 VanDerWaalsContact N-OE2 3.14Å; V21-L119 HydrophobicContact CG2-CD1 4.12Å
22T89.2Confident88.2Confident51 Ų5153.9 Ų53.931%0.31330%0.296SS..EExtended strand (participates in β ladder)trans-92.1-43.2-161.453.70000112.7K20 I34 V36K20-T22 HydrophobicContact CB-CG2 3.82Å; T22-I34 PolarHBondContact N-O 3.27Å; T22-I34 PolarHBondContact OG1-O 3.18Å; T22-V36 HydrophobicContact CG2-CB 4.1Å; T22-V36 HydrophobicContact CG2-CG2 3.7Å
23E86Confident88.4Confident115 Ų11553.7 Ų53.754%0.53729%0.294SS..EExtended strand (participates in β ladder)trans-137.3156.5-173.1-65.2-178.6-171.400110.4F33 I34E23-F33 WeakPolarHBondContact O-CA 3.36Å; E23-I34 HydrophobicContact CB-CB 4.09Å; E23-I34 HydrophobicContact CB-CD1 3.74Å; E23-I34 HydrophobicContact CB-CG1 4.21Å; E23-I34 PolarHBondContact O-N 2.74Å; E23-I34 WeakPolarHBondContact OE2-CD1 3.46Å
24V88.2Confident88.6Confident16 Ų1654 Ų5410%0.09729%0.293CS..EExtended strand (participates in β ladder)trans-131.4135170.964.50000108.7L31 T32 F33 T105 W108V24-L31 HydrophobicContact CG2-CB 4.12Å; V24-L31 HydrophobicContact CG2-CD2 4.14Å; V24-T32 CarbonylContact C-O 3.55Å; V24-T32 WeakPolarHBondContact CA-O 3.13Å; V24-F33 HydrophobicContact CB-CD1 4.05Å; V24-F33 HydrophobicContact CB-CE1 4.24Å; V24-F33 HydrophobicContact CG2-CD1 3.79Å; V24-F33 HydrophobicContact CG2-CE1 3.66Å; V24-F33 HydrophobicContact CG2-CZ 4.39Å; V24-T105 HydrophobicContact CG1-CG2 4.42Å; V24-W108 HydrophobicContact CB-CB 4.48Å; V24-W108 HydrophobicContact CG1-CB 3.51Å; V24-W108 HydrophobicContact CG1-CG 3.79Å
25S86.8Confident88.9Confident61 Ų6154 Ų5443%0.42729%0.293SS..EExtended strand (participates in β ladder)trans-113.1146.2167.958.20000109.2L31 T32S25-L31 WeakPolarHBondContact O-CA 3.43Å; S25-T32 PolarHBondContact N-O 3.47Å; S25-T32 PolarHBondContact O-N 2.93Å; S25-T32 PolarHBondContact OG-O 3.29Å
26Q84.1Confident89.3Confident75 Ų7550.9 Ų50.935%0.3528%0.282SS..EExtended strand (participates in β ladder)trans-116.9124.2177.6-179.5-179.2-16.700108.9G28 T30 L31 V85Q26-G28 WeakPolarHBondContact CG-O 3.47Å; Q26-G28 PolarHBondContact NE2-O 3.44Å; Q26-T30 WeakPolarHBondContact CA-O 3.26Å; Q26-L31 HydrophobicContact CB-CD2 3.73Å; Q26-L31 HydrophobicContact CG-CD2 3.83Å; Q26-V85 HydrophobicContact CG-CG1 4.31Å
27D80.9Confident89.6Confident131 Ų13150.3 Ų50.370%0.70128%0.277SS*.EExtended strand (participates in β ladder)trans-122.6105170.3-176.622.7000109.3D29 T30D27-D29 PolarHBondContact O-N 2.9Å; D27-D29 VanDerWaalsContact O-N 3.16Å; D27-T30 PolarHBondContact N-O 2.95Å; D27-T30 WeakPolarHBondContact O-CB 3.34Å; D27-T30 PolarHBondContact O-N 3.44Å
28G81.5Confident89.8Confident49 Ų4947.4 Ų47.451%0.50526%0.264SS..THydrogen-bonded Turntrans57.5-116.1-170.600000112.2Q26Q26-G28 WeakPolarHBondContact CG-O 3.47Å; Q26-G28 PolarHBondContact NE2-O 3.44Å
29D79.4Confident89.9Confident112 Ų11249.4 Ų49.460%0.59927%0.27SS*.THydrogen-bonded Turntrans-92.4-1177.3-68-32.6000113.3D27 N86D27-D29 PolarHBondContact O-N 2.9Å; D27-D29 VanDerWaalsContact O-N 3.16Å; D29-N86 PolarHBondContact OD1-ND2 3.46Å
30T83.3Confident89.5Confident72 Ų7252.5 Ų52.544%0.44229%0.286SS..EExtended strand (participates in β ladder)trans-99.5129.5-175.6-51.60000110.4Q26 D27 T51Q26-T30 WeakPolarHBondContact CA-O 3.26Å; D27-T30 PolarHBondContact N-O 2.95Å; D27-T30 WeakPolarHBondContact O-CB 3.34Å; D27-T30 PolarHBondContact O-N 3.44Å; T30-T51 HydrophobicContact CG2-CG2 4Å
31L88.9Confident88.9Confident8 Ų852.3 Ų52.34%0.04230%0.299CS..EExtended strand (participates in β ladder)trans-101.6132.1168.2-61.3179.4000109.9V24 S25 Q26 F33 T51 P83 V85 W108V24-L31 HydrophobicContact CG2-CB 4.12Å; V24-L31 HydrophobicContact CG2-CD2 4.14Å; S25-L31 WeakPolarHBondContact O-CA 3.43Å; Q26-L31 HydrophobicContact CB-CD2 3.73Å; Q26-L31 HydrophobicContact CG-CD2 3.83Å; L31-F33 HydrophobicContact CB-CE1 4.49Å; L31-F33 HydrophobicContact CB-CE2 3.99Å; L31-F33 HydrophobicContact CB-CZ 3.8Å; L31-F33 HydrophobicContact CD1-CZ 3.99Å; L31-T51 WeakPolarHBondContact O-CA 3.47Å; L31-P83 HydrophobicContact CD1-CB 3.98Å; L31-P83 HydrophobicContact CD1-CG 3.6Å; L31-V85 HydrophobicContact CD1-CG2 3.87Å; L31-V85 HydrophobicContact CD2-CG2 4.08Å; L31-V85 HydrophobicContact CG-CG2 3.68Å; L31-W108 HydrophobicContact CD1-CD2 4.02Å; L31-W108 HydrophobicContact CD1-CE3 3.93Å; L31-W108 HydrophobicContact CD1-CH2 3.67Å; L31-W108 HydrophobicContact CD1-CZ2 3.71Å; L31-W108 HydrophobicContact CD1-CZ3 3.78Å; L31-W108 HydrophobicContact CD2-CZ2 4.11Å; L31-W108 HydrophobicContact CG-CZ2 4.49Å
32T91.6Very high88Confident32 Ų3253.9 Ų53.920%0.19632%0.316CS..EExtended strand (participates in β ladder)trans-116.9123.8173.4-57.90000109V24 S25 D49V24-T32 CarbonylContact C-O 3.55Å; V24-T32 WeakPolarHBondContact CA-O 3.13Å; S25-T32 PolarHBondContact N-O 3.47Å; S25-T32 PolarHBondContact O-N 2.93Å; S25-T32 PolarHBondContact OG-O 3.29Å; T32-D49 HydrophobicContact CG2-CB 3.8Å
33F93.4Very high87.3Confident0 Ų058.9 Ų58.90%035%0.347CS..EExtended strand (participates in β ladder)trans-102.6129.6-177.1-56.4-80.1000110.1V21 E23 V24 L31 R50 F55 Y111 L115V21-F33 HydrophobicContact CG1-CB 3.93Å; V21-F33 HydrophobicContact CG1-CD1 4.17Å; V21-F33 HydrophobicContact CG1-CG 4.41Å; E23-F33 WeakPolarHBondContact O-CA 3.36Å; V24-F33 HydrophobicContact CB-CD1 4.05Å; V24-F33 HydrophobicContact CB-CE1 4.24Å; V24-F33 HydrophobicContact CG2-CD1 3.79Å; V24-F33 HydrophobicContact CG2-CE1 3.66Å; V24-F33 HydrophobicContact CG2-CZ 4.39Å; L31-F33 HydrophobicContact CB-CE1 4.49Å; L31-F33 HydrophobicContact CB-CE2 3.99Å; L31-F33 HydrophobicContact CB-CZ 3.8Å; L31-F33 HydrophobicContact CD1-CZ 3.99Å; F33-R50 WeakPolarHBondContact CD2-O 3.5Å; F33-R50 PolarHBondContact N-O 2.77Å; F33-R50 PolarHBondContact O-N 3.5Å; F33-F55 HydrophobicContact CB-CE2 4.49Å; F33-F55 AromaticContact CD2-CE2 3.99Å; F33-F55 HydrophobicContact CD2-CE2 3.99Å; F33-F55 HydrophobicContact CG-CE2 4.49Å; F33-Y111 AromaticContact CE1-CD1 3.87Å; F33-Y111 HydrophobicContact CE1-CD1 3.87Å; F33-Y111 HydrophobicContact CE1-CE1 4.13Å; F33-Y111 HydrophobicContact CE2-CE1 4.43Å; F33-Y111 AromaticContact CZ-CD1 3.82Å; F33-Y111 HydrophobicContact CZ-CD1 3.82Å; F33-Y111 AromaticContact CZ-CE1 3.63Å; F33-Y111 HydrophobicContact CZ-CE1 3.63Å; F33-L115 HydrophobicContact CD1-CD1 3.9Å; F33-L115 HydrophobicContact CD2-CD1 3.89Å; F33-L115 HydrophobicContact CE1-CD1 3.82Å; F33-L115 HydrophobicContact CE2-CD1 3.81Å; F33-L115 HydrophobicContact CG-CD1 3.95Å; F33-L115 HydrophobicContact CZ-CD1 3.78Å
34I94.6Very high87.4Confident38 Ų3854.5 Ų54.520%0.19533%0.333CS..EExtended strand (participates in β ladder)trans-90116.1175.7-60.8171.2000108.6T22 E23 V36T22-I34 PolarHBondContact N-O 3.27Å; T22-I34 PolarHBondContact OG1-O 3.18Å; E23-I34 HydrophobicContact CB-CB 4.09Å; E23-I34 HydrophobicContact CB-CD1 3.74Å; E23-I34 HydrophobicContact CB-CG1 4.21Å; E23-I34 PolarHBondContact O-N 2.74Å; E23-I34 WeakPolarHBondContact OE2-CD1 3.46Å; I34-V36 HydrophobicContact CG2-CG2 4.41Å
35I96.3Very high87.7Confident0 Ų058.9 Ų58.90%035%0.353CS..EExtended strand (participates in β ladder)trans-105.9126.4-179.3-49.7177000109V19 K20 V21 H47 V48 R50 F55 L119 F137 L138V19-I35 HydrophobicContact CG1-CG2 3.93Å; K20-I35 CarbonylContact O-C 3.59Å; K20-I35 VanDerWaalsContact O-CA 3.31Å; K20-I35 WeakPolarHBondContact O-CA 3.24Å; V21-I35 HydrophobicContact CG2-CG1 4.36Å; I35-H47 WeakPolarHBondContact O-CA 3.4Å; I35-V48 HydrophobicContact CB-CG2 3.75Å; I35-V48 HydrophobicContact CD1-CG2 4.43Å; I35-V48 HydrophobicContact CG1-CG2 4.46Å; I35-V48 HydrophobicContact CG2-CG2 4.41Å; I35-V48 PolarHBondContact N-O 3.36Å; I35-V48 PolarHBondContact O-N 2.53Å; I35-R50 HydrophobicContact CD1-CB 3.91Å; I35-R50 HydrophobicContact CD1-CG 3.54Å; I35-R50 HydrophobicContact CG1-CG 4.38Å; I35-F55 HydrophobicContact CD1-CE2 4.39Å; I35-F55 HydrophobicContact CD1-CZ 3.84Å; I35-L119 HydrophobicContact CD1-CD1 3.76Å; I35-L119 HydrophobicContact CG1-CD1 4.46Å; I35-L119 HydrophobicContact CG2-CD1 4.14Å; I35-F137 HydrophobicContact CD1-CD1 4.46Å; I35-F137 HydrophobicContact CD1-CE1 3.47Å; I35-F137 VanDerWaalsContact CD1-CE1 3.47Å; I35-F137 HydrophobicContact CD1-CZ 3.87Å; I35-L138 HydrophobicContact CG2-CD2 4.27Å
36V95.9Very high88Confident16 Ų1658.5 Ų58.510%0.09734%0.342CS..EExtended strand (participates in β ladder)trans-112.9131.3177.8-175.60000109.2V19 K20 T22 I34 E45 Y46V19-V36 CarbonylContact C-O 3.57Å; V19-V36 WeakPolarHBondContact CA-O 3.42Å; K20-V36 PolarHBondContact N-O 2.9Å; K20-V36 PolarHBondContact O-N 3.41Å; T22-V36 HydrophobicContact CG2-CB 4.1Å; T22-V36 HydrophobicContact CG2-CG2 3.7Å; I34-V36 HydrophobicContact CG2-CG2 4.41Å; V36-E45 HydrophobicContact CG1-CB 4.13Å; V36-E45 HydrophobicContact CG1-CG 4.22Å; V36-E45 WeakPolarHBondContact CG1-OE2 3.23Å; V36-Y46 WeakPolarHBondContact CA-O 3.38Å
37S94.5Very high88.6Confident0 Ų059.9 Ų59.90%035%0.348CS..EExtended strand (participates in β ladder)trans-140.2137.6176.461.30000111.6E45 Y46 L138S37-E45 CarbonylContact O-C 3.56Å; S37-E45 VanDerWaalsContact O-CA 3.29Å; S37-E45 WeakPolarHBondContact O-CA 3.38Å; S37-Y46 PolarHBondContact N-O 3.2Å; S37-Y46 PolarHBondContact O-N 2.97Å; S37-L138 PolarHBondContact OG-O 3.32Å
38Q93.3Very high89.3Confident79 Ų7953.7 Ų53.737%0.36932%0.316SS..EExtended strand (participates in β ladder)trans-79.3133-178.6-170.8178.9-300110.7V14 Y15 T18V14-Q38 CarbonylContact C-O 3.52Å; V14-Q38 WeakPolarHBondContact CA-O 3.38Å; V14-Q38 WeakPolarHBondContact CB-O 3.49Å; Y15-Q38 HydrophobicContact CD2-CB 4.15Å; Y15-Q38 HydrophobicContact CD2-CG 3.99Å; Y15-Q38 HydrophobicContact CE2-CG 4.48Å; Y15-Q38 PolarHBondContact N-O 3.07Å; T18-Q38 HydrophobicContact CG2-CB 3.99Å; T18-Q38 VanDerWaalsContact OG1-CB 3.3Å; T18-Q38 WeakPolarHBondContact OG1-CB 3.3Å; T18-Q38 PolarHBondContact OG1-N 3.34Å
39K93.1Very high89.9Confident65 Ų6555.8 Ų55.828%0.28332%0.315SS..BIsolated β-bridgetrans-66.2138.9176.3-64.7-176.2-178.7-178.60110.8Y15 S41 G44 E45 Y46Y15-K39 WeakPolarHBondContact CE2-O 3.21Å; K39-S41 VanDerWaalsContact C-N 3.33Å; K39-G44 WeakPolarHBondContact CB-O 3.12Å; K39-G44 WeakPolarHBondContact CG-O 3.15Å; K39-G44 PolarHBondContact N-O 3.09Å; K39-E45 WeakPolarHBondContact CE-O 3.48Å; K39-Y46 HydrophobicContact CB-CE2 4.39Å; K39-Y46 HydrophobicContact CD-CE1 4.44Å; K39-Y46 HydrophobicContact CD-CE2 4.22Å; K39-Y46 HydrophobicContact CG-CD2 3.75Å; K39-Y46 HydrophobicContact CG-CE2 3.5Å; K39-Y46 VanDerWaalsContact CG-CE2 3.5Å; K39-Y46 HydrophobicContact CG-CG 4.42Å
40L88.3Confident90.6Very high64 Ų6450.4 Ų50.434%0.33529%0.286SS..THydrogen-bonded Turntrans-72.7-28.1172.7-167.573.7000111.8S13 Y15 G42S13-L40 WeakPolarHBondContact O-CB 3.42Å; S13-L40 PolarHBondContact O-N 3.09Å; Y15-L40 HydrophobicContact CD1-CD1 3.82Å; Y15-L40 HydrophobicContact CD2-CD1 4.42Å; Y15-L40 HydrophobicContact CE1-CD1 3.45Å; Y15-L40 VanDerWaalsContact CE1-CD1 3.45Å; Y15-L40 HydrophobicContact CE2-CD1 4.1Å; Y15-L40 HydrophobicContact CG-CD1 4.3Å; L40-G42 VanDerWaalsContact C-N 3.34Å; L40-G42 PolarHBondContact O-N 3.46Å
41S83.3Confident91.1Very high108 Ų10848.1 Ų48.176%0.75527%0.272SS*.THydrogen-bonded Turntrans-82.62.6-174.257.30000115.4K39K39-S41 VanDerWaalsContact C-N 3.33Å
42G75.6Confident91.2Very high39 Ų3948.7 Ų48.740%0.40227%0.274SS..SBendtrans157.7-157.817900000115L40 G44L40-G42 VanDerWaalsContact C-N 3.34Å; L40-G42 PolarHBondContact O-N 3.46Å; G42-G44 VanDerWaalsContact C-N 3.31Å; G42-G44 PolarHBondContact O-N 3.45Å; G42-G44 VanDerWaalsContact O-N 3.12Å
43T73.6Confident91.3Very high156 Ų15650 Ų5096%0.95728%0.28SS*.SBendtrans-87.452.4-174.459.50000113.4
44G89Confident91.3Very high24 Ų2450.3 Ų50.325%0.24728%0.282CS..  trans-133.6166.4179.800000113.1K39 G42K39-G44 WeakPolarHBondContact CB-O 3.12Å; K39-G44 WeakPolarHBondContact CG-O 3.15Å; K39-G44 PolarHBondContact N-O 3.09Å; G42-G44 VanDerWaalsContact C-N 3.31Å; G42-G44 PolarHBondContact O-N 3.45Å; G42-G44 VanDerWaalsContact O-N 3.12Å
45E94.3Very high91.3Very high108 Ų10848.5 Ų48.551%0.50527%0.272SS..EExtended strand (participates in β ladder)trans-123.8150178.5-64.4178.9161.800110.5V36 S37 K39 H47V36-E45 HydrophobicContact CG1-CB 4.13Å; V36-E45 HydrophobicContact CG1-CG 4.22Å; V36-E45 WeakPolarHBondContact CG1-OE2 3.23Å; S37-E45 CarbonylContact O-C 3.56Å; S37-E45 VanDerWaalsContact O-CA 3.29Å; S37-E45 WeakPolarHBondContact O-CA 3.38Å; K39-E45 WeakPolarHBondContact CE-O 3.48Å; E45-H47 IonicContact OE2-CE1 2.65Å; E45-H47 IonicContact OE2-NE2 3.05Å; E45-H47 PolarHBondContact OE2-NE2 3.48Å
46Y94.1Very high91.2Very high53 Ų5351.5 Ų51.521%0.20829%0.286CS..EExtended strand (participates in β ladder)trans-93.4139.5159.1-62.2-77.5000108.9S13 V14 V36 S37 K39 T139S13-Y46 PolarHBondContact OG-OH 2.93Å; V14-Y46 HydrophobicContact CG1-CD2 3.41Å; V14-Y46 VanDerWaalsContact CG1-CD2 3.41Å; V14-Y46 HydrophobicContact CG1-CE2 3.5Å; V36-Y46 WeakPolarHBondContact CA-O 3.38Å; S37-Y46 PolarHBondContact N-O 3.2Å; S37-Y46 PolarHBondContact O-N 2.97Å; K39-Y46 HydrophobicContact CB-CE2 4.39Å; K39-Y46 HydrophobicContact CD-CE1 4.44Å; K39-Y46 HydrophobicContact CD-CE2 4.22Å; K39-Y46 HydrophobicContact CG-CD2 3.75Å; K39-Y46 HydrophobicContact CG-CE2 3.5Å; K39-Y46 VanDerWaalsContact CG-CE2 3.5Å; K39-Y46 HydrophobicContact CG-CG 4.42Å; Y46-T139 HydrophobicContact CD1-CG2 4.41Å; Y46-T139 HydrophobicContact CD2-CG2 3.73Å; Y46-T139 HydrophobicContact CE1-CG2 4.28Å; Y46-T139 HydrophobicContact CE2-CG2 3.51Å; Y46-T139 HydrophobicContact CG-CG2 4.15Å
47H95.4Very high91.1Very high103 Ų10352.3 Ų52.348%0.47729%0.288SS..EExtended strand (participates in β ladder)trans-123.7116.9174.7-72.5-111000106.2I35 E45I35-H47 WeakPolarHBondContact O-CA 3.4Å; E45-H47 IonicContact OE2-CE1 2.65Å; E45-H47 IonicContact OE2-NE2 3.05Å; E45-H47 PolarHBondContact OE2-NE2 3.48Å
48V95.5Very high91.1Very high2 Ų252.3 Ų52.31%0.01229%0.288CS..EExtended strand (participates in β ladder)trans-134137.5-176-58.20000111.3I35 R50 S140I35-V48 HydrophobicContact CB-CG2 3.75Å; I35-V48 HydrophobicContact CD1-CG2 4.43Å; I35-V48 HydrophobicContact CG1-CG2 4.46Å; I35-V48 HydrophobicContact CG2-CG2 4.41Å; I35-V48 PolarHBondContact N-O 3.36Å; I35-V48 PolarHBondContact O-N 2.53Å; V48-R50 HydrophobicContact CG2-CG 4.4Å; V48-S140 WeakPolarHBondContact CG1-O 3.38Å
49D94.3Very high91.1Very high92 Ų9250.6 Ų50.649%0.49228%0.28SS..EExtended strand (participates in β ladder)trans-95.2126.8178.9-63.3-24.7000109.6T32T32-D49 HydrophobicContact CG2-CB 3.8Å
50R95Very high90.9Very high0 Ų049.4 Ų49.40%028%0.275CS..EExtended strand (participates in β ladder)trans-133.3132.6-178.5-62.9-64.3177.7-105.13.3111.7F33 I35 V48 D54 F55 V136 F137 S140F33-R50 WeakPolarHBondContact CD2-O 3.5Å; F33-R50 PolarHBondContact N-O 2.77Å; F33-R50 PolarHBondContact O-N 3.5Å; I35-R50 HydrophobicContact CD1-CB 3.91Å; I35-R50 HydrophobicContact CD1-CG 3.54Å; I35-R50 HydrophobicContact CG1-CG 4.38Å; V48-R50 HydrophobicContact CG2-CG 4.4Å; R50-D54 HydrophobicContact CB-CB 4.29Å; R50-F55 HydrophobicContact CB-CD2 4.41Å; R50-F55 HydrophobicContact CB-CE2 3.89Å; R50-V136 PolarHBondContact NH2-O 3.3Å; R50-F137 HydrophobicContact CB-CE2 4.29Å; R50-F137 HydrophobicContact CB-CZ 3.98Å; R50-F137 HydrophobicContact CG-CE1 4.07Å; R50-F137 HydrophobicContact CG-CE2 3.82Å; R50-F137 HydrophobicContact CG-CZ 3.59Å; R50-F137 VanDerWaalsContact CZ-O 3.26Å; R50-F137 PolarHBondContact NE-O 2.87Å; R50-F137 PolarHBondContact NH2-O 2.7Å; R50-S140 PolarHBondContact NH1-O 3.35Å; R50-S140 PolarHBondContact NH2-O 3.12Å
51T93.4Very high91.1Very high23 Ų2348.1 Ų48.114%0.14127%0.267CS..EExtended strand (participates in β ladder)trans-85.9164.2167.465.50000110.2T30 L31 D53 D54 F55T30-T51 HydrophobicContact CG2-CG2 4Å; L31-T51 WeakPolarHBondContact O-CA 3.47Å; T51-D53 PolarHBondContact O-N 3.39Å; T51-D54 PolarHBondContact N-OD2 3.11Å; T51-D54 WeakPolarHBondContact O-CB 3.04Å; T51-D54 PolarHBondContact O-N 3.45Å; T51-D54 PolarHBondContact OG1-OD2 2.87Å; T51-F55 WeakPolarHBondContact O-CD2 3.2Å; T51-F55 PolarHBondContact O-N 3.42Å
52Y91.4Very high91.6Very high20 Ų2043.1 Ų43.18%0.07823%0.232CC..Hα-helixtrans-58.5-31.1174.1-174.1-84.5000112.7D54 F55 E56 L79 P80 R82 Y111Y52-D54 PolarHBondContact O-N 2.98Å; Y52-F55 WeakPolarHBondContact O-CB 3.2Å; Y52-F55 PolarHBondContact O-N 2.91Å; Y52-F55 VanDerWaalsContact O-N 3.14Å; Y52-E56 HydrophobicContact CD1-CG 4.04Å; Y52-E56 HydrophobicContact CE1-CG 3.6Å; Y52-E56 WeakPolarHBondContact CE1-OE1 3.49Å; Y52-E56 PolarHBondContact O-N 3.47Å; Y52-L79 HydrophobicContact CE1-CD2 4.4Å; Y52-L79 HydrophobicContact CE2-CD2 4.24Å; Y52-L79 HydrophobicContact CE2-CG 4.37Å; Y52-P80 WeakPolarHBondContact CE2-O 3.14Å; Y52-P80 PolarHBondContact OH-O 2.99Å; Y52-R82 HydrophobicContact CD1-CB 4.11Å; Y52-R82 HydrophobicContact CD1-CG 3.81Å; Y52-R82 HydrophobicContact CE1-CB 3.58Å; Y52-R82 HydrophobicContact CE1-CG 3.83Å; Y52-R82 HydrophobicContact CE2-CB 4.24Å; Y52-R82 HydrophobicContact CG-CG 4.2Å; Y52-R82 VanDerWaalsContact CZ-CA 3.41Å; Y52-R82 PolarHBondContact OH-N 2.65Å; Y52-R82 VanDerWaalsContact OH-N 3.17Å; Y52-Y111 WeakPolarHBondContact CD2-OH 3.23Å; Y52-Y111 WeakPolarHBondContact CE2-OH 3.48Å
53D92.2Very high92.3Very high60 Ų6042.8 Ų42.832%0.32122%0.219SC..Hα-helixtrans-63.6-31.9175.6-67.1-7.6000112T51 F55 E56 W57 R82T51-D53 PolarHBondContact O-N 3.39Å; D53-F55 VanDerWaalsContact C-N 3.33Å; D53-E56 PolarHBondContact O-N 3.27Å; D53-W57 WeakPolarHBondContact O-CB 3.38Å; D53-W57 PolarHBondContact O-N 3.35Å; D53-R82 IonicContact OD1-CZ 3.31Å; D53-R82 IonicContact OD1-NH1 3.76Å; D53-R82 PolarHBondContact OD1-NH1 3.41Å; D53-R82 IonicContact OD1-NH2 3.42Å; D53-R82 PolarHBondContact OD1-NH2 3.32Å
54D94.6Very high93Very high7 Ų736.7 Ų36.74%0.03719%0.185CC..Hα-helixtrans-70.4-32.8175.9-56-51.5000111.3R50 T51 Y52 W57 L58 F137 P144R50-D54 HydrophobicContact CB-CB 4.29Å; T51-D54 PolarHBondContact N-OD2 3.11Å; T51-D54 WeakPolarHBondContact O-CB 3.04Å; T51-D54 PolarHBondContact O-N 3.45Å; T51-D54 PolarHBondContact OG1-OD2 2.87Å; Y52-D54 PolarHBondContact O-N 2.98Å; D54-W57 WeakPolarHBondContact O-CB 3.39Å; D54-W57 PolarHBondContact O-N 3.36Å; D54-L58 PolarHBondContact O-N 3.4Å; D54-F137 HydrophobicContact CB-CE2 3.9Å; D54-F137 WeakPolarHBondContact O-CE2 3.32Å; D54-P144 HydrophobicContact CB-CG 4.04Å
55F95.1Very high92.9Very high0 Ų036.9 Ų36.90%018%0.179CC..Hα-helixtrans-67.4-41.2171.8-76-94.2000111.7F33 I35 R50 T51 Y52 D53 W57 L58 Q59 L79 L115 F118 L119 F137F33-F55 HydrophobicContact CB-CE2 4.49Å; F33-F55 AromaticContact CD2-CE2 3.99Å; F33-F55 HydrophobicContact CD2-CE2 3.99Å; F33-F55 HydrophobicContact CG-CE2 4.49Å; I35-F55 HydrophobicContact CD1-CE2 4.39Å; I35-F55 HydrophobicContact CD1-CZ 3.84Å; R50-F55 HydrophobicContact CB-CD2 4.41Å; R50-F55 HydrophobicContact CB-CE2 3.89Å; T51-F55 WeakPolarHBondContact O-CD2 3.2Å; T51-F55 PolarHBondContact O-N 3.42Å; Y52-F55 WeakPolarHBondContact O-CB 3.2Å; Y52-F55 PolarHBondContact O-N 2.91Å; Y52-F55 VanDerWaalsContact O-N 3.14Å; D53-F55 VanDerWaalsContact C-N 3.33Å; F55-W57 VanDerWaalsContact C-N 3.3Å; F55-W57 PolarHBondContact O-N 2.99Å; F55-L58 PolarHBondContact O-N 2.79Å; F55-Q59 WeakPolarHBondContact O-CB 3.48Å; F55-Q59 PolarHBondContact O-N 2.99Å; F55-L79 HydrophobicContact CB-CD1 3.71Å; F55-L79 HydrophobicContact CB-CD2 4.05Å; F55-L79 HydrophobicContact CD1-CD1 3.97Å; F55-L79 HydrophobicContact CG-CD1 4.22Å; F55-L115 HydrophobicContact CD1-CD2 3.85Å; F55-L115 HydrophobicContact CD2-CD2 4.49Å; F55-L115 HydrophobicContact CE1-CB 3.95Å; F55-L115 HydrophobicContact CE1-CD1 4.37Å; F55-L115 HydrophobicContact CE1-CD2 3.83Å; F55-L115 HydrophobicContact CE1-CG 4.27Å; F55-L115 HydrophobicContact CE2-CD1 4.01Å; F55-L115 HydrophobicContact CE2-CD2 4.5Å; F55-L115 HydrophobicContact CG-CD2 4.19Å; F55-L115 HydrophobicContact CZ-CB 4.04Å; F55-L115 HydrophobicContact CZ-CD1 3.89Å; F55-L115 HydrophobicContact CZ-CD2 4.17Å; F55-L115 HydrophobicContact CZ-CG 4.27Å; F55-F118 HydrophobicContact CD1-CD1 4.13Å; F55-F118 HydrophobicContact CD1-CE1 4.11Å; F55-F118 HydrophobicContact CE1-CD1 4.46Å; F55-L119 HydrophobicContact CD1-CD2 4.37Å; F55-L119 HydrophobicContact CE1-CD1 3.77Å; F55-L119 HydrophobicContact CE1-CD2 3.91Å; F55-L119 HydrophobicContact CE1-CG 3.85Å; F55-L119 HydrophobicContact CZ-CD1 4.11Å; F55-F137 AromaticContact CD1-CZ 3.87Å; F55-F137 HydrophobicContact CD1-CZ 3.87Å; F55-F137 HydrophobicContact CD2-CZ 4.02Å; F55-F137 HydrophobicContact CE1-CE1 4.21Å; F55-F137 AromaticContact CE1-CZ 3.84Å; F55-F137 HydrophobicContact CE1-CZ 3.84Å; F55-F137 AromaticContact CE2-CZ 3.97Å; F55-F137 HydrophobicContact CE2-CZ 3.97Å; F55-F137 HydrophobicContact CG-CE2 4.46Å; F55-F137 AromaticContact CG-CZ 3.97Å; F55-F137 HydrophobicContact CG-CZ 3.97Å; F55-F137 HydrophobicContact CZ-CE1 4.37Å; F55-F137 AromaticContact CZ-CZ 3.89Å; F55-F137 HydrophobicContact CZ-CZ 3.89Å
56E92.8Very high92Very high62 Ų6233.9 Ų33.929%0.2917%0.165SC..Hα-helixtrans-62.3-39.2172.3-72.9-174.1161.700111.5Y52 D53 Q59 Q60 L79 R82Y52-E56 HydrophobicContact CD1-CG 4.04Å; Y52-E56 HydrophobicContact CE1-CG 3.6Å; Y52-E56 WeakPolarHBondContact CE1-OE1 3.49Å; Y52-E56 PolarHBondContact O-N 3.47Å; D53-E56 PolarHBondContact O-N 3.27Å; E56-Q59 PolarHBondContact O-N 2.77Å; E56-Q60 WeakPolarHBondContact O-CB 3.32Å; E56-Q60 WeakPolarHBondContact O-CG 3.39Å; E56-Q60 PolarHBondContact O-N 2.93Å; E56-L79 HydrophobicContact CG-CD2 4.05Å; E56-R82 IonicContact OE1-CZ 2.77Å; E56-R82 IonicContact OE1-NE 2.95Å; E56-R82 IonicContact OE1-NH2 2.75Å; E56-R82 PolarHBondContact OE1-NH2 3.38Å; E56-R82 IonicContact OE2-NH2 3.51Å; E56-R82 PolarHBondContact OE2-NH2 2.98Å
57W93.5Very high91.5Very high34 Ų3439 Ų3913%0.12920%0.196CC..Hα-helixtrans-58.8-47.8173.3171.898000111.1D53 D54 F55 Q59 Q60 H61 A133 V136 F137 P144 G145D53-W57 WeakPolarHBondContact O-CB 3.38Å; D53-W57 PolarHBondContact O-N 3.35Å; D54-W57 WeakPolarHBondContact O-CB 3.39Å; D54-W57 PolarHBondContact O-N 3.36Å; F55-W57 VanDerWaalsContact C-N 3.3Å; F55-W57 PolarHBondContact O-N 2.99Å; W57-Q59 PolarHBondContact O-N 3.2Å; W57-Q60 PolarHBondContact O-N 3.16Å; W57-H61 AromaticContact CD1-CE1 3.48Å; W57-H61 VanDerWaalsContact CD1-CE1 3.48Å; W57-H61 AromaticContact CD1-ND1 3.95Å; W57-H61 AromaticContact CD2-CE1 3.74Å; W57-H61 AromaticContact CD2-ND1 3.71Å; W57-H61 AromaticContact CE2-CE1 3.09Å; W57-H61 AromaticContact CE2-ND1 3.5Å; W57-H61 AromaticContact CE2-NE2 3.55Å; W57-H61 AromaticContact CG-CE1 3.93Å; W57-H61 AromaticContact CG-ND1 3.97Å; W57-H61 AromaticContact CZ2-CD2 3.89Å; W57-H61 AromaticContact CZ2-CE1 3.52Å; W57-H61 AromaticContact CZ2-ND1 3.92Å; W57-H61 AromaticContact CZ2-NE2 3.47Å; W57-H61 WeakPolarHBondContact CZ2-NE2 3.15Å; W57-H61 AromaticContact NE1-CE1 2.99Å; W57-H61 PolarHBondContact NE1-CE1 3.37Å; W57-H61 AromaticContact NE1-ND1 3.73Å; W57-H61 AromaticContact NE1-NE2 3.64Å; W57-H61 PolarHBondContact O-N 3.44Å; W57-H61 VanDerWaalsContact O-N 3.09Å; W57-H61 PolarHBondContact O-ND1 2.79Å; W57-A133 HydrophobicContact CH2-CB 3.66Å; W57-A133 HydrophobicContact CZ2-CB 4.48Å; W57-A133 HydrophobicContact CZ3-CB 3.94Å; W57-V136 HydrophobicContact CH2-CG1 4.45Å; W57-F137 HydrophobicContact CE3-CD2 4.41Å; W57-F137 HydrophobicContact CZ3-CB 4.33Å; W57-F137 HydrophobicContact CZ3-CD2 4.46Å; W57-P144 HydrophobicContact CD2-CB 3.48Å; W57-P144 VanDerWaalsContact CD2-CB 3.48Å; W57-P144 HydrophobicContact CD2-CG 3.69Å; W57-P144 VanDerWaalsContact CE2-CB 3.41Å; W57-P144 HydrophobicContact CE3-CB 3.55Å; W57-P144 HydrophobicContact CE3-CG 3.5Å; W57-P144 HydrophobicContact CG-CB 4.21Å; W57-P144 HydrophobicContact CG-CG 4.21Å; W57-P144 HydrophobicContact CH2-CB 3.62Å; W57-P144 HydrophobicContact CH2-CG 4.4Å; W57-P144 HydrophobicContact CZ2-CB 3.51Å; W57-P144 HydrophobicContact CZ3-CB 3.62Å; W57-P144 HydrophobicContact CZ3-CG 3.9Å; W57-G145 PolarHBondContact NE1-O 3.03Å; W57-G145 VanDerWaalsContact NE1-O 3.14Å
58L95.1Very high91.3Very high0 Ų036.4 Ų36.40%019%0.188CC..Hα-helixtrans-59.9-48.7178174.960.6000110.5D54 F55 Q60 H61 L62 F118 L119 A133 V134 F137D54-L58 PolarHBondContact O-N 3.4Å; F55-L58 PolarHBondContact O-N 2.79Å; L58-Q60 VanDerWaalsContact C-N 3.29Å; L58-Q60 PolarHBondContact O-N 3.04Å; L58-H61 WeakPolarHBondContact O-CB 3.41Å; L58-H61 PolarHBondContact O-N 3.44Å; L58-L62 HydrophobicContact CD1-CG 4.44Å; L58-L62 HydrophobicContact CG-CD1 4.47Å; L58-L62 WeakPolarHBondContact O-CG 3.12Å; L58-L62 PolarHBondContact O-N 3.37Å; L58-F118 HydrophobicContact CD2-CE1 4.09Å; L58-L119 HydrophobicContact CD2-CD2 3.86Å; L58-A133 HydrophobicContact CD1-CB 4.2Å; L58-V134 HydrophobicContact CD1-CG2 3.92Å; L58-F137 HydrophobicContact CB-CD2 3.93Å; L58-F137 HydrophobicContact CB-CE2 4.26Å; L58-F137 HydrophobicContact CB-CG 4.39Å; L58-F137 HydrophobicContact CD1-CB 4.24Å; L58-F137 HydrophobicContact CD2-CB 4.28Å; L58-F137 HydrophobicContact CD2-CD1 3.87Å; L58-F137 HydrophobicContact CD2-CD2 4.11Å; L58-F137 HydrophobicContact CD2-CE1 4.2Å; L58-F137 HydrophobicContact CD2-CE2 4.42Å; L58-F137 HydrophobicContact CD2-CG 3.81Å; L58-F137 HydrophobicContact CD2-CZ 4.45Å; L58-F137 HydrophobicContact CG-CG 4.48Å
59Q92.9Very high91.1Very high43 Ų4341 Ų4120%0.20122%0.217CC..Hα-helixtrans-57.9-43179.5-160.2-170.530.300111.7F55 E56 W57 H61 L62 F63F55-Q59 WeakPolarHBondContact O-CB 3.48Å; F55-Q59 PolarHBondContact O-N 2.99Å; E56-Q59 PolarHBondContact O-N 2.77Å; W57-Q59 PolarHBondContact O-N 3.2Å; Q59-H61 VanDerWaalsContact C-N 3.3Å; Q59-H61 PolarHBondContact O-N 2.88Å; Q59-L62 WeakPolarHBondContact O-CB 3.49Å; Q59-L62 PolarHBondContact O-N 3.1Å; Q59-F63 HydrophobicContact CG-CD2 4.11Å; Q59-F63 HydrophobicContact CG-CE1 4.46Å; Q59-F63 HydrophobicContact CG-CE2 3.49Å; Q59-F63 VanDerWaalsContact CG-CE2 3.49Å; Q59-F63 HydrophobicContact CG-CZ 3.7Å; Q59-F63 WeakPolarHBondContact O-CD2 3.39Å; Q59-F63 WeakPolarHBondContact O-CG 3.36Å; Q59-F63 PolarHBondContact O-N 3.39Å; Q59-F63 VanDerWaalsContact O-N 3.08Å
60Q90.8Very high91.1Very high39 Ų3936.8 Ų36.818%0.18220%0.195CC..Hα-helixtrans-61.3-36.7175.7-72.3170.324.500112.7E56 W57 L58 F63 A64E56-Q60 WeakPolarHBondContact O-CB 3.32Å; E56-Q60 WeakPolarHBondContact O-CG 3.39Å; E56-Q60 PolarHBondContact O-N 2.93Å; W57-Q60 PolarHBondContact O-N 3.16Å; L58-Q60 VanDerWaalsContact C-N 3.29Å; L58-Q60 PolarHBondContact O-N 3.04Å; Q60-F63 PolarHBondContact O-N 3.33Å; Q60-A64 WeakPolarHBondContact O-CB 3.37Å; Q60-A64 PolarHBondContact O-N 3.16Å; Q60-A64 VanDerWaalsContact O-N 3.16Å
61H92.2Very high91.1Very high38 Ų3836.9 Ų36.918%0.17620%0.196CC..Hα-helixtrans-72.3-35177.2-75.766.2000112.6W57 L58 Q59 F63 A64 N131 A133 V149W57-H61 AromaticContact CD1-CE1 3.48Å; W57-H61 VanDerWaalsContact CD1-CE1 3.48Å; W57-H61 AromaticContact CD1-ND1 3.95Å; W57-H61 AromaticContact CD2-CE1 3.74Å; W57-H61 AromaticContact CD2-ND1 3.71Å; W57-H61 AromaticContact CE2-CE1 3.09Å; W57-H61 AromaticContact CE2-ND1 3.5Å; W57-H61 AromaticContact CE2-NE2 3.55Å; W57-H61 AromaticContact CG-CE1 3.93Å; W57-H61 AromaticContact CG-ND1 3.97Å; W57-H61 AromaticContact CZ2-CD2 3.89Å; W57-H61 AromaticContact CZ2-CE1 3.52Å; W57-H61 AromaticContact CZ2-ND1 3.92Å; W57-H61 AromaticContact CZ2-NE2 3.47Å; W57-H61 WeakPolarHBondContact CZ2-NE2 3.15Å; W57-H61 AromaticContact NE1-CE1 2.99Å; W57-H61 PolarHBondContact NE1-CE1 3.37Å; W57-H61 AromaticContact NE1-ND1 3.73Å; W57-H61 AromaticContact NE1-NE2 3.64Å; W57-H61 PolarHBondContact O-N 3.44Å; W57-H61 VanDerWaalsContact O-N 3.09Å; W57-H61 PolarHBondContact O-ND1 2.79Å; L58-H61 WeakPolarHBondContact O-CB 3.41Å; L58-H61 PolarHBondContact O-N 3.44Å; Q59-H61 VanDerWaalsContact C-N 3.3Å; Q59-H61 PolarHBondContact O-N 2.88Å; H61-F63 VanDerWaalsContact C-N 3.25Å; H61-F63 PolarHBondContact O-N 3.4Å; H61-A64 PolarHBondContact O-N 3.06Å; H61-N131 PolarHBondContact O-ND2 3.19Å; H61-A133 HydrophobicContact CB-CB 3.5Å; H61-A133 VanDerWaalsContact CB-CB 3.5Å; H61-V149 WeakPolarHBondContact CE1-CG2 3.47Å; H61-V149 WeakPolarHBondContact NE2-CG2 3.34Å
62L93.2Very high91.1Very high3 Ų336.6 Ų36.62%0.01619%0.193CC..Hα-helixtrans-60.5-41171.5-63.6177.1000110.5L58 Q59 A64 F76 F118 V122 L128 N131 V134L58-L62 HydrophobicContact CD1-CG 4.44Å; L58-L62 HydrophobicContact CG-CD1 4.47Å; L58-L62 WeakPolarHBondContact O-CG 3.12Å; L58-L62 PolarHBondContact O-N 3.37Å; Q59-L62 WeakPolarHBondContact O-CB 3.49Å; Q59-L62 PolarHBondContact O-N 3.1Å; L62-A64 VanDerWaalsContact C-N 3.31Å; L62-A64 PolarHBondContact O-N 3.05Å; L62-F76 HydrophobicContact CB-CD1 4.23Å; L62-F76 HydrophobicContact CB-CE1 4.07Å; L62-F76 WeakPolarHBondContact O-CE1 3.42Å; L62-F118 HydrophobicContact CD1-CZ 4.41Å; L62-V122 HydrophobicContact CD1-CG1 3.88Å; L62-V122 HydrophobicContact CD1-CG2 3.75Å; L62-V122 HydrophobicContact CD2-CG1 4.02Å; L62-L128 HydrophobicContact CD2-CB 4.17Å; L62-L128 HydrophobicContact CD2-CD2 4.32Å; L62-N131 HydrophobicContact CD2-CB 4.14Å; L62-V134 HydrophobicContact CD2-CG2 3.77Å
63F90.1Very high91.4Very high32 Ų3235.6 Ų35.614%0.1419%0.189CC..THydrogen-bonded Turntrans-77.1-5.9178-60.5-33.8000115.6Q59 Q60 H61 F76 I153 F154Q59-F63 HydrophobicContact CG-CD2 4.11Å; Q59-F63 HydrophobicContact CG-CE1 4.46Å; Q59-F63 HydrophobicContact CG-CE2 3.49Å; Q59-F63 VanDerWaalsContact CG-CE2 3.49Å; Q59-F63 HydrophobicContact CG-CZ 3.7Å; Q59-F63 WeakPolarHBondContact O-CD2 3.39Å; Q59-F63 WeakPolarHBondContact O-CG 3.36Å; Q59-F63 PolarHBondContact O-N 3.39Å; Q59-F63 VanDerWaalsContact O-N 3.08Å; Q60-F63 PolarHBondContact O-N 3.33Å; H61-F63 VanDerWaalsContact C-N 3.25Å; H61-F63 PolarHBondContact O-N 3.4Å; F63-F76 HydrophobicContact CD1-CB 4.4Å; F63-F76 AromaticContact CD1-CD1 3.87Å; F63-F76 HydrophobicContact CD1-CD1 3.87Å; F63-F76 AromaticContact CD1-CD2 3.68Å; F63-F76 HydrophobicContact CD1-CD2 3.68Å; F63-F76 AromaticContact CD1-CE1 3.92Å; F63-F76 HydrophobicContact CD1-CE1 3.92Å; F63-F76 AromaticContact CD1-CE2 3.69Å; F63-F76 HydrophobicContact CD1-CE2 3.69Å; F63-F76 AromaticContact CD1-CG 3.75Å; F63-F76 HydrophobicContact CD1-CG 3.75Å; F63-F76 AromaticContact CD1-CZ 3.84Å; F63-F76 HydrophobicContact CD1-CZ 3.84Å; F63-F76 HydrophobicContact CE1-CB 3.57Å; F63-F76 AromaticContact CE1-CD1 3.87Å; F63-F76 HydrophobicContact CE1-CD1 3.87Å; F63-F76 AromaticContact CE1-CD2 3.49Å; F63-F76 HydrophobicContact CE1-CD2 3.49Å; F63-F76 VanDerWaalsContact CE1-CD2 3.49Å; F63-F76 HydrophobicContact CE1-CE1 4.38Å; F63-F76 HydrophobicContact CE1-CE2 4.02Å; F63-F76 AromaticContact CE1-CG 3.39Å; F63-F76 HydrophobicContact CE1-CG 3.39Å; F63-F76 HydrophobicContact CE1-CZ 4.46Å; F63-F76 HydrophobicContact CZ-CB 4.42Å; F63-I153 WeakPolarHBondContact O-CB 3.34Å; F63-I153 WeakPolarHBondContact O-CD1 3.4Å; F63-I153 WeakPolarHBondContact O-CG1 3.38Å; F63-F154 HydrophobicContact CB-CD2 4.36Å; F63-F154 HydrophobicContact CB-CE2 3.77Å; F63-F154 HydrophobicContact CD1-CE2 4.05Å; F63-F154 HydrophobicContact CD1-CZ 4.38Å; F63-F154 HydrophobicContact CD2-CD2 4.31Å; F63-F154 AromaticContact CD2-CE2 3.32Å; F63-F154 HydrophobicContact CD2-CE2 3.32Å; F63-F154 AromaticContact CD2-CZ 3.94Å; F63-F154 HydrophobicContact CD2-CZ 3.94Å; F63-F154 HydrophobicContact CE1-CE2 4.37Å; F63-F154 HydrophobicContact CE1-CZ 4.29Å; F63-F154 AromaticContact CE2-CE2 3.69Å; F63-F154 HydrophobicContact CE2-CE2 3.69Å; F63-F154 AromaticContact CE2-CZ 3.82Å; F63-F154 HydrophobicContact CE2-CZ 3.82Å; F63-F154 HydrophobicContact CG-CD2 4.49Å; F63-F154 AromaticContact CG-CE2 3.5Å; F63-F154 HydrophobicContact CG-CE2 3.5Å; F63-F154 VanDerWaalsContact CG-CE2 3.5Å; F63-F154 HydrophobicContact CG-CZ 4.2Å; F63-F154 HydrophobicContact CZ-CE2 4.22Å; F63-F154 HydrophobicContact CZ-CZ 4.01Å
64A87.9Confident91.6Very high28 Ų2832.8 Ų32.823%0.23117%0.174CC..THydrogen-bonded Turntrans-95.1-1-176.800000113.5Q60 H61 L62 E66 V149Q60-A64 WeakPolarHBondContact O-CB 3.37Å; Q60-A64 PolarHBondContact O-N 3.16Å; Q60-A64 VanDerWaalsContact O-N 3.16Å; H61-A64 PolarHBondContact O-N 3.06Å; L62-A64 VanDerWaalsContact C-N 3.31Å; L62-A64 PolarHBondContact O-N 3.05Å; A64-E66 PolarHBondContact O-N 2.95Å; A64-V149 HydrophobicContact CB-CG1 3.46Å; A64-V149 VanDerWaalsContact CB-CG1 3.46Å
65Q86.3Confident91.7Very high28 Ų2832.8 Ų32.813%0.13117%0.174CC..  trans-81.473.7-171.9-63.5-168.2-35.300112.9V68 I71 N131Q65-V68 HydrophobicContact CB-CB 4.23Å; Q65-V68 HydrophobicContact CB-CG2 3.82Å; Q65-V68 HydrophobicContact CG-CG2 4.36Å; Q65-I71 HydrophobicContact CB-CD1 4.39Å; Q65-I71 HydrophobicContact CB-CG1 4.06Å; Q65-I71 WeakPolarHBondContact O-CG2 3.39Å; Q65-N131 PolarHBondContact NE2-ND2 3.27Å
66E75.6Confident91.8Very high45 Ų4533.3 Ų33.321%0.2118%0.176CC..THydrogen-bonded Turntrans-71.4-37-177.8-66.8-165.3149.700113.9A64 V68 N152 I153 R156A64-E66 PolarHBondContact O-N 2.95Å; E66-V68 VanDerWaalsContact C-N 3.27Å; E66-V68 PolarHBondContact O-N 3.21Å; E66-N152 HydrophobicContact CG-CB 4.31Å; E66-N152 WeakPolarHBondContact OE1-CB 3.46Å; E66-I153 HydrophobicContact CG-CG1 3.99Å; E66-R156 IonicContact OE1-CZ 3.77Å; E66-R156 IonicContact OE1-NE 3.2Å; E66-R156 PolarHBondContact OE1-NE 2.79Å; E66-R156 IonicContact OE1-NH2 3.58Å; E66-R156 PolarHBondContact OE1-NH2 3.46Å; E66-R156 IonicContact OE2-CZ 3.48Å; E66-R156 IonicContact OE2-NE 3.85Å; E66-R156 IonicContact OE2-NH2 3.71Å; E66-R156 PolarHBondContact OE2-NH2 2.91Å
67D83.9Confident91.9Very high161 Ų16130.8 Ų30.886%0.86117%0.165SC*.THydrogen-bonded Turntrans-84.61.7-173.1-57.1-47.5000113.8P69D67-P69 WeakPolarHBondContact O-CD 3.38Å
68V91.8Very high91.8Very high48 Ų4829.7 Ų29.729%0.29116%0.163SC..SBendtrans-83.2119.2-178175.40000109.8Q65 E66 G70 I71 I127Q65-V68 HydrophobicContact CB-CB 4.23Å; Q65-V68 HydrophobicContact CB-CG2 3.82Å; Q65-V68 HydrophobicContact CG-CG2 4.36Å; E66-V68 VanDerWaalsContact C-N 3.27Å; E66-V68 PolarHBondContact O-N 3.21Å; V68-G70 PolarHBondContact O-N 3.39Å; V68-I71 HydrophobicContact CB-CB 4.06Å; V68-I71 HydrophobicContact CB-CG2 4.38Å; V68-I71 HydrophobicContact CG1-CB 4.26Å; V68-I71 VanDerWaalsContact O-CB 3.32Å; V68-I71 WeakPolarHBondContact O-CB 3.41Å; V68-I71 WeakPolarHBondContact O-CG2 3.37Å; V68-I71 PolarHBondContact O-N 2.7Å; V68-I127 HydrophobicContact CG1-CG2 3.48Å; V68-I127 VanDerWaalsContact CG1-CG2 3.48Å
69P92.1Very high91.7Very high98 Ų9829.9 Ų29.964%0.63616%0.164SC*.THydrogen-bonded Turntrans-57.9127.4-177.8-26.335.3000112.6D67 I71 Q321D67-P69 WeakPolarHBondContact O-CD 3.38Å; P69-I71 VanDerWaalsContact C-N 3.3Å; P69-I71 PolarHBondContact O-N 2.83Å; P69-Q321 HydrophobicContact CB-CG 4.38Å
70G94.3Very high91.4Very high3 Ų328.2 Ų28.23%0.03116%0.157CC..THydrogen-bonded Turntrans80.4-2.2176.900000115.8V68 Q72 G73V68-G70 PolarHBondContact O-N 3.39Å; G70-Q72 PolarHBondContact O-N 3.33Å; G70-Q72 VanDerWaalsContact O-N 3.14Å; G70-G73 PolarHBondContact O-N 3.44Å
71I94.9Very high91Very high2 Ų228.1 Ų28.11%0.0116%0.162CC..G310 helixtrans-56.7-30.5179.9-167.861.7000114Q65 V68 P69 G73 V74 F76 I127 L128 R282Q65-I71 HydrophobicContact CB-CD1 4.39Å; Q65-I71 HydrophobicContact CB-CG1 4.06Å; Q65-I71 WeakPolarHBondContact O-CG2 3.39Å; V68-I71 HydrophobicContact CB-CB 4.06Å; V68-I71 HydrophobicContact CB-CG2 4.38Å; V68-I71 HydrophobicContact CG1-CB 4.26Å; V68-I71 VanDerWaalsContact O-CB 3.32Å; V68-I71 WeakPolarHBondContact O-CB 3.41Å; V68-I71 WeakPolarHBondContact O-CG2 3.37Å; V68-I71 PolarHBondContact O-N 2.7Å; P69-I71 VanDerWaalsContact C-N 3.3Å; P69-I71 PolarHBondContact O-N 2.83Å; I71-G73 PolarHBondContact O-N 3.42Å; I71-V74 HydrophobicContact CD1-CG2 4.21Å; I71-V74 WeakPolarHBondContact O-CB 3.26Å; I71-V74 PolarHBondContact O-N 3.2Å; I71-F76 HydrophobicContact CD1-CE1 3.95Å; I71-F76 HydrophobicContact CD1-CZ 3.8Å; I71-F76 HydrophobicContact CG1-CZ 4.03Å; I71-I127 HydrophobicContact CD1-CG2 3.94Å; I71-L128 HydrophobicContact CD1-CD2 3.97Å; I71-R282 PolarHBondContact O-NH1 3.22Å
72Q93.6Very high90.6Very high17 Ų1731 Ų318%0.07917%0.171CC..G310 helixtrans-70.7-18.6177.8-59-61.5-16.300112.8G70 K286 I322G70-Q72 PolarHBondContact O-N 3.33Å; G70-Q72 VanDerWaalsContact O-N 3.14Å; Q72-K286 HydrophobicContact CG-CG 4.46Å; Q72-I322 HydrophobicContact CB-CD1 3.74Å; Q72-I322 HydrophobicContact CB-CG1 3.94Å; Q72-I322 HydrophobicContact CB-CG2 4.24Å; Q72-I322 HydrophobicContact CG-CD1 4.16Å
73G96.3Very high89.7Confident0 Ų031.7 Ų31.70%018%0.176CC..G310 helixtrans-90.5-2.9173.900000113.8G70 I71 M279 A326G70-G73 PolarHBondContact O-N 3.44Å; I71-G73 PolarHBondContact O-N 3.42Å; G73-M279 WeakPolarHBondContact O-CG 3.3Å; G73-A326 VanDerWaalsContact O-CA 3.27Å; G73-A326 WeakPolarHBondContact O-CA 3.39Å; G73-A326 PolarHBondContact O-N 3.39Å
74V97.5Very high88.7Confident0 Ų036.2 Ų36.20%020%0.198CC..  trans-75.6129.1-179.7172.70000110.7I71 F76 H125 I127 L128 R282 V325I71-V74 HydrophobicContact CD1-CG2 4.21Å; I71-V74 WeakPolarHBondContact O-CB 3.26Å; I71-V74 PolarHBondContact O-N 3.2Å; V74-F76 HydrophobicContact CG1-CD1 4.14Å; V74-F76 HydrophobicContact CG1-CE1 4.39Å; V74-F76 HydrophobicContact CG1-CG 4.24Å; V74-F76 PolarHBondContact O-N 3.4Å; V74-H125 WeakPolarHBondContact CG1-NE2 3.49Å; V74-I127 HydrophobicContact CG2-CB 4.43Å; V74-I127 HydrophobicContact CG2-CD1 3.77Å; V74-L128 HydrophobicContact CG1-CD1 4.26Å; V74-L128 HydrophobicContact CG1-CD2 4.17Å; V74-L128 HydrophobicContact CG1-CG 4.34Å; V74-R282 PolarHBondContact O-NH2 3.13Å; V74-V325 HydrophobicContact CG2-CG1 3.88Å
75I97Very high87.3Confident7 Ų735.6 Ų35.64%0.03619%0.191CC..  trans-82.699.9163.3-60.1175.6000106.9A275 E276 M279 E329 I330 L333I75-A275 HydrophobicContact CG2-CB 3.92Å; I75-E276 HydrophobicContact CD1-CB 3.99Å; I75-E276 HydrophobicContact CD1-CG 3.96Å; I75-M279 HydrophobicContact CD1-CE 4.02Å; I75-M279 HydrophobicContact CG1-CB 4.07Å; I75-M279 HydrophobicContact CG1-CE 3.79Å; I75-M279 HydrophobicContact CG1-CG 4.08Å; I75-E329 HydrophobicContact CB-CB 4.17Å; I75-E329 HydrophobicContact CD1-CB 3.81Å; I75-E329 HydrophobicContact CG1-CB 3.74Å; I75-I330 HydrophobicContact CD1-CG1 4.21Å; I75-L333 HydrophobicContact CD1-CB 4.36Å; I75-L333 HydrophobicContact CD1-CD2 3.9Å; I75-L333 HydrophobicContact CG2-CD2 4.41Å
76F95.8Very high85.8Confident12 Ų1238.5 Ų38.55%0.05321%0.207CC..PPolyproline II helixtrans-65.6134-176.1-71.4-83.9000111.1L62 F63 I71 V74 L128 R282L62-F76 HydrophobicContact CB-CD1 4.23Å; L62-F76 HydrophobicContact CB-CE1 4.07Å; L62-F76 WeakPolarHBondContact O-CE1 3.42Å; F63-F76 HydrophobicContact CD1-CB 4.4Å; F63-F76 AromaticContact CD1-CD1 3.87Å; F63-F76 HydrophobicContact CD1-CD1 3.87Å; F63-F76 AromaticContact CD1-CD2 3.68Å; F63-F76 HydrophobicContact CD1-CD2 3.68Å; F63-F76 AromaticContact CD1-CE1 3.92Å; F63-F76 HydrophobicContact CD1-CE1 3.92Å; F63-F76 AromaticContact CD1-CE2 3.69Å; F63-F76 HydrophobicContact CD1-CE2 3.69Å; F63-F76 AromaticContact CD1-CG 3.75Å; F63-F76 HydrophobicContact CD1-CG 3.75Å; F63-F76 AromaticContact CD1-CZ 3.84Å; F63-F76 HydrophobicContact CD1-CZ 3.84Å; F63-F76 HydrophobicContact CE1-CB 3.57Å; F63-F76 AromaticContact CE1-CD1 3.87Å; F63-F76 HydrophobicContact CE1-CD1 3.87Å; F63-F76 AromaticContact CE1-CD2 3.49Å; F63-F76 HydrophobicContact CE1-CD2 3.49Å; F63-F76 VanDerWaalsContact CE1-CD2 3.49Å; F63-F76 HydrophobicContact CE1-CE1 4.38Å; F63-F76 HydrophobicContact CE1-CE2 4.02Å; F63-F76 AromaticContact CE1-CG 3.39Å; F63-F76 HydrophobicContact CE1-CG 3.39Å; F63-F76 HydrophobicContact CE1-CZ 4.46Å; F63-F76 HydrophobicContact CZ-CB 4.42Å; I71-F76 HydrophobicContact CD1-CE1 3.95Å; I71-F76 HydrophobicContact CD1-CZ 3.8Å; I71-F76 HydrophobicContact CG1-CZ 4.03Å; V74-F76 HydrophobicContact CG1-CD1 4.14Å; V74-F76 HydrophobicContact CG1-CE1 4.39Å; V74-F76 HydrophobicContact CG1-CG 4.24Å; V74-F76 PolarHBondContact O-N 3.4Å; F76-L128 HydrophobicContact CD1-CD1 4.2Å; F76-L128 HydrophobicContact CD1-CD2 3.74Å; F76-L128 HydrophobicContact CE1-CD2 3.47Å; F76-L128 VanDerWaalsContact CE1-CD2 3.47Å; F76-R282 VanDerWaalsContact CE2-NH1 3.31Å
77P95.4Very high84.3Confident9 Ų937.8 Ų37.86%0.05821%0.21CC..PPolyproline II helixtrans-52124171.3-28.236.1000110.3L79 F118 Q121 V122 L128P77-L79 PolarHBondContact O-N 2.95Å; P77-F118 HydrophobicContact CB-CD2 3.84Å; P77-F118 HydrophobicContact CB-CE2 4.14Å; P77-F118 WeakPolarHBondContact O-CE2 3.21Å; P77-Q121 HydrophobicContact CB-CB 4.22Å; P77-Q121 HydrophobicContact CG-CB 3.92Å; P77-V122 HydrophobicContact CB-CG2 4.18Å; P77-V122 HydrophobicContact CG-CG2 3.97Å; P77-L128 HydrophobicContact CG-CD1 4.16Å
78P92.3Very high82.2Confident11 Ų1133.9 Ų33.97%0.07120%0.195CC..PPolyproline II helixtrans-72.5132.8-179.428.1-32.4000109.8L268 R271 Y272P78-L268 HydrophobicContact CG-CD1 3.94Å; P78-R271 HydrophobicContact CB-CB 3.5Å; P78-R271 VanDerWaalsContact CB-CB 3.5Å; P78-R271 HydrophobicContact CB-CG 4.42Å; P78-R271 HydrophobicContact CG-CB 3.86Å; P78-Y272 HydrophobicContact CG-CD1 3.98Å; P78-Y272 HydrophobicContact CG-CD2 3.91Å; P78-Y272 HydrophobicContact CG-CE1 3.93Å; P78-Y272 HydrophobicContact CG-CE2 3.85Å; P78-Y272 HydrophobicContact CG-CG 3.96Å
79L91.5Very high79.6Confident4 Ų435.2 Ų35.22%0.02121%0.211CC..PPolyproline II helixtrans-69.9131.5170.4-173.266.8000109.1Y52 F55 E56 P77 L115 F118 R271Y52-L79 HydrophobicContact CE1-CD2 4.4Å; Y52-L79 HydrophobicContact CE2-CD2 4.24Å; Y52-L79 HydrophobicContact CE2-CG 4.37Å; F55-L79 HydrophobicContact CB-CD1 3.71Å; F55-L79 HydrophobicContact CB-CD2 4.05Å; F55-L79 HydrophobicContact CD1-CD1 3.97Å; F55-L79 HydrophobicContact CG-CD1 4.22Å; E56-L79 HydrophobicContact CG-CD2 4.05Å; P77-L79 PolarHBondContact O-N 2.95Å; L79-L115 HydrophobicContact CD1-CD2 4.12Å; L79-F118 HydrophobicContact CB-CE2 4.41Å; L79-F118 HydrophobicContact CD1-CD1 3.93Å; L79-F118 HydrophobicContact CD1-CD2 4.42Å; L79-F118 HydrophobicContact CD1-CE1 3.85Å; L79-F118 HydrophobicContact CD1-CE2 4.35Å; L79-F118 HydrophobicContact CD1-CG 4.22Å; L79-F118 HydrophobicContact CD1-CZ 4.08Å; L79-R271 PolarHBondContact O-NH1 2.91Å
80P87.8Confident77Confident8 Ų839.6 Ų39.65%0.05222%0.22CC..PPolyproline II helixtrans-53.8152.8173.2-2736000112Y52 Y111 A114 L115Y52-P80 WeakPolarHBondContact CE2-O 3.14Å; Y52-P80 PolarHBondContact OH-O 2.99Å; P80-Y111 HydrophobicContact CB-CE2 4.01Å; P80-A114 HydrophobicContact CB-CB 4.18Å; P80-A114 HydrophobicContact CG-CB 3.72Å; P80-L115 HydrophobicContact CB-CD2 4.49Å; P80-L115 HydrophobicContact CG-CD2 4.07Å
81A82.5Confident74.3Confident36 Ų3641.2 Ų41.230%0.29823%0.233SC..PPolyproline II helixtrans-55.4146.5179.300000111.9Y111A81-Y111 WeakPolarHBondContact O-CE2 3.24Å; A81-Y111 VanDerWaalsContact O-CZ 3.28Å; A81-Y111 PolarHBondContact O-OH 2.98Å
82R82.9Confident71.8Confident98 Ų9845.7 Ų45.737%0.3726%0.255SS..PPolyproline II helixtrans-57.6128.1172.4-174.8177.3-72.7-98.84.4109.5Y52 D53 E56 Q84Y52-R82 HydrophobicContact CD1-CB 4.11Å; Y52-R82 HydrophobicContact CD1-CG 3.81Å; Y52-R82 HydrophobicContact CE1-CB 3.58Å; Y52-R82 HydrophobicContact CE1-CG 3.83Å; Y52-R82 HydrophobicContact CE2-CB 4.24Å; Y52-R82 HydrophobicContact CG-CG 4.2Å; Y52-R82 VanDerWaalsContact CZ-CA 3.41Å; Y52-R82 PolarHBondContact OH-N 2.65Å; Y52-R82 VanDerWaalsContact OH-N 3.17Å; D53-R82 IonicContact OD1-CZ 3.31Å; D53-R82 IonicContact OD1-NH1 3.76Å; D53-R82 PolarHBondContact OD1-NH1 3.41Å; D53-R82 IonicContact OD1-NH2 3.42Å; D53-R82 PolarHBondContact OD1-NH2 3.32Å; E56-R82 IonicContact OE1-CZ 2.77Å; E56-R82 IonicContact OE1-NE 2.95Å; E56-R82 IonicContact OE1-NH2 2.75Å; E56-R82 PolarHBondContact OE1-NH2 3.38Å; E56-R82 IonicContact OE2-NH2 3.51Å; E56-R82 PolarHBondContact OE2-NH2 2.98Å; R82-Q84 PolarHBondContact O-N 3.43Å
83P73.9Confident69.2Low19 Ų1954.3 Ų54.312%0.12329%0.292CS..PPolyproline II helixtrans-70.1133.9179.728.5-26000108.7L31 V85 W108 Y111L31-P83 HydrophobicContact CD1-CB 3.98Å; L31-P83 HydrophobicContact CD1-CG 3.6Å; P83-V85 PolarHBondContact O-N 3.4Å; P83-W108 HydrophobicContact CB-CE3 4.37Å; P83-W108 HydrophobicContact CB-CH2 3.83Å; P83-W108 HydrophobicContact CB-CZ3 3.4Å; P83-W108 HydrophobicContact CG-CZ3 4.42Å; P83-Y111 HydrophobicContact CB-CD1 4.46Å; P83-Y111 HydrophobicContact CB-CE1 4.11Å; P83-Y111 HydrophobicContact CB-CE2 4.31Å; P83-Y111 VanDerWaalsContact CD-OH 3.3Å; P83-Y111 WeakPolarHBondContact CD-OH 3.39Å; P83-Y111 HydrophobicContact CG-CD1 4.41Å; P83-Y111 HydrophobicContact CG-CE1 3.72Å
84Q68.6Low66.5Low126 Ų12663 Ų6359%0.58933%0.333SS*.  trans-9296.3176.8-65.2-66-41.500108.8R82R82-Q84 PolarHBondContact O-N 3.43Å
85V59.7Low63.6Low16 Ų1667.9 Ų67.910%0.09736%0.358CS..SBendtrans-69.2-40.1-177.5-177.40000111.4Q26 L31 P83 W108Q26-V85 HydrophobicContact CG-CG1 4.31Å; L31-V85 HydrophobicContact CD1-CG2 3.87Å; L31-V85 HydrophobicContact CD2-CG2 4.08Å; L31-V85 HydrophobicContact CG-CG2 3.68Å; P83-V85 PolarHBondContact O-N 3.4Å; V85-W108 HydrophobicContact CG2-CH2 4.34Å; V85-W108 HydrophobicContact CG2-CZ2 4.38Å
86N53.6Low60.8Low88 Ų8868.7 Ų68.747%0.47137%0.368SS..SBendtrans-138.789.4178.8-74.6-39.7000110.3D29 S88D29-N86 PolarHBondContact OD1-ND2 3.46Å; N86-S88 PolarHBondContact O-N 3.3Å; N86-S88 VanDerWaalsContact O-N 3.14Å
87A44.2Very low57.9Low31 Ų3172.1 Ų72.126%0.25638%0.383SS..  trans-65.5114.7176.200000110.6A91A87-A91 HydrophobicContact CB-CB 4.33Å
88S39.6Very low55.2Low79 Ų7976.1 Ų76.155%0.55241%0.41SS*.  trans-65.6158.5175.376.60000112.3N86 K90 A91 M92N86-S88 PolarHBondContact O-N 3.3Å; N86-S88 VanDerWaalsContact O-N 3.14Å; S88-K90 PolarHBondContact O-N 3.25Å; S88-A91 WeakPolarHBondContact O-CA 3.47Å; S88-A91 WeakPolarHBondContact O-CB 3.44Å; S88-A91 PolarHBondContact O-N 3.19Å; S88-M92 WeakPolarHBondContact O-CG 3.12Å; S88-M92 PolarHBondContact O-N 3.4Å; S88-M92 VanDerWaalsContact O-N 3.1Å
89A38Very low52.4Low75 Ų7578.8 Ų78.862%0.6243%0.429SS*.THydrogen-bonded Turntrans-54.5-18.6-179.200000116M92A89-M92 HydrophobicContact CB-CE 3.91Å
90K36.5Very low49.8Very low190 Ų19090.4 Ų90.483%0.82647%0.473SS*.THydrogen-bonded Turntrans-84-35.3172-88.5-178175.8177.60113.2S88 M92 K93S88-K90 PolarHBondContact O-N 3.25Å; K90-M92 PolarHBondContact O-N 3.39Å; K90-K93 PolarHBondContact O-N 3.39Å
91A39.5Very low47.1Very low37 Ų3795 Ų9531%0.30650%0.501SS..G310 helixtrans-66.7-27.3169.800000111.3A87 S88 K93 Q94 L95A87-A91 HydrophobicContact CB-CB 4.33Å; S88-A91 WeakPolarHBondContact O-CA 3.47Å; S88-A91 WeakPolarHBondContact O-CB 3.44Å; S88-A91 PolarHBondContact O-N 3.19Å; A91-K93 PolarHBondContact O-N 2.8Å; A91-K93 VanDerWaalsContact O-N 3.12Å; A91-Q94 PolarHBondContact O-N 2.91Å; A91-Q94 VanDerWaalsContact O-N 3.17Å; A91-L95 PolarHBondContact O-N 3.07Å
92M42Very low45Very low97 Ų9798.6 Ų98.648%0.47852%0.524SS..G310 helixtrans-65-8.7176.9-64.8-147.1-75.900115.9S88 A89 K90S88-M92 WeakPolarHBondContact O-CG 3.12Å; S88-M92 PolarHBondContact O-N 3.4Å; S88-M92 VanDerWaalsContact O-N 3.1Å; A89-M92 HydrophobicContact CB-CE 3.91Å; K90-M92 PolarHBondContact O-N 3.39Å
93K38.3Very low43.2Very low198 Ų19895.4 Ų95.486%0.86152%0.516SS*.G310 helixtrans-92.7-17.6173.4-85.9-171.8176.8-176.50114.2K90 A91K90-K93 PolarHBondContact O-N 3.39Å; A91-K93 PolarHBondContact O-N 2.8Å; A91-K93 VanDerWaalsContact O-N 3.12Å
94Q38.8Very low42Very low182 Ų18297.4 Ų97.485%0.8553%0.53SS*.THydrogen-bonded Turntrans-114.3-23179.3-74.4-161.2-27.100113.6A91A91-Q94 PolarHBondContact O-N 2.91Å; A91-Q94 VanDerWaalsContact O-N 3.17Å
95L37.4Very low41.1Very low103 Ų10395.5 Ų95.554%0.53953%0.527SS..SBendtrans-126.7106170.3-82.2142000106.8A91 K97 L198A91-L95 PolarHBondContact O-N 3.07Å; L95-K97 PolarHBondContact O-N 3.45Å; L95-L198 HydrophobicContact CD2-CD2 3.83Å
96G38.1Very low41Very low23 Ų23104.8 Ų104.824%0.23756%0.56CS.*  trans-61133.9-178.600000111.3L202 Q205G96-L202 VanDerWaalsContact CA-CD2 3.42Å; G96-L202 WeakPolarHBondContact O-CD2 3.2Å; G96-Q205 PolarHBondContact O-OE1 2.94Å
97K36Very low41.7Very low85 Ų85104.5 Ų104.537%0.3756%0.556SS.*  trans41.783151.7-63.3174175.4179.60116.4L95 Q205 V209L95-K97 PolarHBondContact O-N 3.45Å; K97-Q205 PolarHBondContact O-NE2 3.49Å; K97-Q205 PolarHBondContact O-OE1 3.29Å; K97-V209 HydrophobicContact CD-CG2 3.91Å
98C36.9Very low43.2Very low93 Ų93104.7 Ų104.763%0.62855%0.55SS**  trans-115.2149.2152.7-141.90000110.2
99S35Very low45.2Very low67 Ų67105 Ų10547%0.46954%0.543SS..  trans82.997.7170.3-163.40000118.2
100R35.4Very low47.1Very low247 Ų247103 Ų10393%0.93252%0.523SS*.SBendtrans-151.777.3131.3-73.8-160-162.8156.46.5110.9
101T32.9Very low49.3Very low106 Ų10695.1 Ų95.165%0.6549%0.489SS*.SBendtrans-166.7140.6143.834.10000104.9P103T101-P103 VanDerWaalsContact O-N 3.12Å
102S36.5Very low51.7Low111 Ų11193.4 Ų93.478%0.77648%0.475SS*.  trans-43.9122.7171.4-178.80000108.8S104S102-S104 PolarHBondContact O-N 2.96Å
103P45.7Very low53.9Low31 Ų3193.6 Ų93.620%0.20147%0.473CS..  trans-59.4118.5-177.6-2130.6000108.6T101 E107 W108T101-P103 VanDerWaalsContact O-N 3.12Å; P103-E107 WeakPolarHBondContact CA-OE2 3.36Å; P103-W108 HydrophobicContact CB-CZ2 4.49Å; P103-W108 HydrophobicContact CG-CZ2 4.45Å
104S49.2Very low56.2Low60 Ų6085.3 Ų85.342%0.4244%0.441SS..  trans-68.515216962.30000108.8S102 R106 E107S102-S104 PolarHBondContact O-N 2.96Å; S104-R106 PolarHBondContact O-N 3.05Å; S104-E107 PolarHBondContact N-OE1 3.1Å; S104-E107 PolarHBondContact O-N 3.33Å; S104-E107 PolarHBondContact OG-OE1 3.45Å
105T50.5Low58.8Low86 Ų8676.6 Ų76.653%0.52840%0.401SS..THydrogen-bonded Turntrans-51.4-21.2176.6-46.30000113.3V24V24-T105 HydrophobicContact CG1-CG2 4.42Å
106R56.7Low61.5Low212 Ų21272.4 Ų72.480%0.838%0.378SS*.THydrogen-bonded Turntrans-69.5-30.4177-171.9178-73.9-136.1-0.2113.4S104 W108 Q109S104-R106 PolarHBondContact O-N 3.05Å; R106-W108 VanDerWaalsContact C-N 3.32Å; R106-W108 PolarHBondContact O-N 3.33Å; R106-Q109 PolarHBondContact O-N 3.3Å
107E68.2Low64.1Low82 Ų8273.5 Ų73.538%0.38338%0.38SS..THydrogen-bonded Turntrans-70.9-28.1-175.8-73.4165.2-132.100112.9P103 S104P103-E107 WeakPolarHBondContact CA-OE2 3.36Å; S104-E107 PolarHBondContact N-OE1 3.1Å; S104-E107 PolarHBondContact O-N 3.33Å; S104-E107 PolarHBondContact OG-OE1 3.45Å
108W76.3Confident66.9Low34 Ų3469.6 Ų69.613%0.12936%0.363CS..THydrogen-bonded Turntrans-89.9-4.5-179-65.2114.1000114.2V24 L31 P83 V85 P103 R106 Y111 C112V24-W108 HydrophobicContact CB-CB 4.48Å; V24-W108 HydrophobicContact CG1-CB 3.51Å; V24-W108 HydrophobicContact CG1-CG 3.79Å; L31-W108 HydrophobicContact CD1-CD2 4.02Å; L31-W108 HydrophobicContact CD1-CE3 3.93Å; L31-W108 HydrophobicContact CD1-CH2 3.67Å; L31-W108 HydrophobicContact CD1-CZ2 3.71Å; L31-W108 HydrophobicContact CD1-CZ3 3.78Å; L31-W108 HydrophobicContact CD2-CZ2 4.11Å; L31-W108 HydrophobicContact CG-CZ2 4.49Å; P83-W108 HydrophobicContact CB-CE3 4.37Å; P83-W108 HydrophobicContact CB-CH2 3.83Å; P83-W108 HydrophobicContact CB-CZ3 3.4Å; P83-W108 HydrophobicContact CG-CZ3 4.42Å; V85-W108 HydrophobicContact CG2-CH2 4.34Å; V85-W108 HydrophobicContact CG2-CZ2 4.38Å; P103-W108 HydrophobicContact CB-CZ2 4.49Å; P103-W108 HydrophobicContact CG-CZ2 4.45Å; R106-W108 VanDerWaalsContact C-N 3.32Å; R106-W108 PolarHBondContact O-N 3.33Å; W108-Y111 HydrophobicContact CE3-CD1 4.47Å; W108-Y111 HydrophobicContact CE3-CG 4.41Å; W108-Y111 WeakPolarHBondContact O-CB 3.16Å; W108-Y111 PolarHBondContact O-N 3.39Å; W108-Y111 VanDerWaalsContact O-N 3.1Å; W108-C112 PolarHBondContact O-N 2.9Å; W108-C112 PolarHBondContact O-SG 2.97Å
109Q81Confident69.8Low86 Ų8665.3 Ų65.340%0.40233%0.334SS..Hα-helixtrans-56.8-45.5-176.6-72.2-67.1-41.100113.4R106 Y111 C112 K113R106-Q109 PolarHBondContact O-N 3.3Å; Q109-Y111 VanDerWaalsContact C-N 3.28Å; Q109-Y111 PolarHBondContact O-N 3.46Å; Q109-C112 PolarHBondContact O-N 3.21Å; Q109-K113 PolarHBondContact O-N 3.38Å
110P79.1Confident72.7Confident32 Ų3265 Ų6521%0.20832%0.323CS..Hα-helixtrans-63.5-36176.7-25.139.2000112.4K113 A114 N260 L264P110-K113 WeakPolarHBondContact O-CB 3.47Å; P110-K113 PolarHBondContact O-N 2.76Å; P110-A114 PolarHBondContact O-N 3.1Å; P110-N260 HydrophobicContact CB-CB 4.2Å; P110-N260 HydrophobicContact CG-CB 3.79Å; P110-L264 HydrophobicContact CB-CD1 3.37Å
111Y82.3Confident75.5Confident25 Ų2556.1 Ų56.110%0.09829%0.292CS..Hα-helixtrans-67.8-44.2176.3-167-100.5000112.3F33 Y52 P80 A81 P83 W108 Q109 K113 A114 L115F33-Y111 AromaticContact CE1-CD1 3.87Å; F33-Y111 HydrophobicContact CE1-CD1 3.87Å; F33-Y111 HydrophobicContact CE1-CE1 4.13Å; F33-Y111 HydrophobicContact CE2-CE1 4.43Å; F33-Y111 AromaticContact CZ-CD1 3.82Å; F33-Y111 HydrophobicContact CZ-CD1 3.82Å; F33-Y111 AromaticContact CZ-CE1 3.63Å; F33-Y111 HydrophobicContact CZ-CE1 3.63Å; Y52-Y111 WeakPolarHBondContact CD2-OH 3.23Å; Y52-Y111 WeakPolarHBondContact CE2-OH 3.48Å; P80-Y111 HydrophobicContact CB-CE2 4.01Å; A81-Y111 WeakPolarHBondContact O-CE2 3.24Å; A81-Y111 VanDerWaalsContact O-CZ 3.28Å; A81-Y111 PolarHBondContact O-OH 2.98Å; P83-Y111 HydrophobicContact CB-CD1 4.46Å; P83-Y111 HydrophobicContact CB-CE1 4.11Å; P83-Y111 HydrophobicContact CB-CE2 4.31Å; P83-Y111 VanDerWaalsContact CD-OH 3.3Å; P83-Y111 WeakPolarHBondContact CD-OH 3.39Å; P83-Y111 HydrophobicContact CG-CD1 4.41Å; P83-Y111 HydrophobicContact CG-CE1 3.72Å; W108-Y111 HydrophobicContact CE3-CD1 4.47Å; W108-Y111 HydrophobicContact CE3-CG 4.41Å; W108-Y111 WeakPolarHBondContact O-CB 3.16Å; W108-Y111 PolarHBondContact O-N 3.39Å; W108-Y111 VanDerWaalsContact O-N 3.1Å; Q109-Y111 VanDerWaalsContact C-N 3.28Å; Q109-Y111 PolarHBondContact O-N 3.46Å; Y111-K113 PolarHBondContact O-N 2.76Å; Y111-A114 WeakPolarHBondContact O-CB 3.42Å; Y111-A114 PolarHBondContact O-N 2.75Å; Y111-A114 VanDerWaalsContact O-N 3.12Å; Y111-L115 HydrophobicContact CD1-CD1 4.02Å; Y111-L115 HydrophobicContact CD1-CG 4.37Å; Y111-L115 HydrophobicContact CE1-CD1 3.61Å; Y111-L115 HydrophobicContact CE1-CD2 4.39Å; Y111-L115 HydrophobicContact CE1-CG 3.96Å; Y111-L115 PolarHBondContact O-N 3.35Å
112C89.1Confident78.5Confident1 Ų151.1 Ų51.11%0.00726%0.261CS..Hα-helixtrans-57.3-41.7172.1-64.80000110.6V21 W108 Q109 A114 L115 E116V21-C112 HydrophobicContact CB-CB 4.11Å; V21-C112 WeakPolarHBondContact CB-O 3.45Å; V21-C112 HydrophobicContact CG1-CB 3.75Å; W108-C112 PolarHBondContact O-N 2.9Å; W108-C112 PolarHBondContact O-SG 2.97Å; Q109-C112 PolarHBondContact O-N 3.21Å; C112-A114 VanDerWaalsContact C-N 3.34Å; C112-A114 PolarHBondContact O-N 2.86Å; C112-L115 PolarHBondContact O-N 2.97Å; C112-E116 VanDerWaalsContact O-CB 3.27Å; C112-E116 WeakPolarHBondContact O-CB 3.42Å; C112-E116 PolarHBondContact O-N 3.42Å
113K88.1Confident81.4Confident101 Ų10146.3 Ų46.344%0.43923%0.228SC..Hα-helixtrans-64.4-36.2176.9-168.964.2178.6-173.90113Q109 P110 Y111 E116 T117Q109-K113 PolarHBondContact O-N 3.38Å; P110-K113 WeakPolarHBondContact O-CB 3.47Å; P110-K113 PolarHBondContact O-N 2.76Å; Y111-K113 PolarHBondContact O-N 2.76Å; K113-E116 WeakPolarHBondContact CD-OE1 3.49Å; K113-E116 WeakPolarHBondContact CE-OE1 3.05Å; K113-E116 IonicContact NZ-OE1 3.6Å; K113-E116 PolarHBondContact NZ-OE1 3.37Å; K113-T117 WeakPolarHBondContact O-CB 3.5Å; K113-T117 PolarHBondContact O-N 3.03Å; K113-T117 PolarHBondContact O-OG1 3Å
114A88Confident83.7Confident24 Ų2448.7 Ų48.720%0.19825%0.25CS..Hα-helixtrans-66.1-46.5175.100000111.4P80 P110 Y111 C112 E116 T117 F118P80-A114 HydrophobicContact CB-CB 4.18Å; P80-A114 HydrophobicContact CG-CB 3.72Å; P110-A114 PolarHBondContact O-N 3.1Å; Y111-A114 WeakPolarHBondContact O-CB 3.42Å; Y111-A114 PolarHBondContact O-N 2.75Å; Y111-A114 VanDerWaalsContact O-N 3.12Å; C112-A114 VanDerWaalsContact C-N 3.34Å; C112-A114 PolarHBondContact O-N 2.86Å; A114-E116 VanDerWaalsContact C-N 3.35Å; A114-E116 PolarHBondContact O-N 3.14Å; A114-T117 PolarHBondContact O-N 3.09Å; A114-F118 PolarHBondContact O-N 3.47Å
115L92.9Very high85.9Confident0 Ų046.9 Ų46.90%024%0.235CC..Hα-helixtrans-61.9-41.8174.3-68.8177.4000112V21 F33 F55 L79 P80 Y111 C112 T117 F118 L119V21-L115 HydrophobicContact CG2-CB 4.18Å; F33-L115 HydrophobicContact CD1-CD1 3.9Å; F33-L115 HydrophobicContact CD2-CD1 3.89Å; F33-L115 HydrophobicContact CE1-CD1 3.82Å; F33-L115 HydrophobicContact CE2-CD1 3.81Å; F33-L115 HydrophobicContact CG-CD1 3.95Å; F33-L115 HydrophobicContact CZ-CD1 3.78Å; F55-L115 HydrophobicContact CD1-CD2 3.85Å; F55-L115 HydrophobicContact CD2-CD2 4.49Å; F55-L115 HydrophobicContact CE1-CB 3.95Å; F55-L115 HydrophobicContact CE1-CD1 4.37Å; F55-L115 HydrophobicContact CE1-CD2 3.83Å; F55-L115 HydrophobicContact CE1-CG 4.27Å; F55-L115 HydrophobicContact CE2-CD1 4.01Å; F55-L115 HydrophobicContact CE2-CD2 4.5Å; F55-L115 HydrophobicContact CG-CD2 4.19Å; F55-L115 HydrophobicContact CZ-CB 4.04Å; F55-L115 HydrophobicContact CZ-CD1 3.89Å; F55-L115 HydrophobicContact CZ-CD2 4.17Å; F55-L115 HydrophobicContact CZ-CG 4.27Å; L79-L115 HydrophobicContact CD1-CD2 4.12Å; P80-L115 HydrophobicContact CB-CD2 4.49Å; P80-L115 HydrophobicContact CG-CD2 4.07Å; Y111-L115 HydrophobicContact CD1-CD1 4.02Å; Y111-L115 HydrophobicContact CD1-CG 4.37Å; Y111-L115 HydrophobicContact CE1-CD1 3.61Å; Y111-L115 HydrophobicContact CE1-CD2 4.39Å; Y111-L115 HydrophobicContact CE1-CG 3.96Å; Y111-L115 PolarHBondContact O-N 3.35Å; C112-L115 PolarHBondContact O-N 2.97Å; L115-T117 VanDerWaalsContact C-N 3.32Å; L115-T117 PolarHBondContact O-N 3.48Å; L115-F118 WeakPolarHBondContact O-CB 3.43Å; L115-F118 PolarHBondContact O-N 2.93Å; L115-L119 WeakPolarHBondContact O-CG 3.47Å; L115-L119 PolarHBondContact O-N 3.26Å
116E94.6Very high87.9Confident15 Ų1546.7 Ų46.77%0.0724%0.237CC..Hα-helixtrans-58.4-44.7174.5178-179.2111.800111.5K20 V21 C112 K113 A114 L119 R120K20-E116 VanDerWaalsContact CA-OE2 3.24Å; K20-E116 WeakPolarHBondContact CA-OE2 3.45Å; V21-E116 HydrophobicContact CB-CB 4.16Å; V21-E116 HydrophobicContact CG2-CB 3.82Å; V21-E116 PolarHBondContact N-OE2 3.42Å; V21-E116 VanDerWaalsContact N-OE2 3.14Å; C112-E116 VanDerWaalsContact O-CB 3.27Å; C112-E116 WeakPolarHBondContact O-CB 3.42Å; C112-E116 PolarHBondContact O-N 3.42Å; K113-E116 WeakPolarHBondContact CD-OE1 3.49Å; K113-E116 WeakPolarHBondContact CE-OE1 3.05Å; K113-E116 IonicContact NZ-OE1 3.6Å; K113-E116 PolarHBondContact NZ-OE1 3.37Å; A114-E116 VanDerWaalsContact C-N 3.35Å; A114-E116 PolarHBondContact O-N 3.14Å; E116-L119 PolarHBondContact O-N 2.98Å; E116-R120 VanDerWaalsContact CD-CZ 3.48Å; E116-R120 WeakPolarHBondContact O-CG 3.18Å; E116-R120 PolarHBondContact O-N 3.41Å; E116-R120 IonicContact OE1-CZ 3.63Å; E116-R120 IonicContact OE1-NH1 3.85Å; E116-R120 PolarHBondContact OE1-NH1 2.94Å; E116-R120 IonicContact OE1-NH2 3.78Å; E116-R120 PolarHBondContact OE1-NH2 2.76Å; E116-R120 IonicContact OE2-NH2 3.03Å
117T92.1Very high89.8Confident46 Ų4637.6 Ų37.628%0.28220%0.204SC..Hα-helixtrans-62.5-46.5178.4-57.60000110.8K113 A114 L115 L119 R120 Q121K113-T117 WeakPolarHBondContact O-CB 3.5Å; K113-T117 PolarHBondContact O-N 3.03Å; K113-T117 PolarHBondContact O-OG1 3Å; A114-T117 PolarHBondContact O-N 3.09Å; L115-T117 VanDerWaalsContact C-N 3.32Å; L115-T117 PolarHBondContact O-N 3.48Å; T117-L119 PolarHBondContact O-N 3.28Å; T117-R120 PolarHBondContact O-N 3.19Å; T117-Q121 VanDerWaalsContact O-CG 3.31Å; T117-Q121 WeakPolarHBondContact O-CG 3.32Å; T117-Q121 PolarHBondContact O-N 3.37Å
118F95.4Very high91.1Very high3 Ų333.7 Ų33.71%0.01319%0.186CC..Hα-helixtrans-54.1-49.9173.9165.3-97.9000111.7F55 L58 L62 P77 L79 A114 L115 R120 Q121 V122F55-F118 HydrophobicContact CD1-CD1 4.13Å; F55-F118 HydrophobicContact CD1-CE1 4.11Å; F55-F118 HydrophobicContact CE1-CD1 4.46Å; L58-F118 HydrophobicContact CD2-CE1 4.09Å; L62-F118 HydrophobicContact CD1-CZ 4.41Å; P77-F118 HydrophobicContact CB-CD2 3.84Å; P77-F118 HydrophobicContact CB-CE2 4.14Å; P77-F118 WeakPolarHBondContact O-CE2 3.21Å; L79-F118 HydrophobicContact CB-CE2 4.41Å; L79-F118 HydrophobicContact CD1-CD1 3.93Å; L79-F118 HydrophobicContact CD1-CD2 4.42Å; L79-F118 HydrophobicContact CD1-CE1 3.85Å; L79-F118 HydrophobicContact CD1-CE2 4.35Å; L79-F118 HydrophobicContact CD1-CG 4.22Å; L79-F118 HydrophobicContact CD1-CZ 4.08Å; A114-F118 PolarHBondContact O-N 3.47Å; L115-F118 WeakPolarHBondContact O-CB 3.43Å; L115-F118 PolarHBondContact O-N 2.93Å; F118-R120 PolarHBondContact O-N 3.25Å; F118-Q121 PolarHBondContact O-N 3.41Å; F118-V122 HydrophobicContact CD2-CG2 4.31Å; F118-V122 HydrophobicContact CE1-CG2 4.39Å; F118-V122 HydrophobicContact CE2-CG2 3.92Å; F118-V122 HydrophobicContact CZ-CG2 3.96Å; F118-V122 WeakPolarHBondContact O-CG2 3.5Å; F118-V122 PolarHBondContact O-N 3.33Å
119L97.2Very high92Very high3 Ų332.6 Ų32.62%0.01618%0.184CC..Hα-helixtrans-64.3-42.1-179.6-67.3171.9000112.7V19 V21 I35 F55 L58 L115 E116 T117 Q121 V122 A123 F137V19-L119 HydrophobicContact CG1-CB 3.89Å; V19-L119 HydrophobicContact CG1-CD1 4.03Å; V21-L119 HydrophobicContact CG2-CD1 4.12Å; I35-L119 HydrophobicContact CD1-CD1 3.76Å; I35-L119 HydrophobicContact CG1-CD1 4.46Å; I35-L119 HydrophobicContact CG2-CD1 4.14Å; F55-L119 HydrophobicContact CD1-CD2 4.37Å; F55-L119 HydrophobicContact CE1-CD1 3.77Å; F55-L119 HydrophobicContact CE1-CD2 3.91Å; F55-L119 HydrophobicContact CE1-CG 3.85Å; F55-L119 HydrophobicContact CZ-CD1 4.11Å; L58-L119 HydrophobicContact CD2-CD2 3.86Å; L115-L119 WeakPolarHBondContact O-CG 3.47Å; L115-L119 PolarHBondContact O-N 3.26Å; E116-L119 PolarHBondContact O-N 2.98Å; T117-L119 PolarHBondContact O-N 3.28Å; L119-Q121 VanDerWaalsContact C-N 3.33Å; L119-Q121 PolarHBondContact O-N 3.4Å; L119-V122 PolarHBondContact O-N 3.26Å; L119-A123 VanDerWaalsContact O-CB 3.25Å; L119-A123 WeakPolarHBondContact O-CB 3.19Å; L119-A123 PolarHBondContact O-N 3.34Å; L119-F137 HydrophobicContact CD1-CE1 4.08Å; L119-F137 HydrophobicContact CD2-CD1 3.87Å; L119-F137 HydrophobicContact CD2-CE1 3.41Å; L119-F137 VanDerWaalsContact CD2-CE1 3.41Å; L119-F137 HydrophobicContact CD2-CZ 4.24Å; L119-F137 HydrophobicContact CG-CE1 4.38Å
120R95.8Very high92.6Very high61 Ų6135.1 Ų35.123%0.2319%0.193CC..Hα-helixtrans-62.8-40.9177.3-74.8-162.9-173.3116.79.4111.9H17 V19 E116 T117 F118 A123 A124H17-R120 PolarHBondContact O-NE 3.36Å; V19-R120 HydrophobicContact CB-CG 4.24Å; V19-R120 PolarHBondContact O-NE 3.36Å; V19-R120 PolarHBondContact O-NH2 2.99Å; E116-R120 VanDerWaalsContact CD-CZ 3.48Å; E116-R120 WeakPolarHBondContact O-CG 3.18Å; E116-R120 PolarHBondContact O-N 3.41Å; E116-R120 IonicContact OE1-CZ 3.63Å; E116-R120 IonicContact OE1-NH1 3.85Å; E116-R120 PolarHBondContact OE1-NH1 2.94Å; E116-R120 IonicContact OE1-NH2 3.78Å; E116-R120 PolarHBondContact OE1-NH2 2.76Å; E116-R120 IonicContact OE2-NH2 3.03Å; T117-R120 PolarHBondContact O-N 3.19Å; F118-R120 PolarHBondContact O-N 3.25Å; R120-A123 PolarHBondContact O-N 3.15Å; R120-A124 WeakPolarHBondContact O-CB 3.44Å; R120-A124 PolarHBondContact O-N 2.95Å
121Q94.5Very high93.3Very high59 Ų5934.4 Ų34.428%0.27619%0.188SC..Hα-helixtrans-65-45.6177.1-72.5169.2-29.900111.5P77 T117 F118 L119 A123 A124 H125 Y272P77-Q121 HydrophobicContact CB-CB 4.22Å; P77-Q121 HydrophobicContact CG-CB 3.92Å; T117-Q121 VanDerWaalsContact O-CG 3.31Å; T117-Q121 WeakPolarHBondContact O-CG 3.32Å; T117-Q121 PolarHBondContact O-N 3.37Å; F118-Q121 PolarHBondContact O-N 3.41Å; L119-Q121 VanDerWaalsContact C-N 3.33Å; L119-Q121 PolarHBondContact O-N 3.4Å; Q121-A123 VanDerWaalsContact C-N 3.32Å; Q121-A123 PolarHBondContact O-N 3.06Å; Q121-A124 PolarHBondContact O-N 3.08Å; Q121-H125 VanDerWaalsContact O-CB 3.27Å; Q121-H125 WeakPolarHBondContact O-CB 2.94Å; Q121-H125 PolarHBondContact O-N 2.73Å; Q121-Y272 PolarHBondContact NE2-OH 2.89Å; Q121-Y272 PolarHBondContact OE1-OH 3.37Å
122V96.5Very high93.8Very high1 Ų140 Ų401%0.00621%0.213CC..Hα-helixtrans-60-43.8175.3172.10000111.2L62 P77 F118 L119 H125 L128 S129 V134L62-V122 HydrophobicContact CD1-CG1 3.88Å; L62-V122 HydrophobicContact CD1-CG2 3.75Å; L62-V122 HydrophobicContact CD2-CG1 4.02Å; P77-V122 HydrophobicContact CB-CG2 4.18Å; P77-V122 HydrophobicContact CG-CG2 3.97Å; F118-V122 HydrophobicContact CD2-CG2 4.31Å; F118-V122 HydrophobicContact CE1-CG2 4.39Å; F118-V122 HydrophobicContact CE2-CG2 3.92Å; F118-V122 HydrophobicContact CZ-CG2 3.96Å; F118-V122 WeakPolarHBondContact O-CG2 3.5Å; F118-V122 PolarHBondContact O-N 3.33Å; L119-V122 PolarHBondContact O-N 3.26Å; V122-H125 PolarHBondContact O-N 2.89Å; V122-L128 HydrophobicContact CG1-CB 4.27Å; V122-S129 PolarHBondContact O-N 3.32Å; V122-V134 HydrophobicContact CG1-CG1 4.18Å; V122-V134 HydrophobicContact CG1-CG2 3.5Å
123A95.9Very high94.1Very high10 Ų1040.3 Ų40.38%0.08322%0.215CC..Hα-helixtrans-70.9-31.2-179.600000113.6L12 L119 R120 Q121 S129L12-A123 HydrophobicContact CD1-CB 3.76Å; L119-A123 VanDerWaalsContact O-CB 3.25Å; L119-A123 WeakPolarHBondContact O-CB 3.19Å; L119-A123 PolarHBondContact O-N 3.34Å; R120-A123 PolarHBondContact O-N 3.15Å; Q121-A123 VanDerWaalsContact C-N 3.32Å; Q121-A123 PolarHBondContact O-N 3.06Å; A123-S129 VanDerWaalsContact O-CB 3.29Å; A123-S129 WeakPolarHBondContact O-CB 3.24Å
124A94Very high94.4Very high81 Ų8135.7 Ų35.767%0.66920%0.195SC*.Hα-helixtrans-83-19.9177.900000113.2R120 Q121 S126R120-A124 WeakPolarHBondContact O-CB 3.44Å; R120-A124 PolarHBondContact O-N 2.95Å; Q121-A124 PolarHBondContact O-N 3.08Å; A124-S126 PolarHBondContact O-N 3.49Å
125H95.3Very high94.7Very high23 Ų2335.7 Ų35.711%0.10619%0.191CC..  trans-72.2129.2-175.9-174.1-52.8000111.7V74 Q121 V122 I127 L128 S129 E329V74-H125 WeakPolarHBondContact CG1-NE2 3.49Å; Q121-H125 VanDerWaalsContact O-CB 3.27Å; Q121-H125 WeakPolarHBondContact O-CB 2.94Å; Q121-H125 PolarHBondContact O-N 2.73Å; V122-H125 PolarHBondContact O-N 2.89Å; H125-I127 VanDerWaalsContact C-N 3.32Å; H125-I127 PolarHBondContact ND1-N 2.94Å; H125-I127 PolarHBondContact O-N 3.4Å; H125-L128 HydrophobicContact CB-CB 4.01Å; H125-L128 HydrophobicContact CB-CD1 4.13Å; H125-L128 HydrophobicContact CB-CG 4.11Å; H125-L128 PolarHBondContact ND1-N 3.26Å; H125-L128 PolarHBondContact O-N 2.88Å; H125-S129 WeakPolarHBondContact O-CB 3.26Å; H125-S129 PolarHBondContact O-N 3.17Å; H125-S129 PolarHBondContact O-OG 3.03Å; H125-E329 IonicContact CD2-OE1 2.76Å; H125-E329 IonicContact CE1-OE1 3.47Å; H125-E329 IonicContact NE2-OE1 3.37Å; H125-E329 PolarHBondContact NE2-OE1 2.95Å; H125-E329 IonicContact NE2-OE2 2.77Å
126S93.5Very high94.8Very high81 Ų8137.9 Ų37.957%0.56621%0.205SC*.THydrogen-bonded Turntrans-62.5-30-172.364.20000115.3A124 K130A124-S126 PolarHBondContact O-N 3.49Å; S126-K130 WeakPolarHBondContact O-CD 3.46Å; S126-K130 WeakPolarHBondContact O-CE 3.45Å; S126-K130 PolarHBondContact O-NZ 3.42Å
127I95.3Very high94.9Very high21 Ų2137.1 Ų37.111%0.10820%0.201CC..THydrogen-bonded Turntrans-89.2-54.6173.1-53.5179.7000111.9V68 I71 V74 H125 S129 K130 V325V68-I127 HydrophobicContact CG1-CG2 3.48Å; V68-I127 VanDerWaalsContact CG1-CG2 3.48Å; I71-I127 HydrophobicContact CD1-CG2 3.94Å; V74-I127 HydrophobicContact CG2-CB 4.43Å; V74-I127 HydrophobicContact CG2-CD1 3.77Å; H125-I127 VanDerWaalsContact C-N 3.32Å; H125-I127 PolarHBondContact ND1-N 2.94Å; H125-I127 PolarHBondContact O-N 3.4Å; I127-S129 PolarHBondContact O-N 2.97Å; I127-K130 WeakPolarHBondContact O-CB 2.98Å; I127-K130 PolarHBondContact O-N 3.14Å; I127-V325 HydrophobicContact CD1-CG1 4.01Å; I127-V325 HydrophobicContact CD1-CG2 3.98Å
128L96Very high95Very high0 Ų035 Ų350%019%0.188CC..G310 helixtrans-65.2-35.9-171.4-55.1179.2000113.8L62 I71 V74 F76 P77 V122 H125 K130 N131L62-L128 HydrophobicContact CD2-CB 4.17Å; L62-L128 HydrophobicContact CD2-CD2 4.32Å; I71-L128 HydrophobicContact CD1-CD2 3.97Å; V74-L128 HydrophobicContact CG1-CD1 4.26Å; V74-L128 HydrophobicContact CG1-CD2 4.17Å; V74-L128 HydrophobicContact CG1-CG 4.34Å; F76-L128 HydrophobicContact CD1-CD1 4.2Å; F76-L128 HydrophobicContact CD1-CD2 3.74Å; F76-L128 HydrophobicContact CE1-CD2 3.47Å; F76-L128 VanDerWaalsContact CE1-CD2 3.47Å; P77-L128 HydrophobicContact CG-CD1 4.16Å; V122-L128 HydrophobicContact CG1-CB 4.27Å; H125-L128 HydrophobicContact CB-CB 4.01Å; H125-L128 HydrophobicContact CB-CD1 4.13Å; H125-L128 HydrophobicContact CB-CG 4.11Å; H125-L128 PolarHBondContact ND1-N 3.26Å; H125-L128 PolarHBondContact O-N 2.88Å; L128-K130 PolarHBondContact O-N 3.23Å; L128-K130 VanDerWaalsContact O-N 3.1Å; L128-N131 VanDerWaalsContact O-CB 3.24Å; L128-N131 WeakPolarHBondContact O-CB 3.46Å; L128-N131 PolarHBondContact O-N 3.19Å
129S95.2Very high95Very high12 Ų1236.2 Ų36.28%0.08420%0.196CC..G310 helixtrans-60-20.617859.40000113.8L12 V122 A123 H125 I127 N131L12-S129 VanDerWaalsContact CD2-O 3.26Å; L12-S129 WeakPolarHBondContact CD2-O 3.26Å; V122-S129 PolarHBondContact O-N 3.32Å; A123-S129 VanDerWaalsContact O-CB 3.29Å; A123-S129 WeakPolarHBondContact O-CB 3.24Å; H125-S129 WeakPolarHBondContact O-CB 3.26Å; H125-S129 PolarHBondContact O-N 3.17Å; H125-S129 PolarHBondContact O-OG 3.03Å; I127-S129 PolarHBondContact O-N 2.97Å; S129-N131 VanDerWaalsContact C-N 3.26Å; S129-N131 PolarHBondContact O-N 2.96Å
130K94Very high94.8Very high138 Ų13837.8 Ų37.860%0.621%0.207SC*.G310 helixtrans-78.3-9.8176.8-60.3174176.81660112.9V11 S126 I127 L128 K132V11-K130 HydrophobicContact CB-CG 4.49Å; V11-K130 HydrophobicContact CG1-CB 4.49Å; V11-K130 HydrophobicContact CG1-CG 4.1Å; V11-K130 HydrophobicContact CG2-CG 4.17Å; S126-K130 WeakPolarHBondContact O-CD 3.46Å; S126-K130 WeakPolarHBondContact O-CE 3.45Å; S126-K130 PolarHBondContact O-NZ 3.42Å; I127-K130 WeakPolarHBondContact O-CB 2.98Å; I127-K130 PolarHBondContact O-N 3.14Å; L128-K130 PolarHBondContact O-N 3.23Å; L128-K130 VanDerWaalsContact O-N 3.1Å; K130-K132 PolarHBondContact O-N 3.02Å
131N94.3Very high94.5Very high18 Ų1840.5 Ų40.510%0.09623%0.23CC..  trans-68.5123.3176.4-165.4-33000110.3H61 L62 Q65 L128 S129 A133 V134H61-N131 PolarHBondContact O-ND2 3.19Å; L62-N131 HydrophobicContact CD2-CB 4.14Å; Q65-N131 PolarHBondContact NE2-ND2 3.27Å; L128-N131 VanDerWaalsContact O-CB 3.24Å; L128-N131 WeakPolarHBondContact O-CB 3.46Å; L128-N131 PolarHBondContact O-N 3.19Å; S129-N131 VanDerWaalsContact C-N 3.26Å; S129-N131 PolarHBondContact O-N 2.96Å; N131-A133 PolarHBondContact O-N 3.05Å; N131-A133 VanDerWaalsContact O-N 3.11Å; N131-A133 VanDerWaalsContact OD1-CB 3.23Å; N131-A133 WeakPolarHBondContact OD1-CB 3.39Å; N131-A133 PolarHBondContact OD1-N 2.97Å; N131-V134 HydrophobicContact CB-CG2 4Å; N131-V134 WeakPolarHBondContact O-CB 3.49Å; N131-V134 PolarHBondContact O-N 3.12Å
132K92.6Very high94.2Very high143 Ų14344.6 Ų44.662%0.62225%0.249SC*.Hα-helixtrans-59.5-26.2176.9-171.359.4-178174.10112.9K130 V134 E135 V136K130-K132 PolarHBondContact O-N 3.02Å; K132-V134 VanDerWaalsContact C-N 3.29Å; K132-V134 PolarHBondContact O-N 3.5Å; K132-E135 HydrophobicContact CD-CB 4.21Å; K132-E135 HydrophobicContact CD-CG 4.37Å; K132-E135 WeakPolarHBondContact O-CB 3.37Å; K132-E135 PolarHBondContact O-N 3.33Å; K132-V136 HydrophobicContact CG-CG2 4.41Å; K132-V136 WeakPolarHBondContact O-CG2 3.17Å; K132-V136 PolarHBondContact O-N 2.89Å
133A94.1Very high93.4Very high7 Ų748.5 Ų48.56%0.05828%0.275CS..Hα-helixtrans-62.5-33.9174.600000112.8W57 L58 H61 N131 F137W57-A133 HydrophobicContact CH2-CB 3.66Å; W57-A133 HydrophobicContact CZ2-CB 4.48Å; W57-A133 HydrophobicContact CZ3-CB 3.94Å; L58-A133 HydrophobicContact CD1-CB 4.2Å; H61-A133 HydrophobicContact CB-CB 3.5Å; H61-A133 VanDerWaalsContact CB-CB 3.5Å; N131-A133 PolarHBondContact O-N 3.05Å; N131-A133 VanDerWaalsContact O-N 3.11Å; N131-A133 VanDerWaalsContact OD1-CB 3.23Å; N131-A133 WeakPolarHBondContact OD1-CB 3.39Å; N131-A133 PolarHBondContact OD1-N 2.97Å; A133-F137 WeakPolarHBondContact O-CB 3.2Å; A133-F137 PolarHBondContact O-N 3.23Å
134V95.6Very high92.6Very high3 Ų348.5 Ų48.52%0.01827%0.274CS..Hα-helixtrans-65.9-46.4176.6177.60000110L12 L58 L62 V122 N131 K132 F137 L138L12-V134 HydrophobicContact CD1-CG1 3.94Å; L12-V134 HydrophobicContact CD2-CB 4.26Å; L12-V134 HydrophobicContact CD2-CG1 3.89Å; L58-V134 HydrophobicContact CD1-CG2 3.92Å; L62-V134 HydrophobicContact CD2-CG2 3.77Å; V122-V134 HydrophobicContact CG1-CG1 4.18Å; V122-V134 HydrophobicContact CG1-CG2 3.5Å; N131-V134 HydrophobicContact CB-CG2 4Å; N131-V134 WeakPolarHBondContact O-CB 3.49Å; N131-V134 PolarHBondContact O-N 3.12Å; K132-V134 VanDerWaalsContact C-N 3.29Å; K132-V134 PolarHBondContact O-N 3.5Å; V134-F137 PolarHBondContact O-N 3.42Å; V134-L138 HydrophobicContact CG1-CD1 3.95Å; V134-L138 WeakPolarHBondContact O-CG 3.23Å; V134-L138 PolarHBondContact O-N 2.79Å
135E94.6Very high91.4Very high24 Ų2447.3 Ų47.311%0.11227%0.269CS..Hα-helixtrans-59.2-49.3176.2-179.166.4-165.100111.4L12 S13 K132 F137 L138 T139L12-E135 VanDerWaalsContact CA-OE2 3.3Å; L12-E135 WeakPolarHBondContact CA-OE2 3.43Å; L12-E135 HydrophobicContact CD2-CB 4.05Å; L12-E135 WeakPolarHBondContact CD2-OE2 3.38Å; S13-E135 WeakPolarHBondContact CB-OE1 3.22Å; S13-E135 PolarHBondContact N-OE2 3.31Å; S13-E135 PolarHBondContact OG-OE1 3.29Å; K132-E135 HydrophobicContact CD-CB 4.21Å; K132-E135 HydrophobicContact CD-CG 4.37Å; K132-E135 WeakPolarHBondContact O-CB 3.37Å; K132-E135 PolarHBondContact O-N 3.33Å; E135-F137 VanDerWaalsContact C-N 3.33Å; E135-F137 PolarHBondContact O-N 3Å; E135-L138 PolarHBondContact O-N 3.45Å; E135-T139 WeakPolarHBondContact O-CB 3.12Å; E135-T139 WeakPolarHBondContact O-CG2 3.29Å; E135-T139 PolarHBondContact O-N 3Å; E135-T139 VanDerWaalsContact O-N 3.1Å; E135-T139 PolarHBondContact O-OG1 2.91Å
136V94.4Very high90.1Very high46 Ų4655.3 Ų55.328%0.27930%0.299SS..Hα-helixtrans-60.9-44.6177.41710000110.8R50 W57 K132 L138 T139 S140R50-V136 PolarHBondContact NH2-O 3.3Å; W57-V136 HydrophobicContact CH2-CG1 4.45Å; K132-V136 HydrophobicContact CG-CG2 4.41Å; K132-V136 WeakPolarHBondContact O-CG2 3.17Å; K132-V136 PolarHBondContact O-N 2.89Å; V136-L138 VanDerWaalsContact C-N 3.29Å; V136-L138 PolarHBondContact O-N 2.96Å; V136-T139 PolarHBondContact O-N 2.76Å; V136-S140 WeakPolarHBondContact O-CB 3.37Å; V136-S140 PolarHBondContact O-N 3.17Å
137F96Very high88.5Confident0 Ų059.3 Ų59.30%031%0.308CS..Hα-helixtrans-60.6-37.2-179.2-175-88.3000112.5I35 R50 D54 F55 W57 L58 L119 A133 V134 E135I35-F137 HydrophobicContact CD1-CD1 4.46Å; I35-F137 HydrophobicContact CD1-CE1 3.47Å; I35-F137 VanDerWaalsContact CD1-CE1 3.47Å; I35-F137 HydrophobicContact CD1-CZ 3.87Å; R50-F137 HydrophobicContact CB-CE2 4.29Å; R50-F137 HydrophobicContact CB-CZ 3.98Å; R50-F137 HydrophobicContact CG-CE1 4.07Å; R50-F137 HydrophobicContact CG-CE2 3.82Å; R50-F137 HydrophobicContact CG-CZ 3.59Å; R50-F137 VanDerWaalsContact CZ-O 3.26Å; R50-F137 PolarHBondContact NE-O 2.87Å; R50-F137 PolarHBondContact NH2-O 2.7Å; D54-F137 HydrophobicContact CB-CE2 3.9Å; D54-F137 WeakPolarHBondContact O-CE2 3.32Å; F55-F137 AromaticContact CD1-CZ 3.87Å; F55-F137 HydrophobicContact CD1-CZ 3.87Å; F55-F137 HydrophobicContact CD2-CZ 4.02Å; F55-F137 HydrophobicContact CE1-CE1 4.21Å; F55-F137 AromaticContact CE1-CZ 3.84Å; F55-F137 HydrophobicContact CE1-CZ 3.84Å; F55-F137 AromaticContact CE2-CZ 3.97Å; F55-F137 HydrophobicContact CE2-CZ 3.97Å; F55-F137 HydrophobicContact CG-CE2 4.46Å; F55-F137 AromaticContact CG-CZ 3.97Å; F55-F137 HydrophobicContact CG-CZ 3.97Å; F55-F137 HydrophobicContact CZ-CE1 4.37Å; F55-F137 AromaticContact CZ-CZ 3.89Å; F55-F137 HydrophobicContact CZ-CZ 3.89Å; W57-F137 HydrophobicContact CE3-CD2 4.41Å; W57-F137 HydrophobicContact CZ3-CB 4.33Å; W57-F137 HydrophobicContact CZ3-CD2 4.46Å; L58-F137 HydrophobicContact CB-CD2 3.93Å; L58-F137 HydrophobicContact CB-CE2 4.26Å; L58-F137 HydrophobicContact CB-CG 4.39Å; L58-F137 HydrophobicContact CD1-CB 4.24Å; L58-F137 HydrophobicContact CD2-CB 4.28Å; L58-F137 HydrophobicContact CD2-CD1 3.87Å; L58-F137 HydrophobicContact CD2-CD2 4.11Å; L58-F137 HydrophobicContact CD2-CE1 4.2Å; L58-F137 HydrophobicContact CD2-CE2 4.42Å; L58-F137 HydrophobicContact CD2-CG 3.81Å; L58-F137 HydrophobicContact CD2-CZ 4.45Å; L58-F137 HydrophobicContact CG-CG 4.48Å; L119-F137 HydrophobicContact CD1-CE1 4.08Å; L119-F137 HydrophobicContact CD2-CD1 3.87Å; L119-F137 HydrophobicContact CD2-CE1 3.41Å; L119-F137 VanDerWaalsContact CD2-CE1 3.41Å; L119-F137 HydrophobicContact CD2-CZ 4.24Å; L119-F137 HydrophobicContact CG-CE1 4.38Å; A133-F137 WeakPolarHBondContact O-CB 3.2Å; A133-F137 PolarHBondContact O-N 3.23Å; V134-F137 PolarHBondContact O-N 3.42Å; E135-F137 VanDerWaalsContact C-N 3.33Å; E135-F137 PolarHBondContact O-N 3Å
138L95.7Very high86.6Confident2 Ų267.7 Ų67.71%0.0134%0.344CS..Hα-helixtrans-88.5-19.6-176.4-65.7173.7000114.3L12 V14 V19 I35 S37 V134 E135 V136L12-L138 HydrophobicContact CD1-CD1 4.36Å; V14-L138 HydrophobicContact CG2-CB 4.47Å; V14-L138 HydrophobicContact CG2-CD1 3.89Å; V19-L138 HydrophobicContact CG1-CD2 4.03Å; V19-L138 HydrophobicContact CG2-CD1 4.24Å; V19-L138 HydrophobicContact CG2-CD2 4.24Å; I35-L138 HydrophobicContact CG2-CD2 4.27Å; S37-L138 PolarHBondContact OG-O 3.32Å; V134-L138 HydrophobicContact CG1-CD1 3.95Å; V134-L138 WeakPolarHBondContact O-CG 3.23Å; V134-L138 PolarHBondContact O-N 2.79Å; E135-L138 PolarHBondContact O-N 3.45Å; V136-L138 VanDerWaalsContact C-N 3.29Å; V136-L138 PolarHBondContact O-N 2.96Å
139T94.1Very high84.9Confident28 Ų2870 Ų7017%0.17236%0.358CS..Hα-helixtrans-122.5-23.2-167.9660000115.1V14 Y46 E135 V136V14-T139 HydrophobicContact CG1-CG2 3.86Å; Y46-T139 HydrophobicContact CD1-CG2 4.41Å; Y46-T139 HydrophobicContact CD2-CG2 3.73Å; Y46-T139 HydrophobicContact CE1-CG2 4.28Å; Y46-T139 HydrophobicContact CE2-CG2 3.51Å; Y46-T139 HydrophobicContact CG-CG2 4.15Å; E135-T139 WeakPolarHBondContact O-CB 3.12Å; E135-T139 WeakPolarHBondContact O-CG2 3.29Å; E135-T139 PolarHBondContact O-N 3Å; E135-T139 VanDerWaalsContact O-N 3.1Å; E135-T139 PolarHBondContact O-OG1 2.91Å; V136-T139 PolarHBondContact O-N 2.76Å
140S93.4Very high82.9Confident36 Ų3678.7 Ų78.725%0.25239%0.389SS..  trans-77126.6-179.6-179.60000111.2V48 R50 V136 E142V48-S140 WeakPolarHBondContact CG1-O 3.38Å; R50-S140 PolarHBondContact NH1-O 3.35Å; R50-S140 PolarHBondContact NH2-O 3.12Å; V136-S140 WeakPolarHBondContact O-CB 3.37Å; V136-S140 PolarHBondContact O-N 3.17Å; S140-E142 VanDerWaalsContact C-N 3.29Å; S140-E142 PolarHBondContact O-N 2.97Å; S140-E142 PolarHBondContact OG-N 2.96Å; S140-E142 PolarHBondContact OG-O 2.84Å
141T89.9Confident81.1Confident117 Ų11779 Ų7972%0.71839%0.386SS*.SBendtrans-66-35.4171.949.10000111.6
142E87.4Confident79.4Confident145 Ų14580.6 Ų80.668%0.67840%0.395SS*.SBendtrans-76.1137.9174.9-66-177.1-177.600110.6S140S140-E142 VanDerWaalsContact C-N 3.29Å; S140-E142 PolarHBondContact O-N 2.97Å; S140-E142 PolarHBondContact OG-N 2.96Å; S140-E142 PolarHBondContact OG-O 2.84Å
143P80.9Confident77.8Confident84 Ų8474 Ų7455%0.54537%0.367SS..PPolyproline II helixtrans-63.5147.2174.528-33.9000110G145P143-G145 PolarHBondContact O-N 2.89Å
144P79.4Confident76.1Confident10 Ų1076.9 Ų76.97%0.06538%0.378CS..PPolyproline II helixtrans-59.9136.3-179.322.1-30.1000111.6D54 W57 R146D54-P144 HydrophobicContact CB-CG 4.04Å; W57-P144 HydrophobicContact CD2-CB 3.48Å; W57-P144 VanDerWaalsContact CD2-CB 3.48Å; W57-P144 HydrophobicContact CD2-CG 3.69Å; W57-P144 VanDerWaalsContact CE2-CB 3.41Å; W57-P144 HydrophobicContact CE3-CB 3.55Å; W57-P144 HydrophobicContact CE3-CG 3.5Å; W57-P144 HydrophobicContact CG-CB 4.21Å; W57-P144 HydrophobicContact CG-CG 4.21Å; W57-P144 HydrophobicContact CH2-CB 3.62Å; W57-P144 HydrophobicContact CH2-CG 4.4Å; W57-P144 HydrophobicContact CZ2-CB 3.51Å; W57-P144 HydrophobicContact CZ3-CB 3.62Å; W57-P144 HydrophobicContact CZ3-CG 3.9Å; P144-R146 PolarHBondContact O-N 3.06Å
145G68.2Low74.1Confident55 Ų5580.6 Ų80.657%0.56740%0.398SS*.PPolyproline II helixtrans-58.1131.9178.400000111.7W57 P143 Q147W57-G145 PolarHBondContact NE1-O 3.03Å; W57-G145 VanDerWaalsContact NE1-O 3.14Å; P143-G145 PolarHBondContact O-N 2.89Å; G145-Q147 PolarHBondContact O-N 2.81Å
146R66.8Low72.3Confident191 Ų19185.4 Ų85.472%0.72142%0.415SS*.  trans-74.438-176.4-61.5-177.2179.9-173.8-3.5114.2P144 K148P144-R146 PolarHBondContact O-N 3.06Å; R146-K148 PolarHBondContact O-N 3.23Å
147Q61.1Low70.4Confident165 Ų16583.9 Ų83.977%0.77141%0.405SS*.  trans-70.8120.3170.2-72.3-174.8-16.400108.7G145 V149G145-Q147 PolarHBondContact O-N 2.81Å; Q147-V149 PolarHBondContact O-N 3.45Å; Q147-V149 VanDerWaalsContact O-N 3.08Å
148K54.9Low68.6Low198 Ų19887.3 Ų87.386%0.86143%0.429SS*.  trans-65.4110.2173.8-76.9-176177.6178.30108.7R146R146-K148 PolarHBondContact O-N 3.23Å
149V60.3Low66.7Low47 Ų4793.8 Ų93.829%0.28546%0.459SS..  trans-72.6137.5167.7179.90000108.8H61 A64 Q147 R151H61-V149 WeakPolarHBondContact CE1-CG2 3.47Å; H61-V149 WeakPolarHBondContact NE2-CG2 3.34Å; A64-V149 HydrophobicContact CB-CG1 3.46Å; A64-V149 VanDerWaalsContact CB-CG1 3.46Å; Q147-V149 PolarHBondContact O-N 3.45Å; Q147-V149 VanDerWaalsContact O-N 3.08Å; V149-R151 PolarHBondContact O-N 3.29Å
150R54.1Low65Low195 Ų19593.3 Ų93.374%0.73646%0.458SS*.  trans-64118179.1-151.3179.3-178.5173.9-0.7108.3N152R150-N152 WeakPolarHBondContact CB-OD1 3.33Å; R150-N152 VanDerWaalsContact CD-OD1 3.26Å; R150-N152 WeakPolarHBondContact CD-OD1 3.31Å; R150-N152 WeakPolarHBondContact CG-OD1 3.44Å; R150-N152 PolarHBondContact O-N 2.69Å
151R55.8Low63.3Low145 Ų14594.6 Ų94.655%0.54746%0.464SS..  trans-69.565.1178.7-70.1-175.9-179.7173.6-2.3111.7V149 N155V149-R151 PolarHBondContact O-N 3.29Å; R151-N155 WeakPolarHBondContact O-CB 3.15Å; R151-N155 PolarHBondContact O-N 2.86Å; R151-N155 PolarHBondContact O-ND2 2.85Å; R151-N155 VanDerWaalsContact O-ND2 3.1Å
152N58.8Low61.9Low52 Ų5295.2 Ų95.228%0.27846%0.459SS..Hα-helixtrans-69.5-41.2-168.5-68.5-16000113.1E66 R150 F154 N155 R156E66-N152 HydrophobicContact CG-CB 4.31Å; E66-N152 WeakPolarHBondContact OE1-CB 3.46Å; R150-N152 WeakPolarHBondContact CB-OD1 3.33Å; R150-N152 VanDerWaalsContact CD-OD1 3.26Å; R150-N152 WeakPolarHBondContact CD-OD1 3.31Å; R150-N152 WeakPolarHBondContact CG-OD1 3.44Å; R150-N152 PolarHBondContact O-N 2.69Å; N152-F154 PolarHBondContact O-N 3.47Å; N152-N155 PolarHBondContact O-N 2.87Å; N152-R156 PolarHBondContact O-N 2.76Å; N152-R156 VanDerWaalsContact O-N 3.16Å
153I59.6Low60.4Low5 Ų594.5 Ų94.53%0.02646%0.455CS..Hα-helixtrans-58.9-46.5178.3-59.8-174.3000110.6F63 E66 L157 R282F63-I153 WeakPolarHBondContact O-CB 3.34Å; F63-I153 WeakPolarHBondContact O-CD1 3.4Å; F63-I153 WeakPolarHBondContact O-CG1 3.38Å; E66-I153 HydrophobicContact CG-CG1 3.99Å; I153-L157 HydrophobicContact CG2-CD1 4.14Å; I153-L157 VanDerWaalsContact O-CD1 3.26Å; I153-L157 WeakPolarHBondContact O-CD1 3.34Å; I153-L157 PolarHBondContact O-N 2.86Å; I153-R282 HydrophobicContact CG2-CG 4.48Å
154F57.6Low59.4Low67 Ų6791.4 Ų91.429%0.29443%0.434SS..Hα-helixtrans-72.3-30.3179.4-71.2-80.8000114.7F63 N152 L157 S158 E278F63-F154 HydrophobicContact CB-CD2 4.36Å; F63-F154 HydrophobicContact CB-CE2 3.77Å; F63-F154 HydrophobicContact CD1-CE2 4.05Å; F63-F154 HydrophobicContact CD1-CZ 4.38Å; F63-F154 HydrophobicContact CD2-CD2 4.31Å; F63-F154 AromaticContact CD2-CE2 3.32Å; F63-F154 HydrophobicContact CD2-CE2 3.32Å; F63-F154 AromaticContact CD2-CZ 3.94Å; F63-F154 HydrophobicContact CD2-CZ 3.94Å; F63-F154 HydrophobicContact CE1-CE2 4.37Å; F63-F154 HydrophobicContact CE1-CZ 4.29Å; F63-F154 AromaticContact CE2-CE2 3.69Å; F63-F154 HydrophobicContact CE2-CE2 3.69Å; F63-F154 AromaticContact CE2-CZ 3.82Å; F63-F154 HydrophobicContact CE2-CZ 3.82Å; F63-F154 HydrophobicContact CG-CD2 4.49Å; F63-F154 AromaticContact CG-CE2 3.5Å; F63-F154 HydrophobicContact CG-CE2 3.5Å; F63-F154 VanDerWaalsContact CG-CE2 3.5Å; F63-F154 HydrophobicContact CG-CZ 4.2Å; F63-F154 HydrophobicContact CZ-CE2 4.22Å; F63-F154 HydrophobicContact CZ-CZ 4.01Å; N152-F154 PolarHBondContact O-N 3.47Å; F154-L157 HydrophobicContact CD1-CD1 4.36Å; F154-L157 VanDerWaalsContact O-CB 3.23Å; F154-L157 WeakPolarHBondContact O-CB 3.25Å; F154-L157 PolarHBondContact O-N 3.05Å; F154-S158 PolarHBondContact O-N 2.89Å; F154-S158 VanDerWaalsContact O-N 3.12Å; F154-E278 HydrophobicContact CE1-CG 4.36Å; F154-E278 VanDerWaalsContact CE1-OE1 3.23Å; F154-E278 WeakPolarHBondContact CE1-OE1 3.29Å
155N54.4Low58.4Low81 Ų81101.5 Ų101.543%0.43347%0.471SS..Hα-helixtrans-69.7-38.1177.8-71.2-21000111.3R151 N152 L157 S158 Q159R151-N155 WeakPolarHBondContact O-CB 3.15Å; R151-N155 PolarHBondContact O-N 2.86Å; R151-N155 PolarHBondContact O-ND2 2.85Å; R151-N155 VanDerWaalsContact O-ND2 3.1Å; N152-N155 PolarHBondContact O-N 2.87Å; N155-L157 VanDerWaalsContact C-N 3.34Å; N155-S158 PolarHBondContact O-N 3.4Å; N155-S158 PolarHBondContact O-OG 3.04Å; N155-Q159 PolarHBondContact O-N 3.43Å
156R55.2Low57.6Low124 Ų124106.6 Ų106.647%0.46848%0.477SS..Hα-helixtrans-66.3-38.5173.5-65.8-175-164.1-142.82.6111.9E66 N152 S158 Q159 A160E66-R156 IonicContact OE1-CZ 3.77Å; E66-R156 IonicContact OE1-NE 3.2Å; E66-R156 PolarHBondContact OE1-NE 2.79Å; E66-R156 IonicContact OE1-NH2 3.58Å; E66-R156 PolarHBondContact OE1-NH2 3.46Å; E66-R156 IonicContact OE2-CZ 3.48Å; E66-R156 IonicContact OE2-NE 3.85Å; E66-R156 IonicContact OE2-NH2 3.71Å; E66-R156 PolarHBondContact OE2-NH2 2.91Å; N152-R156 PolarHBondContact O-N 2.76Å; N152-R156 VanDerWaalsContact O-N 3.16Å; R156-S158 VanDerWaalsContact C-N 3.33Å; R156-S158 PolarHBondContact O-N 2.87Å; R156-Q159 PolarHBondContact O-N 3.49Å; R156-A160 WeakPolarHBondContact O-CB 3.2Å; R156-A160 PolarHBondContact O-N 3.28Å
157L56.1Low56.8Low15 Ų15104.3 Ų104.38%0.07948%0.475CS..Hα-helixtrans-53-48.4171.4-106.2125.9000112I153 F154 N155 Q159 A160 V161 E278 F281 R282I153-L157 HydrophobicContact CG2-CD1 4.14Å; I153-L157 VanDerWaalsContact O-CD1 3.26Å; I153-L157 WeakPolarHBondContact O-CD1 3.34Å; I153-L157 PolarHBondContact O-N 2.86Å; F154-L157 HydrophobicContact CD1-CD1 4.36Å; F154-L157 VanDerWaalsContact O-CB 3.23Å; F154-L157 WeakPolarHBondContact O-CB 3.25Å; F154-L157 PolarHBondContact O-N 3.05Å; N155-L157 VanDerWaalsContact C-N 3.34Å; L157-Q159 VanDerWaalsContact C-N 3.28Å; L157-Q159 PolarHBondContact O-N 3.21Å; L157-A160 CarbonylContact O-C 3.6Å; L157-A160 PolarHBondContact O-N 3.23Å; L157-V161 WeakPolarHBondContact O-CB 3.45Å; L157-V161 WeakPolarHBondContact O-CG2 3.46Å; L157-V161 PolarHBondContact O-N 2.91Å; L157-E278 WeakPolarHBondContact CD1-OE1 3.36Å; L157-E278 VanDerWaalsContact CD2-CD 3.44Å; L157-E278 WeakPolarHBondContact CD2-OE1 3.29Å; L157-E278 WeakPolarHBondContact CD2-OE2 3.45Å; L157-F281 HydrophobicContact CB-CE1 4.29Å; L157-F281 HydrophobicContact CD2-CD1 3.1Å; L157-F281 HydrophobicContact CD2-CE1 3.33Å; L157-F281 HydrophobicContact CD2-CG 4.13Å; L157-F281 HydrophobicContact CG-CD1 3.73Å; L157-F281 HydrophobicContact CG-CE1 3.7Å; L157-R282 HydrophobicContact CD1-CG 3.42Å; L157-R282 VanDerWaalsContact CD1-CG 3.42Å; L157-R282 HydrophobicContact CG-CG 4.1Å
158S56.4Low57Low72 Ų7299.3 Ų99.350%0.50347%0.467SS..Hα-helixtrans-61.1-35.6179.969.70000113.5F154 N155 R156F154-S158 PolarHBondContact O-N 2.89Å; F154-S158 VanDerWaalsContact O-N 3.12Å; N155-S158 PolarHBondContact O-N 3.4Å; N155-S158 PolarHBondContact O-OG 3.04Å; R156-S158 VanDerWaalsContact C-N 3.33Å; R156-S158 PolarHBondContact O-N 2.87Å
159Q57.4Low58Low138 Ų13892 Ų9265%0.64544%0.436SS*.Hα-helixtrans-73.5-44.1174.6-68.9178.9-18.700111.7N155 R156 L157 V161 E162 E163N155-Q159 PolarHBondContact O-N 3.43Å; R156-Q159 PolarHBondContact O-N 3.49Å; L157-Q159 VanDerWaalsContact C-N 3.28Å; L157-Q159 PolarHBondContact O-N 3.21Å; Q159-V161 VanDerWaalsContact C-N 3.3Å; Q159-V161 PolarHBondContact O-N 3.03Å; Q159-E162 PolarHBondContact O-N 2.92Å; Q159-E163 PolarHBondContact O-N 3.14Å
160A58.3Low59.1Low17 Ų1797.5 Ų97.514%0.1446%0.456CS..Hα-helixtrans-66.5-30.1177.600000112.6R156 L157 E162 E163 M164 F281 C285R156-A160 WeakPolarHBondContact O-CB 3.2Å; R156-A160 PolarHBondContact O-N 3.28Å; L157-A160 CarbonylContact O-C 3.6Å; L157-A160 PolarHBondContact O-N 3.23Å; A160-E162 VanDerWaalsContact C-N 3.34Å; A160-E163 PolarHBondContact O-N 3.06Å; A160-M164 WeakPolarHBondContact O-CB 3.27Å; A160-M164 WeakPolarHBondContact O-CG 3.44Å; A160-M164 PolarHBondContact O-N 3.47Å; A160-F281 HydrophobicContact CB-CE1 4.38Å; A160-F281 HydrophobicContact CB-CZ 4.33Å; A160-C285 HydrophobicContact CB-CB 4.13Å; A160-C285 WeakPolarHBondContact CB-SG 3.4Å
161V57.9Low60.7Low63 Ų6388.8 Ų88.838%0.38242%0.424SS..Hα-helixtrans-63.3-41.5173.2165.30000110.3L157 Q159 E163 R165 F281L157-V161 WeakPolarHBondContact O-CB 3.45Å; L157-V161 WeakPolarHBondContact O-CG2 3.46Å; L157-V161 PolarHBondContact O-N 2.91Å; Q159-V161 VanDerWaalsContact C-N 3.3Å; Q159-V161 PolarHBondContact O-N 3.03Å; V161-E163 VanDerWaalsContact C-N 3.34Å; V161-R165 WeakPolarHBondContact O-CB 3.34Å; V161-R165 PolarHBondContact O-N 3.35Å; V161-F281 HydrophobicContact CB-CZ 4.08Å; V161-F281 HydrophobicContact CG2-CE1 3.75Å; V161-F281 HydrophobicContact CG2-CE2 3.79Å; V161-F281 HydrophobicContact CG2-CZ 3.23Å
162E59.1Low62.3Low130 Ų13087.3 Ų87.361%0.60743%0.431SS*.Hα-helixtrans-70.8-31.2-179-167.7161.8-175.800112.5Q159 A160Q159-E162 PolarHBondContact O-N 2.92Å; A160-E162 VanDerWaalsContact C-N 3.34Å
163E57Low64Low131 Ų13187.1 Ų87.161%0.61243%0.43SS*.Hα-helixtrans-76.5-48172-67.2-174.2163.100112Q159 A160 V161 R165 K166Q159-E163 PolarHBondContact O-N 3.14Å; A160-E163 PolarHBondContact O-N 3.06Å; V161-E163 VanDerWaalsContact C-N 3.34Å; E163-R165 VanDerWaalsContact C-N 3.33Å; E163-R165 PolarHBondContact O-N 2.96Å; E163-K166 PolarHBondContact O-N 3.32Å; E163-K166 VanDerWaalsContact O-N 3.17Å
164M60Low65.7Low19 Ų1994.6 Ų94.69%0.09447%0.465CS..Hα-helixtrans-64.2-33.6179.2-80.5-163.473.900113.5A160 K166 E167 G168 H169 F281 I284A160-M164 WeakPolarHBondContact O-CB 3.27Å; A160-M164 WeakPolarHBondContact O-CG 3.44Å; A160-M164 PolarHBondContact O-N 3.47Å; M164-K166 PolarHBondContact O-N 3.34Å; M164-E167 PolarHBondContact O-N 2.95Å; M164-G168 PolarHBondContact O-N 3.4Å; M164-H169 HydrophobicContact CE-CB 3.96Å; M164-F281 HydrophobicContact CB-CE2 4.44Å; M164-F281 HydrophobicContact CE-CE2 4.48Å; M164-F281 HydrophobicContact CG-CE2 4.46Å; M164-F281 HydrophobicContact SD-CD2 4.06Å; M164-F281 HydrophobicContact SD-CE2 3.43Å; M164-F281 WeakPolarHBondContact SD-CE2 3.36Å; M164-F281 HydrophobicContact SD-CZ 3.86Å; M164-I284 HydrophobicContact CE-CB 3.93Å; M164-I284 HydrophobicContact CE-CD1 4.23Å; M164-I284 HydrophobicContact CE-CG2 3.23Å; M164-I284 HydrophobicContact SD-CB 4.14Å; M164-I284 HydrophobicContact SD-CG2 3.68Å
165R56.9Low67.6Low222 Ų22295 Ų9584%0.83847%0.467SS*.Hα-helixtrans-66.9-19.3178.7-168.9174.1-174.2171.52.5112.6V161 E163V161-R165 WeakPolarHBondContact O-CB 3.34Å; V161-R165 PolarHBondContact O-N 3.35Å; E163-R165 VanDerWaalsContact C-N 3.33Å; E163-R165 PolarHBondContact O-N 2.96Å
166K51.6Low69.6Low162 Ų16291.1 Ų91.170%0.70445%0.446SS*.Hα-helixtrans-82-25.8175.5-67.1174.1-174.8169.90112.6E163 M164E163-K166 PolarHBondContact O-N 3.32Å; E163-K166 VanDerWaalsContact O-N 3.17Å; M164-K166 PolarHBondContact O-N 3.34Å
167E49.7Very low71.5Confident142 Ų14287.1 Ų87.166%0.66443%0.433SS*.Hα-helixtrans-119.8-10.2-171.3-70.2-169.7-17400115.7M164 H169M164-E167 PolarHBondContact O-N 2.95Å; E167-H169 PolarHBondContact O-N 3.32Å; E167-H169 VanDerWaalsContact O-N 3.17Å; E167-H169 IonicContact OE2-CE1 2.79Å; E167-H169 PolarHBondContact OE2-CE1 3.27Å; E167-H169 VanDerWaalsContact OE2-CE1 3.29Å; E167-H169 IonicContact OE2-NE2 3.44Å; E167-H169 PolarHBondContact OE2-NE2 2.91Å
168G66.8Low73.4Confident60 Ų6090.2 Ų90.262%0.61945%0.452SS*.  trans54.937.3176.200000113.1M164 K170M164-G168 PolarHBondContact O-N 3.4Å; G168-K170 PolarHBondContact O-N 3.5Å; G168-K170 VanDerWaalsContact O-N 3.09Å
169H75.3Confident75.2Confident45 Ų4588.7 Ų88.721%0.20844%0.437CS..  trans-51.7114.9-173-82.8-80.5000111.7M164 E167 I284M164-H169 HydrophobicContact CE-CB 3.96Å; E167-H169 PolarHBondContact O-N 3.32Å; E167-H169 VanDerWaalsContact O-N 3.17Å; E167-H169 IonicContact OE2-CE1 2.79Å; E167-H169 PolarHBondContact OE2-CE1 3.27Å; E167-H169 VanDerWaalsContact OE2-CE1 3.29Å; E167-H169 IonicContact OE2-NE2 3.44Å; E167-H169 PolarHBondContact OE2-NE2 2.91Å; H169-I284 HydrophobicContact CB-CG2 4.44Å
170K83.6Confident77Confident163 Ų16385.1 Ų85.171%0.70942%0.418SS*.  trans-75.4150.4169.9-65.9-170.8175.7-171.60109.9G168G168-K170 PolarHBondContact O-N 3.5Å; G168-K170 VanDerWaalsContact O-N 3.09Å
171D87.6Confident78.6Confident12 Ų1288.4 Ų88.46%0.06443%0.433CS..  trans-72.2135.6167.3-139.5-68.8000109.7D173 F176 Q177 R283 I284D171-D173 VanDerWaalsContact C-N 3.31Å; D171-D173 PolarHBondContact OD1-N 3.16Å; D171-F176 HydrophobicContact CB-CB 4.35Å; D171-Q177 HydrophobicContact CB-CB 3.91Å; D171-R283 VanDerWaalsContact CG-NH1 3.26Å; D171-R283 IonicContact OD1-CZ 3Å; D171-R283 IonicContact OD1-NH1 2.97Å; D171-R283 PolarHBondContact OD1-NH1 2.69Å; D171-R283 IonicContact OD1-NH2 3.87Å; D171-R283 PolarHBondContact OD1-NH2 3.43Å; D171-R283 IonicContact OD2-CZ 3.67Å; D171-R283 IonicContact OD2-NH1 3.05Å; D171-R283 PolarHBondContact OD2-NH1 3.46Å; D171-I284 HydrophobicContact CB-CD1 4.42Å
172V88.6Confident80.3Confident113 Ų11390.4 Ų90.469%0.68544%0.438SS*.SBendtrans-79.8-19174.1-61.90000111.8L287V172-L287 HydrophobicContact CG2-CD1 4.25Å; V172-L287 HydrophobicContact CG2-CD2 4.18Å
173D94.4Very high82Confident49 Ų4984.4 Ų84.426%0.26241%0.41SS..SBendtrans-89116.8173.2-176.5-43.1000109.2D171 F175 F176 Q177 K327D171-D173 VanDerWaalsContact C-N 3.31Å; D171-D173 PolarHBondContact OD1-N 3.16Å; D173-F175 VanDerWaalsContact C-N 3.27Å; D173-F175 PolarHBondContact O-N 3.17Å; D173-F175 VanDerWaalsContact OD1-CB 3.3Å; D173-F175 WeakPolarHBondContact OD1-CB 3.41Å; D173-F175 PolarHBondContact OD1-N 2.7Å; D173-F176 HydrophobicContact CB-CD2 3.85Å; D173-F176 VanDerWaalsContact CG-CD2 3.49Å; D173-F176 PolarHBondContact O-N 3.18Å; D173-Q177 PolarHBondContact O-N 2.9Å; D173-K327 IonicContact OD2-NZ 3.22Å; D173-K327 PolarHBondContact OD2-NZ 3.36Å
174E95.6Very high83.6Confident162 Ų16283.3 Ų83.376%0.75741%0.408SS*.Hα-helixtrans-57.9-36.6-175.6-174.7177.5-172.700113.1Q177 T178E174-Q177 PolarHBondContact O-N 3.16Å; E174-T178 WeakPolarHBondContact O-CB 3.34Å; E174-T178 PolarHBondContact O-N 2.98Å; E174-T178 PolarHBondContact O-OG1 2.88Å
175F97.2Very high85.2Confident75 Ų7586.3 Ų86.333%0.32943%0.427SS..Hα-helixtrans-61.6-51.5177.7167.8-91.2000110.1D173 Q177 T178 E179 K327 I330D173-F175 VanDerWaalsContact C-N 3.27Å; D173-F175 PolarHBondContact O-N 3.17Å; D173-F175 VanDerWaalsContact OD1-CB 3.3Å; D173-F175 WeakPolarHBondContact OD1-CB 3.41Å; D173-F175 PolarHBondContact OD1-N 2.7Å; F175-Q177 VanDerWaalsContact C-N 3.35Å; F175-Q177 PolarHBondContact O-N 3.26Å; F175-T178 PolarHBondContact O-N 3.32Å; F175-E179 HydrophobicContact CD1-CG 4.42Å; F175-E179 HydrophobicContact CD2-CG 4.47Å; F175-E179 HydrophobicContact CE1-CG 3.96Å; F175-E179 HydrophobicContact CE2-CG 4.03Å; F175-E179 HydrophobicContact CZ-CG 3.75Å; F175-E179 WeakPolarHBondContact O-CG 3.44Å; F175-E179 PolarHBondContact O-N 3.49Å; F175-K327 HydrophobicContact CD1-CD 4.44Å; F175-K327 HydrophobicContact CD1-CG 4.08Å; F175-K327 HydrophobicContact CE1-CD 4.44Å; F175-K327 HydrophobicContact CE1-CG 3.64Å; F175-K327 HydrophobicContact CZ-CG 4.23Å; F175-I330 HydrophobicContact CE1-CD1 3.92Å; F175-I330 HydrophobicContact CZ-CD1 4.21Å; F175-I330 HydrophobicContact CZ-CG2 4.23Å
176F96.6Very high86.9Confident0 Ų077.1 Ų77.10%039%0.394CS..Hα-helixtrans-70.9-31.4-177.7-70.1-76.1000113D171 D173 T178 R180 L280 R283 C323 A326 K327 I330D171-F176 HydrophobicContact CB-CB 4.35Å; D173-F176 HydrophobicContact CB-CD2 3.85Å; D173-F176 VanDerWaalsContact CG-CD2 3.49Å; D173-F176 PolarHBondContact O-N 3.18Å; F176-T178 VanDerWaalsContact C-N 3.35Å; F176-R180 WeakPolarHBondContact O-CB 3.34Å; F176-R180 VanDerWaalsContact O-CG 3.28Å; F176-R180 WeakPolarHBondContact O-CG 3.39Å; F176-R180 PolarHBondContact O-N 3.33Å; F176-L280 HydrophobicContact CD1-CD2 3.96Å; F176-R283 VanDerWaalsContact CE2-NH2 3.28Å; F176-R283 VanDerWaalsContact CG-NH1 3.34Å; F176-C323 HydrophobicContact CE2-CB 4.09Å; F176-C323 HydrophobicContact CZ-CB 4.06Å; F176-A326 HydrophobicContact CE1-CB 3.72Å; F176-A326 HydrophobicContact CZ-CB 4.1Å; F176-K327 HydrophobicContact CE1-CG 4.32Å; F176-K327 HydrophobicContact CE2-CD 4.42Å; F176-K327 VanDerWaalsContact CE2-CE 3.41Å; F176-K327 HydrophobicContact CE2-CG 4.31Å; F176-K327 HydrophobicContact CZ-CD 4.28Å; F176-K327 HydrophobicContact CZ-CG 3.72Å; F176-I330 HydrophobicContact CD1-CD1 4.35Å; F176-I330 HydrophobicContact CE1-CD1 4.16Å
177Q94.8Very high88.7Confident39 Ų3969.6 Ų69.618%0.18236%0.362CS..Hα-helixtrans-63.6-44.2172.3-175.454.14900110.9D171 D173 E174 F175 R180 D181D171-Q177 HydrophobicContact CB-CB 3.91Å; D173-Q177 PolarHBondContact O-N 2.9Å; E174-Q177 PolarHBondContact O-N 3.16Å; F175-Q177 VanDerWaalsContact C-N 3.35Å; F175-Q177 PolarHBondContact O-N 3.26Å; Q177-R180 PolarHBondContact O-N 2.93Å; Q177-D181 VanDerWaalsContact NE2-CG 3.31Å; Q177-D181 PolarHBondContact NE2-OD1 3.13Å; Q177-D181 PolarHBondContact NE2-OD2 3.27Å; Q177-D181 PolarHBondContact O-N 2.89Å
178T95.9Very high90.6Very high80 Ų8064.4 Ų64.449%0.49135%0.347SS..Hα-helixtrans-64.1-45.2177.7-63.50000111.5E174 F175 F176 R180 D181 H182E174-T178 WeakPolarHBondContact O-CB 3.34Å; E174-T178 PolarHBondContact O-N 2.98Å; E174-T178 PolarHBondContact O-OG1 2.88Å; F175-T178 PolarHBondContact O-N 3.32Å; F176-T178 VanDerWaalsContact C-N 3.35Å; T178-R180 VanDerWaalsContact C-N 3.31Å; T178-R180 PolarHBondContact O-N 3.33Å; T178-D181 PolarHBondContact O-N 3.26Å; T178-H182 WeakPolarHBondContact O-CB 3.44Å; T178-H182 PolarHBondContact O-N 2.93Å
179E95.8Very high91.8Very high40 Ų4067 Ų6719%0.18734%0.343CS..Hα-helixtrans-62.5-37.4176.8-69.4-57.1155.500112.2F175 H182 N183 I330F175-E179 HydrophobicContact CD1-CG 4.42Å; F175-E179 HydrophobicContact CD2-CG 4.47Å; F175-E179 HydrophobicContact CE1-CG 3.96Å; F175-E179 HydrophobicContact CE2-CG 4.03Å; F175-E179 HydrophobicContact CZ-CG 3.75Å; F175-E179 WeakPolarHBondContact O-CG 3.44Å; F175-E179 PolarHBondContact O-N 3.49Å; E179-H182 PolarHBondContact O-N 3.12Å; E179-N183 WeakPolarHBondContact O-CB 3.49Å; E179-N183 PolarHBondContact O-N 2.7Å; E179-I330 HydrophobicContact CB-CD1 4.47Å; E179-I330 HydrophobicContact CG-CD1 4.28Å; E179-I330 HydrophobicContact CG-CG2 4.23Å
180R93.6Very high92.5Very high63 Ų6365.2 Ų65.224%0.23834%0.335CS..Hα-helixtrans-63.7-45.3174.2-78.1175.863.2101.3-0.1112.9F176 Q177 T178 H182 L184 L280F176-R180 WeakPolarHBondContact O-CB 3.34Å; F176-R180 VanDerWaalsContact O-CG 3.28Å; F176-R180 WeakPolarHBondContact O-CG 3.39Å; F176-R180 PolarHBondContact O-N 3.33Å; Q177-R180 PolarHBondContact O-N 2.93Å; T178-R180 VanDerWaalsContact C-N 3.31Å; T178-R180 PolarHBondContact O-N 3.33Å; R180-H182 VanDerWaalsContact C-N 3.33Å; R180-L184 WeakPolarHBondContact O-CB 3.47Å; R180-L184 PolarHBondContact O-N 2.98Å; R180-L280 HydrophobicContact CG-CB 3.86Å; R180-L280 HydrophobicContact CG-CD1 3.8Å; R180-L280 HydrophobicContact CG-CD2 4.2Å; R180-L280 HydrophobicContact CG-CG 4.17Å; R180-L280 PolarHBondContact NH1-O 2.97Å
181D93.1Very high92.8Very high86 Ų8662.8 Ų62.846%0.4632%0.321SS..Hα-helixtrans-66.6-39.9-179.7-67.4-25.9000110.5Q177 T178 V185Q177-D181 VanDerWaalsContact NE2-CG 3.31Å; Q177-D181 PolarHBondContact NE2-OD1 3.13Å; Q177-D181 PolarHBondContact NE2-OD2 3.27Å; Q177-D181 PolarHBondContact O-N 2.89Å; T178-D181 PolarHBondContact O-N 3.26Å; D181-V185 WeakPolarHBondContact O-CG2 3.41Å; D181-V185 PolarHBondContact O-N 3.04Å
182H94.2Very high93Very high105 Ų10567.2 Ų67.249%0.48634%0.343SS..Hα-helixtrans-65.5-51.6174.6-178.3-156.1000112.3T178 E179 R180 L184 V185 L186T178-H182 WeakPolarHBondContact O-CB 3.44Å; T178-H182 PolarHBondContact O-N 2.93Å; E179-H182 PolarHBondContact O-N 3.12Å; R180-H182 VanDerWaalsContact C-N 3.33Å; H182-L184 VanDerWaalsContact C-N 3.28Å; H182-L184 PolarHBondContact O-N 3.47Å; H182-V185 PolarHBondContact O-N 3.17Å; H182-V185 VanDerWaalsContact O-N 3.16Å; H182-L186 WeakPolarHBondContact O-CB 3.38Å; H182-L186 PolarHBondContact O-N 2.91Å
183N94.3Very high93.2Very high4 Ų464 Ų642%0.02133%0.329CS..Hα-helixtrans-59.6-37.3179.3173.4-84.6000111.7E179 V185 L186 T187 Q273 E276 K277 L280E179-N183 WeakPolarHBondContact O-CB 3.49Å; E179-N183 PolarHBondContact O-N 2.7Å; N183-V185 VanDerWaalsContact C-N 3.35Å; N183-V185 PolarHBondContact O-N 3.41Å; N183-L186 PolarHBondContact O-N 3.2Å; N183-T187 WeakPolarHBondContact O-CB 3.17Å; N183-T187 PolarHBondContact O-N 3.27Å; N183-T187 PolarHBondContact O-OG1 2.91Å; N183-T187 PolarHBondContact OD1-OG1 2.86Å; N183-Q273 PolarHBondContact ND2-O 3.41Å; N183-Q273 PolarHBondContact ND2-OE1 3.19Å; N183-E276 PolarHBondContact ND2-OE2 2.96Å; N183-K277 WeakPolarHBondContact OD1-CB 3.5Å; N183-L280 HydrophobicContact CB-CD1 4.18Å
184L90.5Very high92.9Very high109 Ų10962.8 Ų62.857%0.57133%0.327SS*.Hα-helixtrans-58.6-46.2176.1177.763.3000111.9R180 H182 G188R180-L184 WeakPolarHBondContact O-CB 3.47Å; R180-L184 PolarHBondContact O-N 2.98Å; H182-L184 VanDerWaalsContact C-N 3.28Å; H182-L184 PolarHBondContact O-N 3.47Å; L184-G188 PolarHBondContact O-N 2.83Å
185V93.5Very high92.6Very high81 Ų8160.2 Ų60.249%0.49132%0.315SS..Hα-helixtrans-68.9-46.8178.3174.90000110.4D181 H182 N183 T187 G188 H189D181-V185 WeakPolarHBondContact O-CG2 3.41Å; D181-V185 PolarHBondContact O-N 3.04Å; H182-V185 PolarHBondContact O-N 3.17Å; H182-V185 VanDerWaalsContact O-N 3.16Å; N183-V185 VanDerWaalsContact C-N 3.35Å; N183-V185 PolarHBondContact O-N 3.41Å; V185-T187 PolarHBondContact O-N 2.82Å; V185-G188 PolarHBondContact O-N 3.27Å; V185-G188 VanDerWaalsContact O-N 3.13Å; V185-H189 WeakPolarHBondContact CG1-NE2 3.01Å; V185-H189 PolarHBondContact O-CD2 3.29Å; V185-H189 PolarHBondContact O-N 2.65Å; V185-H189 VanDerWaalsContact O-N 3.08Å
186L91.8Very high92.4Very high29 Ų2962.4 Ų62.415%0.15232%0.324CS..Hα-helixtrans-64.7-40.1-177.1-173.656.9000112.5H182 N183 G188 H189 T190 Q273H182-L186 WeakPolarHBondContact O-CB 3.38Å; H182-L186 PolarHBondContact O-N 2.91Å; N183-L186 PolarHBondContact O-N 3.2Å; L186-G188 VanDerWaalsContact C-N 3.27Å; L186-G188 PolarHBondContact O-N 3.4Å; L186-H189 PolarHBondContact O-N 2.87Å; L186-T190 HydrophobicContact CD1-CG2 4.02Å; L186-T190 HydrophobicContact CG-CG2 4.23Å; L186-T190 WeakPolarHBondContact O-CB 3.42Å; L186-T190 WeakPolarHBondContact O-CG2 3.27Å; L186-T190 PolarHBondContact O-N 3.28Å; L186-T190 PolarHBondContact O-OG1 2.9Å; L186-Q273 VanDerWaalsContact CD2-OE1 3.23Å; L186-Q273 HydrophobicContact CG-CG 4.41Å
187T90.4Very high92.2Very high4 Ų463.5 Ų63.53%0.02533%0.329CS..Hα-helixtrans-56.8-42.3172.7-62.80000111.2N183 V185 T190 R191 E274N183-T187 WeakPolarHBondContact O-CB 3.17Å; N183-T187 PolarHBondContact O-N 3.27Å; N183-T187 PolarHBondContact O-OG1 2.91Å; N183-T187 PolarHBondContact OD1-OG1 2.86Å; V185-T187 PolarHBondContact O-N 2.82Å; T187-T190 WeakPolarHBondContact CA-OG1 3.29Å; T187-T190 PolarHBondContact O-OG1 3.14Å; T187-T190 VanDerWaalsContact O-OG1 3.1Å; T187-R191 VanDerWaalsContact O-CB 3.29Å; T187-R191 WeakPolarHBondContact O-CB 3.23Å; T187-R191 PolarHBondContact O-N 2.74Å; T187-R191 VanDerWaalsContact O-N 3.12Å; T187-E274 HydrophobicContact CG2-CG 4.46Å; T187-E274 WeakPolarHBondContact CG2-OE1 3.47Å
188G89.4Confident91.9Very high34 Ų3463.9 Ų63.935%0.35133%0.332SS..Hα-helixtrans-64.3-45.317700000112.6L184 V185 L186 M192L184-G188 PolarHBondContact O-N 2.83Å; V185-G188 PolarHBondContact O-N 3.27Å; V185-G188 VanDerWaalsContact O-N 3.13Å; L186-G188 VanDerWaalsContact C-N 3.27Å; L186-G188 PolarHBondContact O-N 3.4Å; G188-M192 WeakPolarHBondContact O-CB 3.44Å; G188-M192 PolarHBondContact O-N 3.35Å; G188-M192 VanDerWaalsContact O-N 3.11Å
189H92.8Very high91.5Very high114 Ų11463.6 Ų63.653%0.52833%0.328SS..Hα-helixtrans-67.3-45.5179.2-69.4-44.7000113.1V185 L186 M192 A193V185-H189 WeakPolarHBondContact CG1-NE2 3.01Å; V185-H189 PolarHBondContact O-CD2 3.29Å; V185-H189 PolarHBondContact O-N 2.65Å; V185-H189 VanDerWaalsContact O-N 3.08Å; L186-H189 PolarHBondContact O-N 2.87Å; H189-M192 PolarHBondContact O-N 3.39Å; H189-A193 WeakPolarHBondContact O-CB 3.24Å; H189-A193 PolarHBondContact O-N 2.83Å
190T89.9Confident91.3Very high7 Ų765.1 Ų65.14%0.04334%0.339CS..Hα-helixtrans-63.5-43.9-179.849.70000111.6L186 T187 M192 A193 G194 D269 Q273L186-T190 HydrophobicContact CD1-CG2 4.02Å; L186-T190 HydrophobicContact CG-CG2 4.23Å; L186-T190 WeakPolarHBondContact O-CB 3.42Å; L186-T190 WeakPolarHBondContact O-CG2 3.27Å; L186-T190 PolarHBondContact O-N 3.28Å; L186-T190 PolarHBondContact O-OG1 2.9Å; T187-T190 WeakPolarHBondContact CA-OG1 3.29Å; T187-T190 PolarHBondContact O-OG1 3.14Å; T187-T190 VanDerWaalsContact O-OG1 3.1Å; T190-M192 PolarHBondContact O-N 3.49Å; T190-A193 PolarHBondContact O-N 3.1Å; T190-G194 PolarHBondContact O-N 3.16Å; T190-D269 WeakPolarHBondContact CG2-OD2 3.27Å; T190-Q273 HydrophobicContact CG2-CG 4.02Å
191R88.4Confident91Very high113 Ų11362.1 Ų62.143%0.42633%0.328SS..Hα-helixtrans-59.3-48.8174.1-172.1-173-58.2167.60.1111.8T187 A193 G194 E195 E274T187-R191 VanDerWaalsContact O-CB 3.29Å; T187-R191 WeakPolarHBondContact O-CB 3.23Å; T187-R191 PolarHBondContact O-N 2.74Å; T187-R191 VanDerWaalsContact O-N 3.12Å; R191-A193 VanDerWaalsContact C-N 3.33Å; R191-A193 PolarHBondContact O-N 2.94Å; R191-G194 PolarHBondContact O-N 2.85Å; R191-E195 WeakPolarHBondContact O-CG 2.98Å; R191-E195 PolarHBondContact O-N 3.49Å; R191-E274 IonicContact CZ-OE1 3.77Å; R191-E274 IonicContact NH2-OE1 3.88Å; R191-E274 PolarHBondContact NH2-OE1 2.98Å
192M92.3Very high90.5Very high104 Ų10459 Ų5951%0.51231%0.312SS..Hα-helixtrans-62.6-39.9-179.9-171.1-174.7-44.400112G188 H189 T190 E195 K196G188-M192 WeakPolarHBondContact O-CB 3.44Å; G188-M192 PolarHBondContact O-N 3.35Å; G188-M192 VanDerWaalsContact O-N 3.11Å; H189-M192 PolarHBondContact O-N 3.39Å; T190-M192 PolarHBondContact O-N 3.49Å; M192-E195 PolarHBondContact O-N 3.45Å; M192-K196 HydrophobicContact CG-CG 4.44Å; M192-K196 WeakPolarHBondContact O-CB 3.48Å; M192-K196 VanDerWaalsContact O-CG 3.23Å; M192-K196 WeakPolarHBondContact O-CG 3.38Å; M192-K196 PolarHBondContact O-N 2.98Å
193A92.4Very high90.3Very high47 Ų4757.4 Ų57.439%0.38831%0.309SS..Hα-helixtrans-62.1-45.3175.200000111.4H189 T190 R191 K196 F197 L266H189-A193 WeakPolarHBondContact O-CB 3.24Å; H189-A193 PolarHBondContact O-N 2.83Å; T190-A193 PolarHBondContact O-N 3.1Å; R191-A193 VanDerWaalsContact C-N 3.33Å; R191-A193 PolarHBondContact O-N 2.94Å; A193-K196 PolarHBondContact O-N 3.33Å; A193-F197 VanDerWaalsContact O-CB 3.29Å; A193-F197 WeakPolarHBondContact O-CB 3.46Å; A193-F197 PolarHBondContact O-N 3.3Å; A193-L266 HydrophobicContact CB-CD2 4.43Å
194G88.8Confident90.1Very high22 Ų2258.6 Ų58.623%0.22732%0.315CS..Hα-helixtrans-59.7-46.5174.900000112.9T190 R191 F197 L198T190-G194 PolarHBondContact O-N 3.16Å; R191-G194 PolarHBondContact O-N 2.85Å; G194-F197 PolarHBondContact O-N 2.93Å; G194-L198 WeakPolarHBondContact O-CB 3.43Å; G194-L198 PolarHBondContact O-N 3.48Å
195E88.7Confident89.8Confident108 Ų10854.3 Ų54.351%0.50529%0.292SS..Hα-helixtrans-60.9-46176.6-72.8173.1-177.300112.1R191 M192 L198 D199R191-E195 WeakPolarHBondContact O-CG 2.98Å; R191-E195 PolarHBondContact O-N 3.49Å; M192-E195 PolarHBondContact O-N 3.45Å; E195-L198 PolarHBondContact O-N 3.42Å; E195-D199 PolarHBondContact O-N 3Å
196K94.1Very high89.5Confident122 Ų12256 Ų5653%0.5329%0.293SS..Hα-helixtrans-67.9-36.7179.7-70.6-71145.8-138.20112.4M192 A193 L198 D199 V200M192-K196 HydrophobicContact CG-CG 4.44Å; M192-K196 WeakPolarHBondContact O-CB 3.48Å; M192-K196 VanDerWaalsContact O-CG 3.23Å; M192-K196 WeakPolarHBondContact O-CG 3.38Å; M192-K196 PolarHBondContact O-N 2.98Å; A193-K196 PolarHBondContact O-N 3.33Å; K196-L198 VanDerWaalsContact C-N 3.35Å; K196-D199 IonicContact NZ-OD2 2.82Å; K196-D199 PolarHBondContact NZ-OD2 3Å; K196-D199 WeakPolarHBondContact O-CB 3.32Å; K196-D199 PolarHBondContact O-N 3.33Å; K196-V200 PolarHBondContact O-N 3.48Å
197F92.5Very high89.5Confident22 Ų2258.5 Ų58.510%0.09631%0.305CS..Hα-helixtrans-66-41.3174.5-172.4-100.2000111.2A193 G194 D199 V200 V201 D258 L262 L266 W348A193-F197 VanDerWaalsContact O-CB 3.29Å; A193-F197 WeakPolarHBondContact O-CB 3.46Å; A193-F197 PolarHBondContact O-N 3.3Å; G194-F197 PolarHBondContact O-N 2.93Å; F197-D199 VanDerWaalsContact C-N 3.32Å; F197-D199 PolarHBondContact O-N 3.01Å; F197-V200 WeakPolarHBondContact O-CB 3.35Å; F197-V200 PolarHBondContact O-N 3.38Å; F197-V200 VanDerWaalsContact O-N 3.1Å; F197-V201 HydrophobicContact CD1-CG2 4.28Å; F197-V201 HydrophobicContact CE1-CG2 3.93Å; F197-V201 HydrophobicContact CZ-CG2 4.43Å; F197-V201 PolarHBondContact O-N 3.03Å; F197-V201 VanDerWaalsContact O-N 3.13Å; F197-D258 HydrophobicContact CE1-CB 4.1Å; F197-D258 WeakPolarHBondContact CE1-O 3.21Å; F197-D258 HydrophobicContact CZ-CB 3.7Å; F197-L262 HydrophobicContact CD2-CD2 3.9Å; F197-L262 HydrophobicContact CD2-CG 4.39Å; F197-L262 HydrophobicContact CE1-CB 4.19Å; F197-L262 HydrophobicContact CE2-CB 4.19Å; F197-L262 HydrophobicContact CE2-CD2 3.64Å; F197-L262 HydrophobicContact CE2-CG 4.15Å; F197-L262 HydrophobicContact CZ-CB 3.81Å; F197-L262 HydrophobicContact CZ-CD2 4.15Å; F197-L262 HydrophobicContact CZ-CG 4.2Å; F197-L266 HydrophobicContact CB-CD1 3.72Å; F197-L266 HydrophobicContact CD1-CD1 4.28Å; F197-L266 HydrophobicContact CG-CD1 3.93Å; F197-W348 AromaticContact CE2-CE2 3.88Å; F197-W348 AromaticContact CE2-CZ2 3.97Å; F197-W348 HydrophobicContact CE2-CZ2 3.97Å; F197-W348 AromaticContact CE2-NE1 3.92Å; F197-W348 AromaticContact CZ-NE1 3.86Å
198L87.4Confident89.4Confident47 Ų4758.3 Ų58.325%0.24630%0.304CS..Hα-helixtrans-61.5-40.1173.8-175.363.3000111.8L95 G194 E195 K196 V200 V201 L202 M259L95-L198 HydrophobicContact CD2-CD2 3.83Å; G194-L198 WeakPolarHBondContact O-CB 3.43Å; G194-L198 PolarHBondContact O-N 3.48Å; E195-L198 PolarHBondContact O-N 3.42Å; K196-L198 VanDerWaalsContact C-N 3.35Å; L198-V200 PolarHBondContact O-N 3.33Å; L198-V201 PolarHBondContact O-N 3.37Å; L198-L202 HydrophobicContact CD1-CG 4.37Å; L198-L202 HydrophobicContact CG-CD1 4.28Å; L198-L202 HydrophobicContact CG-CG 4.29Å; L198-L202 WeakPolarHBondContact O-CB 3.42Å; L198-L202 VanDerWaalsContact O-CG 3.23Å; L198-L202 WeakPolarHBondContact O-CG 3.41Å; L198-L202 PolarHBondContact O-N 3.26Å; L198-M259 HydrophobicContact CD1-CE 4.24Å; L198-M259 HydrophobicContact CD1-SD 3.84Å
199D87.9Confident89.3Confident75 Ų7558.8 Ų58.840%0.40130%0.3SS..Hα-helixtrans-55.7-37.7173.8-74.7-27.1000112.3E195 K196 F197 T203E195-D199 PolarHBondContact O-N 3Å; K196-D199 IonicContact NZ-OD2 2.82Å; K196-D199 PolarHBondContact NZ-OD2 3Å; K196-D199 WeakPolarHBondContact O-CB 3.32Å; K196-D199 PolarHBondContact O-N 3.33Å; F197-D199 VanDerWaalsContact C-N 3.32Å; F197-D199 PolarHBondContact O-N 3.01Å; D199-T203 WeakPolarHBondContact O-CB 3.4Å; D199-T203 PolarHBondContact O-N 3.26Å; D199-T203 VanDerWaalsContact O-N 3.09Å; D199-T203 PolarHBondContact O-OG1 2.97Å
200V91.9Very high89.4Confident71 Ų7156 Ų5643%0.4330%0.297SS..Hα-helixtrans-65.1-54175.9174.50000110.5K196 F197 L198 L202 T203 E204K196-V200 PolarHBondContact O-N 3.48Å; F197-V200 WeakPolarHBondContact O-CB 3.35Å; F197-V200 PolarHBondContact O-N 3.38Å; F197-V200 VanDerWaalsContact O-N 3.1Å; L198-V200 PolarHBondContact O-N 3.33Å; V200-L202 VanDerWaalsContact C-N 3.27Å; V200-L202 PolarHBondContact O-N 3.45Å; V200-T203 WeakPolarHBondContact O-CA 3.49Å; V200-T203 VanDerWaalsContact O-CB 3.29Å; V200-T203 WeakPolarHBondContact O-CB 3.3Å; V200-T203 PolarHBondContact O-N 3Å; V200-E204 PolarHBondContact O-N 2.87Å
201V86.6Confident89.6Confident1 Ų156.2 Ų56.21%0.00630%0.298CS..Hα-helixtrans-54.3-45.5177.8173.50000111.2F197 L198 T203 E204 Q205 A255 D258 M259F197-V201 HydrophobicContact CD1-CG2 4.28Å; F197-V201 HydrophobicContact CE1-CG2 3.93Å; F197-V201 HydrophobicContact CZ-CG2 4.43Å; F197-V201 PolarHBondContact O-N 3.03Å; F197-V201 VanDerWaalsContact O-N 3.13Å; L198-V201 PolarHBondContact O-N 3.37Å; V201-T203 PolarHBondContact O-N 3.48Å; V201-E204 WeakPolarHBondContact O-CB 3.4Å; V201-E204 PolarHBondContact O-N 2.89Å; V201-Q205 WeakPolarHBondContact O-CG 3.31Å; V201-Q205 PolarHBondContact O-N 2.98Å; V201-A255 HydrophobicContact CG1-CB 4.04Å; V201-D258 HydrophobicContact CG2-CB 3.79Å; V201-M259 HydrophobicContact CB-CG 4.45Å; V201-M259 HydrophobicContact CB-SD 4.25Å; V201-M259 HydrophobicContact CG1-CG 3.56Å; V201-M259 HydrophobicContact CG1-SD 3.83Å; V201-M259 HydrophobicContact CG2-CG 4.22Å; V201-M259 HydrophobicContact CG2-SD 4.03Å
202L83.9Confident89.7Confident21 Ų2151.4 Ų51.411%0.1128%0.284CS..Hα-helixtrans-63.4-30.9178.5-69.4-175.3000112.2G96 L198 V200 K206G96-L202 VanDerWaalsContact CA-CD2 3.42Å; G96-L202 WeakPolarHBondContact O-CD2 3.2Å; L198-L202 HydrophobicContact CD1-CG 4.37Å; L198-L202 HydrophobicContact CG-CD1 4.28Å; L198-L202 HydrophobicContact CG-CG 4.29Å; L198-L202 WeakPolarHBondContact O-CB 3.42Å; L198-L202 VanDerWaalsContact O-CG 3.23Å; L198-L202 WeakPolarHBondContact O-CG 3.41Å; L198-L202 PolarHBondContact O-N 3.26Å; V200-L202 VanDerWaalsContact C-N 3.27Å; V200-L202 PolarHBondContact O-N 3.45Å; L202-K206 VanDerWaalsContact O-CG 3.23Å; L202-K206 WeakPolarHBondContact O-CG 3.24Å; L202-K206 PolarHBondContact O-N 3.48Å; L202-K206 VanDerWaalsContact O-N 3.09Å
203T90Very high89.8Confident71 Ų7152.8 Ų52.844%0.43629%0.289SS..Hα-helixtrans-72.1-43176.4-60.20000111.1D199 V200 V201 Q205 K206 I207D199-T203 WeakPolarHBondContact O-CB 3.4Å; D199-T203 PolarHBondContact O-N 3.26Å; D199-T203 VanDerWaalsContact O-N 3.09Å; D199-T203 PolarHBondContact O-OG1 2.97Å; V200-T203 WeakPolarHBondContact O-CA 3.49Å; V200-T203 VanDerWaalsContact O-CB 3.29Å; V200-T203 WeakPolarHBondContact O-CB 3.3Å; V200-T203 PolarHBondContact O-N 3Å; V201-T203 PolarHBondContact O-N 3.48Å; T203-Q205 VanDerWaalsContact C-N 3.33Å; T203-Q205 PolarHBondContact O-N 3.44Å; T203-K206 WeakPolarHBondContact O-CB 3.46Å; T203-K206 PolarHBondContact O-N 3.42Å; T203-K206 VanDerWaalsContact O-N 3.09Å; T203-I207 HydrophobicContact CG2-CD1 4.33Å; T203-I207 WeakPolarHBondContact O-CG1 3.33Å; T203-I207 PolarHBondContact O-N 3.36Å
204E88.6Confident90Very high28 Ų2855 Ų5513%0.13129%0.29CS..Hα-helixtrans-57.9-44.9174.2-64.8169.4161.900111.6V200 V201 K206 I207 A208 V254 A255V200-E204 PolarHBondContact O-N 2.87Å; V201-E204 WeakPolarHBondContact O-CB 3.4Å; V201-E204 PolarHBondContact O-N 2.89Å; E204-K206 VanDerWaalsContact C-N 3.34Å; E204-K206 PolarHBondContact O-N 3.46Å; E204-I207 WeakPolarHBondContact O-CB 3.37Å; E204-I207 PolarHBondContact O-N 2.91Å; E204-A208 PolarHBondContact O-N 3.1Å; E204-V254 WeakPolarHBondContact OE1-CG1 3.32Å; E204-A255 HydrophobicContact CB-CB 4.15Å; E204-A255 WeakPolarHBondContact OE2-CA 3.44Å
205Q84.4Confident90.3Very high19 Ų1954.1 Ų54.19%0.08928%0.28CS..Hα-helixtrans-63.3-37.9174.6-68175.3-11.100112.8G96 K97 V201 T203 I207 A208 V209 A255G96-Q205 PolarHBondContact O-OE1 2.94Å; K97-Q205 PolarHBondContact O-NE2 3.49Å; K97-Q205 PolarHBondContact O-OE1 3.29Å; V201-Q205 WeakPolarHBondContact O-CG 3.31Å; V201-Q205 PolarHBondContact O-N 2.98Å; T203-Q205 VanDerWaalsContact C-N 3.33Å; T203-Q205 PolarHBondContact O-N 3.44Å; Q205-I207 VanDerWaalsContact C-N 3.33Å; Q205-A208 PolarHBondContact O-N 2.66Å; Q205-V209 WeakPolarHBondContact O-CG2 3.4Å; Q205-V209 PolarHBondContact O-N 2.86Å; Q205-A255 HydrophobicContact CG-CB 3.69Å
206K86.9Confident90.6Very high118 Ų11851.7 Ų51.751%0.51328%0.279SS..Hα-helixtrans-63.3-42.2175.1-75.6166-170.9167.60110.9L202 T203 E204 V209 A210L202-K206 VanDerWaalsContact O-CG 3.23Å; L202-K206 WeakPolarHBondContact O-CG 3.24Å; L202-K206 PolarHBondContact O-N 3.48Å; L202-K206 VanDerWaalsContact O-N 3.09Å; T203-K206 WeakPolarHBondContact O-CB 3.46Å; T203-K206 PolarHBondContact O-N 3.42Å; T203-K206 VanDerWaalsContact O-N 3.09Å; E204-K206 VanDerWaalsContact C-N 3.34Å; E204-K206 PolarHBondContact O-N 3.46Å; K206-V209 PolarHBondContact O-N 2.91Å; K206-A210 PolarHBondContact O-N 3.44Å
207I92.2Very high90.7Very high80 Ų8048 Ų4841%0.4127%0.271SS..Hα-helixtrans-60.6-48.1174.8-65.8166.5000109.8T203 E204 Q205 V209 A210 C211 M251T203-I207 HydrophobicContact CG2-CD1 4.33Å; T203-I207 WeakPolarHBondContact O-CG1 3.33Å; T203-I207 PolarHBondContact O-N 3.36Å; E204-I207 WeakPolarHBondContact O-CB 3.37Å; E204-I207 PolarHBondContact O-N 2.91Å; Q205-I207 VanDerWaalsContact C-N 3.33Å; I207-V209 VanDerWaalsContact C-N 3.31Å; I207-V209 PolarHBondContact O-N 3.3Å; I207-A210 WeakPolarHBondContact O-CB 3.37Å; I207-A210 PolarHBondContact O-N 3.12Å; I207-A210 VanDerWaalsContact O-N 3.07Å; I207-C211 PolarHBondContact O-N 2.99Å; I207-C211 PolarHBondContact O-SG 2.98Å; I207-M251 HydrophobicContact CG2-CG 4.1Å; I207-M251 HydrophobicContact CG2-SD 4.35Å
208A88.8Confident90.9Very high0 Ų047.9 Ų47.90%027%0.271CS..Hα-helixtrans-56.1-43.917800000112.8E204 Q205 C211 G212 K248 M251 M252E204-A208 PolarHBondContact O-N 3.1Å; Q205-A208 PolarHBondContact O-N 2.66Å; A208-C211 PolarHBondContact O-N 2.87Å; A208-G212 PolarHBondContact O-N 2.61Å; A208-K248 HydrophobicContact CB-CG 4.32Å; A208-K248 WeakPolarHBondContact O-CG 3.38Å; A208-M251 HydrophobicContact CB-CB 3.78Å; A208-M252 HydrophobicContact CB-CG 3.76Å; A208-M252 HydrophobicContact CB-SD 3.66Å
209V87.3Confident91.2Very high44 Ų4450.1 Ų50.127%0.26728%0.28SS..Hα-helixtrans-64.9-42.7175.9170.30000111.7K97 Q205 K206 I207 C211 G212 H213K97-V209 HydrophobicContact CD-CG2 3.91Å; Q205-V209 WeakPolarHBondContact O-CG2 3.4Å; Q205-V209 PolarHBondContact O-N 2.86Å; K206-V209 PolarHBondContact O-N 2.91Å; I207-V209 VanDerWaalsContact C-N 3.31Å; I207-V209 PolarHBondContact O-N 3.3Å; V209-C211 VanDerWaalsContact C-N 3.33Å; V209-C211 PolarHBondContact O-N 2.84Å; V209-G212 PolarHBondContact O-N 3.2Å; V209-H213 PolarHBondContact O-N 3.14Å
210A93.8Very high91.4Very high56 Ų5654 Ų5446%0.46330%0.3SS..Hα-helixtrans-60.9-42.7176.900000111.4K206 I207 G212 H213 F214K206-A210 PolarHBondContact O-N 3.44Å; I207-A210 WeakPolarHBondContact O-CB 3.37Å; I207-A210 PolarHBondContact O-N 3.12Å; I207-A210 VanDerWaalsContact O-N 3.07Å; A210-G212 VanDerWaalsContact C-N 3.33Å; A210-G212 PolarHBondContact O-N 3.31Å; A210-H213 PolarHBondContact O-N 3.42Å; A210-F214 WeakPolarHBondContact O-CB 3.47Å; A210-F214 PolarHBondContact O-N 2.93Å
211C94Very high91.4Very high12 Ų1253.3 Ų53.38%0.08130%0.298CS..Hα-helixtrans-59.2-43.1173.2-660000111.8I207 A208 V209 F214 A215 F244 I247 K248I207-C211 PolarHBondContact O-N 2.99Å; I207-C211 PolarHBondContact O-SG 2.98Å; A208-C211 PolarHBondContact O-N 2.87Å; V209-C211 VanDerWaalsContact C-N 3.33Å; V209-C211 PolarHBondContact O-N 2.84Å; C211-F214 PolarHBondContact O-N 3.44Å; C211-A215 WeakPolarHBondContact O-CB 3.15Å; C211-A215 PolarHBondContact O-N 3.1Å; C211-F244 HydrophobicContact CB-CD1 4.01Å; C211-I247 HydrophobicContact CB-CG2 4.5Å; C211-I247 VanDerWaalsContact SG-CG2 3.56Å; C211-K248 HydrophobicContact CB-CB 4Å
212G91.1Very high91.6Very high11 Ų1156 Ų5611%0.11331%0.312CS..Hα-helixtrans-63.5-40.8175.600000113.8A208 V209 A210 F214 A215 A216A208-G212 PolarHBondContact O-N 2.61Å; V209-G212 PolarHBondContact O-N 3.2Å; A210-G212 VanDerWaalsContact C-N 3.33Å; A210-G212 PolarHBondContact O-N 3.31Å; G212-F214 VanDerWaalsContact C-N 3.33Å; G212-A215 PolarHBondContact O-N 3.21Å; G212-A216 WeakPolarHBondContact O-CB 3.43Å; G212-A216 PolarHBondContact O-N 3.43Å
213H93.9Very high91.6Very high133 Ų13360 Ų6062%0.61633%0.33SS*.Hα-helixtrans-64.6-40174.1-68.4170.3000111.7V209 A210 A216 A217V209-H213 PolarHBondContact O-N 3.14Å; A210-H213 PolarHBondContact O-N 3.42Å; H213-A216 PolarHBondContact O-N 3.09Å; H213-A217 WeakPolarHBondContact O-CB 3.3Å; H213-A217 PolarHBondContact O-N 3.04Å
214F96.9Very high90.8Very high95 Ų9564.6 Ų64.642%0.41735%0.352SS..Hα-helixtrans-67-42.4178-168.7-105.9000111.9A210 C211 G212 A216 A217 L218 F244A210-F214 WeakPolarHBondContact O-CB 3.47Å; A210-F214 PolarHBondContact O-N 2.93Å; C211-F214 PolarHBondContact O-N 3.44Å; G212-F214 VanDerWaalsContact C-N 3.33Å; F214-A216 VanDerWaalsContact C-N 3.34Å; F214-A216 PolarHBondContact O-N 3Å; F214-A217 PolarHBondContact O-N 2.78Å; F214-L218 HydrophobicContact CD1-CD1 3.82Å; F214-L218 HydrophobicContact CD1-CG 4.33Å; F214-L218 HydrophobicContact CE1-CD1 3.64Å; F214-L218 HydrophobicContact CE1-CD2 4.38Å; F214-L218 HydrophobicContact CE1-CG 4.08Å; F214-L218 HydrophobicContact CZ-CD1 4.43Å; F214-L218 HydrophobicContact CZ-CD2 4.41Å; F214-L218 HydrophobicContact CZ-CG 4.42Å; F214-L218 WeakPolarHBondContact O-CG 3.42Å; F214-L218 PolarHBondContact O-N 2.7Å; F214-F244 HydrophobicContact CB-CD1 4.33Å; F214-F244 HydrophobicContact CD1-CB 4.48Å; F214-F244 AromaticContact CD1-CD1 3.72Å; F214-F244 HydrophobicContact CD1-CD1 3.72Å; F214-F244 AromaticContact CD1-CD2 3.42Å; F214-F244 HydrophobicContact CD1-CD2 3.42Å; F214-F244 VanDerWaalsContact CD1-CD2 3.42Å; F214-F244 AromaticContact CD1-CE1 3.64Å; F214-F244 HydrophobicContact CD1-CE1 3.64Å; F214-F244 AromaticContact CD1-CE2 3.36Å; F214-F244 HydrophobicContact CD1-CE2 3.36Å; F214-F244 AromaticContact CD1-CG 3.6Å; F214-F244 HydrophobicContact CD1-CG 3.6Å; F214-F244 AromaticContact CD1-CZ 3.46Å; F214-F244 HydrophobicContact CD1-CZ 3.46Å; F214-F244 VanDerWaalsContact CD1-CZ 3.46Å; F214-F244 AromaticContact CE1-CD2 3.67Å; F214-F244 HydrophobicContact CE1-CD2 3.67Å; F214-F244 HydrophobicContact CE1-CE1 4.17Å; F214-F244 AromaticContact CE1-CE2 3.23Å; F214-F244 HydrophobicContact CE1-CE2 3.23Å; F214-F244 HydrophobicContact CE1-CG 4.32Å; F214-F244 AromaticContact CE1-CZ 3.5Å; F214-F244 HydrophobicContact CE1-CZ 3.5Å; F214-F244 HydrophobicContact CG-CD1 4.41Å; F214-F244 HydrophobicContact CG-CE1 4.34Å; F214-F244 HydrophobicContact CG-CZ 4.46Å; F214-F244 HydrophobicContact CZ-CE2 4.46Å
215A95.6Very high90.1Very high2 Ų265.2 Ų65.22%0.01737%0.365CS..Hα-helixtrans-56.7-47.3171.500000111.2C211 G212 A217 L218 H219 F244C211-A215 WeakPolarHBondContact O-CB 3.15Å; C211-A215 PolarHBondContact O-N 3.1Å; G212-A215 PolarHBondContact O-N 3.21Å; A215-A217 VanDerWaalsContact C-N 3.35Å; A215-A217 PolarHBondContact O-N 2.88Å; A215-L218 WeakPolarHBondContact O-CB 3.47Å; A215-L218 PolarHBondContact O-N 3.45Å; A215-H219 PolarHBondContact O-CD2 2.95Å; A215-H219 PolarHBondContact O-N 3.36Å; A215-F244 HydrophobicContact CB-CB 4.02Å
216A94.1Very high89.8Confident58 Ų5872.7 Ų72.748%0.47940%0.4SS..Hα-helixtrans-61.8-40.1176.200000112.8G212 H213 F214 H219 L220G212-A216 WeakPolarHBondContact O-CB 3.43Å; G212-A216 PolarHBondContact O-N 3.43Å; H213-A216 PolarHBondContact O-N 3.09Å; F214-A216 VanDerWaalsContact C-N 3.34Å; F214-A216 PolarHBondContact O-N 3Å; A216-H219 WeakPolarHBondContact O-CB 3.44Å; A216-H219 PolarHBondContact O-N 3.31Å; A216-L220 PolarHBondContact O-N 3.06Å
217A96.9Very high89.9Confident45 Ų4570.4 Ų70.437%0.37239%0.393SS..Hα-helixtrans-63.8-39.9176.700000112.1H213 F214 A215 H219 L220H213-A217 WeakPolarHBondContact O-CB 3.3Å; H213-A217 PolarHBondContact O-N 3.04Å; F214-A217 PolarHBondContact O-N 2.78Å; A215-A217 VanDerWaalsContact C-N 3.35Å; A215-A217 PolarHBondContact O-N 2.88Å; A217-H219 VanDerWaalsContact C-N 3.26Å; A217-H219 PolarHBondContact O-N 3.22Å; A217-L220 WeakPolarHBondContact O-CB 3.48Å; A217-L220 PolarHBondContact O-N 3.24Å; A217-L220 VanDerWaalsContact O-N 3.09Å
218L96.1Very high89.6Confident18 Ų1870.7 Ų70.79%0.09440%0.401CS..Hα-helixtrans-61.5-35.1174.2-72.7166.7000112.2F214 A215 L220 C221 L240 F244F214-L218 HydrophobicContact CD1-CD1 3.82Å; F214-L218 HydrophobicContact CD1-CG 4.33Å; F214-L218 HydrophobicContact CE1-CD1 3.64Å; F214-L218 HydrophobicContact CE1-CD2 4.38Å; F214-L218 HydrophobicContact CE1-CG 4.08Å; F214-L218 HydrophobicContact CZ-CD1 4.43Å; F214-L218 HydrophobicContact CZ-CD2 4.41Å; F214-L218 HydrophobicContact CZ-CG 4.42Å; F214-L218 WeakPolarHBondContact O-CG 3.42Å; F214-L218 PolarHBondContact O-N 2.7Å; A215-L218 WeakPolarHBondContact O-CB 3.47Å; A215-L218 PolarHBondContact O-N 3.45Å; L218-L220 VanDerWaalsContact C-N 3.27Å; L218-L220 PolarHBondContact O-N 2.65Å; L218-C221 WeakPolarHBondContact O-CB 3.48Å; L218-C221 PolarHBondContact O-N 2.94Å; L218-L240 HydrophobicContact CD1-CB 3.59Å; L218-L240 HydrophobicContact CD2-CB 4.4Å; L218-L240 HydrophobicContact CD2-CD1 4.5Å; L218-F244 HydrophobicContact CD1-CD2 4.32Å
219H93.4Very high89.5Confident95 Ų9578.3 Ų78.344%0.4444%0.436SS..Hα-helixtrans-65.9-28.5174.8-82.9-117.3000113.2A215 A216 A217 C221 I222 S241A215-H219 PolarHBondContact O-CD2 2.95Å; A215-H219 PolarHBondContact O-N 3.36Å; A216-H219 WeakPolarHBondContact O-CB 3.44Å; A216-H219 PolarHBondContact O-N 3.31Å; A217-H219 VanDerWaalsContact C-N 3.26Å; A217-H219 PolarHBondContact O-N 3.22Å; H219-C221 PolarHBondContact O-N 3.31Å; H219-I222 HydrophobicContact CB-CD1 4.27Å; H219-I222 WeakPolarHBondContact O-CB 3.47Å; H219-I222 PolarHBondContact O-N 3.37Å; H219-S241 WeakPolarHBondContact CD2-CB 3.33Å; H219-S241 PolarHBondContact CD2-OG 3.42Å; H219-S241 WeakPolarHBondContact NE2-CB 3.21Å; H219-S241 PolarHBondContact NE2-OG 3.35Å
220L93.8Very high89.5Confident155 Ų15580.7 Ų80.781%0.81244%0.443SS*.Hα-helixtrans-71.1-20.4176.1-61.6174.8000112.7A216 A217 L218 I222A216-L220 PolarHBondContact O-N 3.06Å; A217-L220 WeakPolarHBondContact O-CB 3.48Å; A217-L220 PolarHBondContact O-N 3.24Å; A217-L220 VanDerWaalsContact O-N 3.09Å; L218-L220 VanDerWaalsContact C-N 3.27Å; L218-L220 PolarHBondContact O-N 2.65Å; L220-I222 VanDerWaalsContact C-N 3.28Å
221C90.7Very high89.2Confident58 Ų5883.9 Ų83.939%0.39244%0.443SS..THydrogen-bonded Turntrans-82.9-3.4177.4-59.80000113.4L218 H219 E223 F233L218-C221 WeakPolarHBondContact O-CB 3.48Å; L218-C221 PolarHBondContact O-N 2.94Å; H219-C221 PolarHBondContact O-N 3.31Å; C221-E223 PolarHBondContact O-N 2.76Å; C221-F233 HydrophobicContact CB-CE1 4.04Å
222I90.5Very high88.9Confident58 Ų5885.1 Ų85.130%0.29745%0.454SS..  trans-78.6118.5-179.1-61.1170.5000108.9H219 L220 C237 V238H219-I222 HydrophobicContact CB-CD1 4.27Å; H219-I222 WeakPolarHBondContact O-CB 3.47Å; H219-I222 PolarHBondContact O-N 3.37Å; L220-I222 VanDerWaalsContact C-N 3.28Å; I222-C237 HydrophobicContact CG1-CB 4.36Å; I222-V238 HydrophobicContact CD1-CG2 3.4Å; I222-V238 VanDerWaalsContact CD1-CG2 3.4Å; I222-V238 HydrophobicContact CG1-CG2 4.11Å
223E85.5Confident88.9Confident104 Ų10490.4 Ų90.449%0.48647%0.474SS..  trans-108.9140.6177.6-69.2-175.2-170.700111.3C221 K230 S234C221-E223 PolarHBondContact O-N 2.76Å; E223-K230 WeakPolarHBondContact OE2-CD 3.45Å; E223-K230 IonicContact OE2-NZ 2.78Å; E223-K230 PolarHBondContact OE2-NZ 3.44Å; E223-S234 PolarHBondContact N-OG 3.33Å
224N73.1Confident88.8Confident168 Ų16884.6 Ų84.690%0.89845%0.449SS*.  trans-90120.5170.6-67.7-37.8000109.5
225G72.5Confident88.5Confident40 Ų4086.8 Ų86.841%0.41245%0.454SS..SBendtrans-176.2163.417800000113.1R231G225-R231 WeakPolarHBondContact O-CD 3.44Å; G225-R231 WeakPolarHBondContact O-CG 3.38Å
226E78.9Confident88.3Confident177 Ų17789.4 Ų89.483%0.82747%0.47SS*.SBendtrans-81.6-16.9-179.4-63.6-169.7158.600113.3P228 R231E226-P228 WeakPolarHBondContact O-CD 3.2Å; E226-R231 PolarHBondContact O-NE 2.85Å; E226-R231 PolarHBondContact O-NH2 3.12Å
227D88.6Confident88.3Confident69 Ų6986.9 Ų86.937%0.36945%0.449SS..  trans-54.8117.2179.5-178.6-6.5000111.2E229 K230 R231D227-E229 VanDerWaalsContact C-N 3.28Å; D227-E229 PolarHBondContact O-N 3.03Å; D227-E229 PolarHBondContact OD1-N 2.91Å; D227-K230 HydrophobicContact CB-CB 4.06Å; D227-K230 HydrophobicContact CB-CD 3.92Å; D227-K230 HydrophobicContact CB-CG 4.07Å; D227-K230 PolarHBondContact O-N 3.34Å; D227-K230 WeakPolarHBondContact OD2-CD 3.49Å; D227-K230 WeakPolarHBondContact OD2-CG 3.38Å; D227-R231 WeakPolarHBondContact O-CG 3.46Å; D227-R231 PolarHBondContact O-N 3.22Å
228P86.1Confident88.2Confident87 Ų8787 Ų8757%0.56544%0.444SS*.Hα-helixtrans-56.1-36.9179.8-25.735.1000114.3E226 A232E226-P228 WeakPolarHBondContact O-CD 3.2Å; P228-A232 WeakPolarHBondContact O-CB 3.27Å; P228-A232 PolarHBondContact O-N 3.1Å
229E86.2Confident88.1Confident159 Ų15989 Ų8974%0.74345%0.453SS*.Hα-helixtrans-72-45.1-177.1-67.2-175.7-178.500111D227 R231 A232 F233D227-E229 VanDerWaalsContact C-N 3.28Å; D227-E229 PolarHBondContact O-N 3.03Å; D227-E229 PolarHBondContact OD1-N 2.91Å; E229-R231 VanDerWaalsContact C-N 3.31Å; E229-R231 PolarHBondContact O-N 3.44Å; E229-A232 WeakPolarHBondContact O-CB 3.45Å; E229-A232 PolarHBondContact O-N 3Å; E229-A232 VanDerWaalsContact O-N 3.12Å; E229-F233 PolarHBondContact O-N 3.06Å
230K86.9Confident88.2Confident95 Ų9587.4 Ų87.441%0.41345%0.447SS..Hα-helixtrans-61.7-38.3174.4-69.4-179.4173-142.20112.6E223 D227 S234E223-K230 WeakPolarHBondContact OE2-CD 3.45Å; E223-K230 IonicContact OE2-NZ 2.78Å; E223-K230 PolarHBondContact OE2-NZ 3.44Å; D227-K230 HydrophobicContact CB-CB 4.06Å; D227-K230 HydrophobicContact CB-CD 3.92Å; D227-K230 HydrophobicContact CB-CG 4.07Å; D227-K230 PolarHBondContact O-N 3.34Å; D227-K230 WeakPolarHBondContact OD2-CD 3.49Å; D227-K230 WeakPolarHBondContact OD2-CG 3.38Å; K230-S234 WeakPolarHBondContact O-CB 3.45Å; K230-S234 PolarHBondContact O-N 3.45Å; K230-S234 PolarHBondContact O-OG 2.96Å
231R87.9Confident88.3Confident123 Ų12380 Ų8046%0.46441%0.409SS..Hα-helixtrans-65.5-39.2173.4-76-170.9-72159-7.5111.8G225 E226 D227 E229 R235G225-R231 WeakPolarHBondContact O-CD 3.44Å; G225-R231 WeakPolarHBondContact O-CG 3.38Å; E226-R231 PolarHBondContact O-NE 2.85Å; E226-R231 PolarHBondContact O-NH2 3.12Å; D227-R231 WeakPolarHBondContact O-CG 3.46Å; D227-R231 PolarHBondContact O-N 3.22Å; E229-R231 VanDerWaalsContact C-N 3.31Å; E229-R231 PolarHBondContact O-N 3.44Å; R231-R235 WeakPolarHBondContact O-CG 3.38Å; R231-R235 PolarHBondContact O-N 3.48Å; R231-R235 VanDerWaalsContact O-N 3.1Å; R231-R235 PolarHBondContact O-NH1 3.47Å
232A87.9Confident88.6Confident38 Ų3880.7 Ų80.731%0.31441%0.406SS..Hα-helixtrans-64.8-47.1176.300000111.9P228 E229 S234 R235 V236P228-A232 WeakPolarHBondContact O-CB 3.27Å; P228-A232 PolarHBondContact O-N 3.1Å; E229-A232 WeakPolarHBondContact O-CB 3.45Å; E229-A232 PolarHBondContact O-N 3Å; E229-A232 VanDerWaalsContact O-N 3.12Å; A232-S234 PolarHBondContact O-N 3.45Å; A232-R235 PolarHBondContact O-N 3.41Å; A232-V236 PolarHBondContact O-N 3.26Å
233F90.4Very high88.9Confident121 Ų12179.1 Ų79.153%0.53140%0.399SS..Hα-helixtrans-59.7-46.8175.4179.6-105.1000112.1C221 E229 R235 V236 C237C221-F233 HydrophobicContact CB-CE1 4.04Å; E229-F233 PolarHBondContact O-N 3.06Å; F233-R235 VanDerWaalsContact C-N 3.3Å; F233-R235 PolarHBondContact O-N 3.16Å; F233-V236 WeakPolarHBondContact O-CB 3.46Å; F233-V236 PolarHBondContact O-N 2.73Å; F233-C237 VanDerWaalsContact CE1-SG 3.55Å; F233-C237 VanDerWaalsContact CZ-SG 3.57Å; F233-C237 PolarHBondContact O-N 2.8Å
234S92.3Very high89.4Confident12 Ų1276.7 Ų76.78%0.08439%0.387CS..Hα-helixtrans-58.9-39.4177.7-64.80000112.6E223 K230 A232 C237 V238E223-S234 PolarHBondContact N-OG 3.33Å; K230-S234 WeakPolarHBondContact O-CB 3.45Å; K230-S234 PolarHBondContact O-N 3.45Å; K230-S234 PolarHBondContact O-OG 2.96Å; A232-S234 PolarHBondContact O-N 3.45Å; S234-C237 PolarHBondContact O-N 2.84Å; S234-V238 WeakPolarHBondContact O-CG2 3.32Å; S234-V238 PolarHBondContact O-N 3.47Å
235R90.2Very high90.5Very high140 Ų14071.3 Ų71.353%0.52836%0.358SS..Hα-helixtrans-62.4-41.3174.2-73.9-170.4-56-88.46.9112.2R231 A232 F233 V238 K239R231-R235 WeakPolarHBondContact O-CG 3.38Å; R231-R235 PolarHBondContact O-N 3.48Å; R231-R235 VanDerWaalsContact O-N 3.1Å; R231-R235 PolarHBondContact O-NH1 3.47Å; A232-R235 PolarHBondContact O-N 3.41Å; F233-R235 VanDerWaalsContact C-N 3.3Å; F233-R235 PolarHBondContact O-N 3.16Å; R235-V238 PolarHBondContact O-N 2.95Å; R235-K239 PolarHBondContact O-N 2.95Å
236V92.1Very high91.6Very high58 Ų5870.6 Ų70.635%0.35235%0.346SS..Hα-helixtrans-64.7-43.3175.9173.80000110.9A232 F233 V238 K239 L240A232-V236 PolarHBondContact O-N 3.26Å; F233-V236 WeakPolarHBondContact O-CB 3.46Å; F233-V236 PolarHBondContact O-N 2.73Å; V236-V238 PolarHBondContact O-N 3.04Å; V236-K239 PolarHBondContact O-N 2.83Å; V236-L240 HydrophobicContact CG1-CD1 3.91Å; V236-L240 HydrophobicContact CG1-CG 4.3Å; V236-L240 WeakPolarHBondContact O-CB 3.31Å; V236-L240 WeakPolarHBondContact O-CG 3.38Å; V236-L240 PolarHBondContact O-N 3.25Å
237C94.8Very high92.4Very high4 Ų464.1 Ų64.13%0.02732%0.317CS..Hα-helixtrans-59-44176-71.50000112.4I222 F233 S234 L240 S241I222-C237 HydrophobicContact CG1-CB 4.36Å; F233-C237 VanDerWaalsContact CE1-SG 3.55Å; F233-C237 VanDerWaalsContact CZ-SG 3.57Å; F233-C237 PolarHBondContact O-N 2.8Å; S234-C237 PolarHBondContact O-N 2.84Å; C237-L240 PolarHBondContact O-N 3.41Å; C237-S241 PolarHBondContact O-N 3.38Å; C237-S241 PolarHBondContact O-OG 2.96Å
238V93.8Very high92.6Very high47 Ų4764.8 Ų64.829%0.28532%0.317SS..Hα-helixtrans-62.2-44.8175172.50000111.4I222 S234 R235 V236 L240 S241 E242I222-V238 HydrophobicContact CD1-CG2 3.4Å; I222-V238 VanDerWaalsContact CD1-CG2 3.4Å; I222-V238 HydrophobicContact CG1-CG2 4.11Å; S234-V238 WeakPolarHBondContact O-CG2 3.32Å; S234-V238 PolarHBondContact O-N 3.47Å; R235-V238 PolarHBondContact O-N 2.95Å; V236-V238 PolarHBondContact O-N 3.04Å; V238-L240 PolarHBondContact O-N 3.01Å; V238-S241 PolarHBondContact O-N 3.09Å; V238-S241 PolarHBondContact O-OG 3.29Å; V238-E242 WeakPolarHBondContact O-CG 3.26Å; V238-E242 PolarHBondContact O-N 2.85Å
239K93.9Very high92.9Very high61 Ų6167.8 Ų67.827%0.26532%0.321SS..Hα-helixtrans-67.3-37.9178.6-72.4-49.1-171.6-175.40113.1R235 V236 S241 E242 V243 F370 M373R235-K239 PolarHBondContact O-N 2.95Å; V236-K239 PolarHBondContact O-N 2.83Å; K239-S241 VanDerWaalsContact C-N 3.35Å; K239-E242 WeakPolarHBondContact CD-OE2 3.31Å; K239-E242 IonicContact NZ-OE1 3.46Å; K239-E242 PolarHBondContact NZ-OE1 3.48Å; K239-E242 IonicContact NZ-OE2 2.7Å; K239-E242 PolarHBondContact NZ-OE2 2.93Å; K239-E242 PolarHBondContact O-N 3.01Å; K239-V243 WeakPolarHBondContact O-CG2 3.3Å; K239-V243 PolarHBondContact O-N 2.99Å; K239-V243 VanDerWaalsContact O-N 3.17Å; K239-F370 HydrophobicContact CB-CE1 4.02Å; K239-F370 HydrophobicContact CB-CE2 3.94Å; K239-F370 HydrophobicContact CB-CZ 3.52Å; K239-M373 HydrophobicContact CB-CE 3.92Å; K239-M373 HydrophobicContact CB-SD 4.37Å; K239-M373 HydrophobicContact CG-CE 3.78Å; K239-M373 HydrophobicContact CG-SD 3.6Å; K239-M373 VanDerWaalsContact CG-SD 3.6Å
240L95.6Very high93.2Very high61 Ų6161.4 Ų61.432%0.31929%0.292SS..Hα-helixtrans-65.6-39.4173.6-74.5173.7000111.3L218 V236 C237 V238 E242 V243 F244 F370L218-L240 HydrophobicContact CD1-CB 3.59Å; L218-L240 HydrophobicContact CD2-CB 4.4Å; L218-L240 HydrophobicContact CD2-CD1 4.5Å; V236-L240 HydrophobicContact CG1-CD1 3.91Å; V236-L240 HydrophobicContact CG1-CG 4.3Å; V236-L240 WeakPolarHBondContact O-CB 3.31Å; V236-L240 WeakPolarHBondContact O-CG 3.38Å; V236-L240 PolarHBondContact O-N 3.25Å; C237-L240 PolarHBondContact O-N 3.41Å; V238-L240 PolarHBondContact O-N 3.01Å; L240-E242 PolarHBondContact O-N 3.49Å; L240-V243 WeakPolarHBondContact O-CB 3.47Å; L240-V243 PolarHBondContact O-N 3.24Å; L240-F244 WeakPolarHBondContact O-CD2 3.4Å; L240-F244 PolarHBondContact O-N 3.45Å; L240-F370 HydrophobicContact CD2-CE1 4.35Å; L240-F370 HydrophobicContact CD2-CZ 3.75Å; L240-F370 HydrophobicContact CG-CE1 4.39Å; L240-F370 HydrophobicContact CG-CZ 3.9Å
241S96.9Very high93.4Very high1 Ų159 Ų591%0.00728%0.283CS..Hα-helixtrans-64.8-41.4178.7680000111.8H219 C237 V238 K239 V243 F244 D245H219-S241 WeakPolarHBondContact CD2-CB 3.33Å; H219-S241 PolarHBondContact CD2-OG 3.42Å; H219-S241 WeakPolarHBondContact NE2-CB 3.21Å; H219-S241 PolarHBondContact NE2-OG 3.35Å; C237-S241 PolarHBondContact O-N 3.38Å; C237-S241 PolarHBondContact O-OG 2.96Å; V238-S241 PolarHBondContact O-N 3.09Å; V238-S241 PolarHBondContact O-OG 3.29Å; K239-S241 VanDerWaalsContact C-N 3.35Å; S241-V243 VanDerWaalsContact C-N 3.3Å; S241-V243 PolarHBondContact O-N 3.13Å; S241-F244 PolarHBondContact O-N 3.49Å; S241-D245 PolarHBondContact O-N 3.01Å
242E95.9Very high93.4Very high72 Ų7256.6 Ų56.634%0.33628%0.277SS..Hα-helixtrans-57.8-39.6173.2-71.8173.1-173.300112.4V238 K239 L240 S246V238-E242 WeakPolarHBondContact O-CG 3.26Å; V238-E242 PolarHBondContact O-N 2.85Å; K239-E242 WeakPolarHBondContact CD-OE2 3.31Å; K239-E242 IonicContact NZ-OE1 3.46Å; K239-E242 PolarHBondContact NZ-OE1 3.48Å; K239-E242 IonicContact NZ-OE2 2.7Å; K239-E242 PolarHBondContact NZ-OE2 2.93Å; K239-E242 PolarHBondContact O-N 3.01Å; L240-E242 PolarHBondContact O-N 3.49Å; E242-S246 WeakPolarHBondContact O-CB 3.38Å; E242-S246 PolarHBondContact O-N 2.8Å; E242-S246 PolarHBondContact O-OG 2.63Å
243V96.9Very high93.4Very high24 Ų2456.8 Ų56.815%0.14528%0.277CS..Hα-helixtrans-62.3-51.2173.9170.70000110.7K239 L240 S241 D245 S246 I247 H366 F370K239-V243 WeakPolarHBondContact O-CG2 3.3Å; K239-V243 PolarHBondContact O-N 2.99Å; K239-V243 VanDerWaalsContact O-N 3.17Å; L240-V243 WeakPolarHBondContact O-CB 3.47Å; L240-V243 PolarHBondContact O-N 3.24Å; S241-V243 VanDerWaalsContact C-N 3.3Å; S241-V243 PolarHBondContact O-N 3.13Å; V243-D245 VanDerWaalsContact C-N 3.32Å; V243-D245 PolarHBondContact O-N 3.19Å; V243-S246 CarbonylContact O-C 3.6Å; V243-S246 WeakPolarHBondContact O-CA 3.28Å; V243-S246 WeakPolarHBondContact O-CB 3.34Å; V243-S246 PolarHBondContact O-N 3.28Å; V243-I247 HydrophobicContact CG1-CD1 3.92Å; V243-I247 HydrophobicContact CG1-CG1 4.41Å; V243-I247 WeakPolarHBondContact O-CG1 3.44Å; V243-I247 PolarHBondContact O-N 2.73Å; V243-H366 HydrophobicContact CG2-CB 3.69Å; V243-F370 HydrophobicContact CG2-CE2 3.79Å
244F97Very high93.4Very high54 Ų5451.6 Ų51.624%0.23726%0.255CS..Hα-helixtrans-66.7-33-178-85.7-85.8000112.8C211 F214 A215 L218 L240 S241 S246 I247 K248C211-F244 HydrophobicContact CB-CD1 4.01Å; F214-F244 HydrophobicContact CB-CD1 4.33Å; F214-F244 HydrophobicContact CD1-CB 4.48Å; F214-F244 AromaticContact CD1-CD1 3.72Å; F214-F244 HydrophobicContact CD1-CD1 3.72Å; F214-F244 AromaticContact CD1-CD2 3.42Å; F214-F244 HydrophobicContact CD1-CD2 3.42Å; F214-F244 VanDerWaalsContact CD1-CD2 3.42Å; F214-F244 AromaticContact CD1-CE1 3.64Å; F214-F244 HydrophobicContact CD1-CE1 3.64Å; F214-F244 AromaticContact CD1-CE2 3.36Å; F214-F244 HydrophobicContact CD1-CE2 3.36Å; F214-F244 AromaticContact CD1-CG 3.6Å; F214-F244 HydrophobicContact CD1-CG 3.6Å; F214-F244 AromaticContact CD1-CZ 3.46Å; F214-F244 HydrophobicContact CD1-CZ 3.46Å; F214-F244 VanDerWaalsContact CD1-CZ 3.46Å; F214-F244 AromaticContact CE1-CD2 3.67Å; F214-F244 HydrophobicContact CE1-CD2 3.67Å; F214-F244 HydrophobicContact CE1-CE1 4.17Å; F214-F244 AromaticContact CE1-CE2 3.23Å; F214-F244 HydrophobicContact CE1-CE2 3.23Å; F214-F244 HydrophobicContact CE1-CG 4.32Å; F214-F244 AromaticContact CE1-CZ 3.5Å; F214-F244 HydrophobicContact CE1-CZ 3.5Å; F214-F244 HydrophobicContact CG-CD1 4.41Å; F214-F244 HydrophobicContact CG-CE1 4.34Å; F214-F244 HydrophobicContact CG-CZ 4.46Å; F214-F244 HydrophobicContact CZ-CE2 4.46Å; A215-F244 HydrophobicContact CB-CB 4.02Å; L218-F244 HydrophobicContact CD1-CD2 4.32Å; L240-F244 WeakPolarHBondContact O-CD2 3.4Å; L240-F244 PolarHBondContact O-N 3.45Å; S241-F244 PolarHBondContact O-N 3.49Å; F244-S246 VanDerWaalsContact C-N 3.3Å; F244-I247 HydrophobicContact CD1-CD1 4.34Å; F244-I247 PolarHBondContact O-N 2.98Å; F244-K248 WeakPolarHBondContact O-CB 3.28Å; F244-K248 PolarHBondContact O-N 3.32Å
245D95.2Very high93.2Very high55 Ų5551 Ų5129%0.29425%0.251SS..Hα-helixtrans-65.6-35170.1-91.3-26.5000112.1S241 V243 K248 K249S241-D245 PolarHBondContact O-N 3.01Å; V243-D245 VanDerWaalsContact C-N 3.32Å; V243-D245 PolarHBondContact O-N 3.19Å; D245-K248 PolarHBondContact O-N 3Å; D245-K249 WeakPolarHBondContact O-CG 3Å; D245-K249 PolarHBondContact O-N 2.98Å
246S96.3Very high92.9Very high24 Ų2447.3 Ų47.317%0.16824%0.244CC..Hα-helixtrans-69-42.8174.6-57.40000111.7E242 V243 F244 K248 K249 N250 H366E242-S246 WeakPolarHBondContact O-CB 3.38Å; E242-S246 PolarHBondContact O-N 2.8Å; E242-S246 PolarHBondContact O-OG 2.63Å; V243-S246 CarbonylContact O-C 3.6Å; V243-S246 WeakPolarHBondContact O-CA 3.28Å; V243-S246 WeakPolarHBondContact O-CB 3.34Å; V243-S246 PolarHBondContact O-N 3.28Å; F244-S246 VanDerWaalsContact C-N 3.3Å; S246-K248 VanDerWaalsContact C-N 3.34Å; S246-K248 PolarHBondContact O-N 2.95Å; S246-K249 PolarHBondContact O-N 2.97Å; S246-N250 WeakPolarHBondContact O-CB 3.43Å; S246-N250 PolarHBondContact O-N 3.33Å; S246-H366 WeakPolarHBondContact CB-NE2 3.13Å; S246-H366 PolarHBondContact OG-NE2 3.42Å
247I95.7Very high92.6Very high42 Ų4246 Ų4622%0.21524%0.235CC..Hα-helixtrans-60-45.9173-63.7167.9000110.1C211 V243 F244 K249 N250 M251 F363C211-I247 HydrophobicContact CB-CG2 4.5Å; C211-I247 VanDerWaalsContact SG-CG2 3.56Å; V243-I247 HydrophobicContact CG1-CD1 3.92Å; V243-I247 HydrophobicContact CG1-CG1 4.41Å; V243-I247 WeakPolarHBondContact O-CG1 3.44Å; V243-I247 PolarHBondContact O-N 2.73Å; F244-I247 HydrophobicContact CD1-CD1 4.34Å; F244-I247 PolarHBondContact O-N 2.98Å; I247-K249 PolarHBondContact O-N 3.05Å; I247-N250 PolarHBondContact O-N 3.4Å; I247-M251 HydrophobicContact CG2-CG 4.12Å; I247-M251 WeakPolarHBondContact O-CB 3.35Å; I247-M251 WeakPolarHBondContact O-CG 3.47Å; I247-M251 PolarHBondContact O-N 3.27Å; I247-F363 HydrophobicContact CB-CE1 4.44Å; I247-F363 HydrophobicContact CB-CZ 4.44Å; I247-F363 HydrophobicContact CG1-CD1 4.49Å; I247-F363 HydrophobicContact CG1-CE1 3.48Å; I247-F363 VanDerWaalsContact CG1-CE1 3.48Å; I247-F363 HydrophobicContact CG1-CZ 3.66Å
248K93.6Very high92.3Very high82 Ų8245.9 Ų45.936%0.35723%0.234SC..Hα-helixtrans-54.9-50175.5167.2-176171.4-168.10111.5A208 C211 F244 D245 S246 N250 M251 M252A208-K248 HydrophobicContact CB-CG 4.32Å; A208-K248 WeakPolarHBondContact O-CG 3.38Å; C211-K248 HydrophobicContact CB-CB 4Å; F244-K248 WeakPolarHBondContact O-CB 3.28Å; F244-K248 PolarHBondContact O-N 3.32Å; D245-K248 PolarHBondContact O-N 3Å; S246-K248 VanDerWaalsContact C-N 3.34Å; S246-K248 PolarHBondContact O-N 2.95Å; K248-N250 PolarHBondContact O-N 3.01Å; K248-M251 PolarHBondContact O-N 2.86Å; K248-M252 WeakPolarHBondContact O-CB 3.08Å; K248-M252 WeakPolarHBondContact O-CG 3.28Å; K248-M252 PolarHBondContact O-N 3.21Å
249K91.1Very high91.9Very high151 Ų15147 Ų4766%0.65724%0.237SC*.Hα-helixtrans-60.8-44.5179.2-73.2171-175.3174.10111.5D245 S246 I247 M252 S253D245-K249 WeakPolarHBondContact O-CG 3Å; D245-K249 PolarHBondContact O-N 2.98Å; S246-K249 PolarHBondContact O-N 2.97Å; I247-K249 PolarHBondContact O-N 3.05Å; K249-M252 PolarHBondContact O-N 3.27Å; K249-S253 PolarHBondContact O-N 3.23Å
250N93Very high91.4Very high25 Ų2546.7 Ų46.713%0.13424%0.238CC..Hα-helixtrans-61.7-50.5177.7-175.8-94.1000111.5S246 I247 K248 M252 S253 V254 T355 G359S246-N250 WeakPolarHBondContact O-CB 3.43Å; S246-N250 PolarHBondContact O-N 3.33Å; I247-N250 PolarHBondContact O-N 3.4Å; K248-N250 PolarHBondContact O-N 3.01Å; N250-M252 VanDerWaalsContact C-N 3.31Å; N250-M252 PolarHBondContact O-N 3.17Å; N250-S253 WeakPolarHBondContact O-CA 3.44Å; N250-S253 VanDerWaalsContact O-CB 3.28Å; N250-S253 WeakPolarHBondContact O-CB 3.34Å; N250-S253 PolarHBondContact O-N 3.37Å; N250-V254 WeakPolarHBondContact O-CG2 3.2Å; N250-V254 PolarHBondContact O-N 3.12Å; N250-T355 PolarHBondContact ND2-O 3.05Å; N250-G359 WeakPolarHBondContact ND2-CA 3.34Å
251M91.1Very high91Very high45 Ų4544.4 Ų44.422%0.22223%0.226CC..Hα-helixtrans-61.2-36.6177.7-68.9-66102.900113I207 A208 I247 K248 S253 V254 A255I207-M251 HydrophobicContact CG2-CG 4.1Å; I207-M251 HydrophobicContact CG2-SD 4.35Å; A208-M251 HydrophobicContact CB-CB 3.78Å; I247-M251 HydrophobicContact CG2-CG 4.12Å; I247-M251 WeakPolarHBondContact O-CB 3.35Å; I247-M251 WeakPolarHBondContact O-CG 3.47Å; I247-M251 PolarHBondContact O-N 3.27Å; K248-M251 PolarHBondContact O-N 2.86Å; M251-S253 VanDerWaalsContact C-N 3.34Å; M251-V254 HydrophobicContact CE-CG2 4.26Å; M251-V254 PolarHBondContact O-N 2.88Å; M251-A255 PolarHBondContact O-N 3.38Å
252M88.2Confident90.8Very high71 Ų7145 Ų4535%0.3523%0.229SC..Hα-helixtrans-65.1-39.2172.1-73.4-55.9-5500111.9A208 K248 K249 N250 A255 V256A208-M252 HydrophobicContact CB-CG 3.76Å; A208-M252 HydrophobicContact CB-SD 3.66Å; K248-M252 WeakPolarHBondContact O-CB 3.08Å; K248-M252 WeakPolarHBondContact O-CG 3.28Å; K248-M252 PolarHBondContact O-N 3.21Å; K249-M252 PolarHBondContact O-N 3.27Å; N250-M252 VanDerWaalsContact C-N 3.31Å; N250-M252 PolarHBondContact O-N 3.17Å; M252-A255 PolarHBondContact O-N 3.18Å; M252-V256 WeakPolarHBondContact O-CB 3.35Å; M252-V256 VanDerWaalsContact O-CG2 3.29Å; M252-V256 WeakPolarHBondContact O-CG2 3.43Å; M252-V256 PolarHBondContact O-N 2.92Å
253S87.9Confident90.4Very high43 Ų4342.1 Ų42.130%0.30122%0.22SC..Hα-helixtrans-63.9-43.9175.7-166.90000111.7K249 N250 M251 V256 N257K249-S253 PolarHBondContact O-N 3.23Å; N250-S253 WeakPolarHBondContact O-CA 3.44Å; N250-S253 VanDerWaalsContact O-CB 3.28Å; N250-S253 WeakPolarHBondContact O-CB 3.34Å; N250-S253 PolarHBondContact O-N 3.37Å; M251-S253 VanDerWaalsContact C-N 3.34Å; S253-V256 PolarHBondContact O-N 2.94Å; S253-N257 WeakPolarHBondContact O-CB 3.35Å; S253-N257 VanDerWaalsContact O-CG 3.23Å; S253-N257 PolarHBondContact O-N 3.32Å; S253-N257 PolarHBondContact O-ND2 3.26Å
254V90.9Very high89.7Confident11 Ų1143.6 Ų43.67%0.06723%0.226CC..Hα-helixtrans-55.7-54.5174.3177.60000109.9E204 N250 M251 V256 N257 D258 T355E204-V254 WeakPolarHBondContact OE1-CG1 3.32Å; N250-V254 WeakPolarHBondContact O-CG2 3.2Å; N250-V254 PolarHBondContact O-N 3.12Å; M251-V254 HydrophobicContact CE-CG2 4.26Å; M251-V254 PolarHBondContact O-N 2.88Å; V254-V256 VanDerWaalsContact C-N 3.31Å; V254-V256 PolarHBondContact O-N 3.41Å; V254-N257 PolarHBondContact O-N 2.91Å; V254-N257 VanDerWaalsContact O-N 3.12Å; V254-D258 WeakPolarHBondContact O-CB 3.2Å; V254-D258 PolarHBondContact O-N 2.97Å; V254-T355 HydrophobicContact CG2-CG2 3.46Å; V254-T355 VanDerWaalsContact CG2-CG2 3.46Å
255A86.8Confident89.2Confident0 Ų041.3 Ų41.30%022%0.218CC..Hα-helixtrans-59.1-39.9-178.400000113.2V201 E204 Q205 M251 M252 M259V201-A255 HydrophobicContact CG1-CB 4.04Å; E204-A255 HydrophobicContact CB-CB 4.15Å; E204-A255 WeakPolarHBondContact OE2-CA 3.44Å; Q205-A255 HydrophobicContact CG-CB 3.69Å; M251-A255 PolarHBondContact O-N 3.38Å; M252-A255 PolarHBondContact O-N 3.18Å; A255-M259 WeakPolarHBondContact O-CG 3.39Å; A255-M259 PolarHBondContact O-N 2.87Å; A255-M259 VanDerWaalsContact O-N 3.13Å
256V83.5Confident88.9Confident63 Ų6339.9 Ų39.938%0.38221%0.21SC..Hα-helixtrans-67.5-44.1176.91690000111M252 S253 V254 D258 M259 N260M252-V256 WeakPolarHBondContact O-CB 3.35Å; M252-V256 VanDerWaalsContact O-CG2 3.29Å; M252-V256 WeakPolarHBondContact O-CG2 3.43Å; M252-V256 PolarHBondContact O-N 2.92Å; S253-V256 PolarHBondContact O-N 2.94Å; V254-V256 VanDerWaalsContact C-N 3.31Å; V254-V256 PolarHBondContact O-N 3.41Å; V256-D258 VanDerWaalsContact C-N 3.33Å; V256-D258 PolarHBondContact O-N 3.26Å; V256-M259 PolarHBondContact O-N 3.43Å; V256-N260 VanDerWaalsContact CG1-ND2 3.35Å; V256-N260 WeakPolarHBondContact CG1-ND2 3.29Å; V256-N260 VanDerWaalsContact O-CB 3.26Å; V256-N260 WeakPolarHBondContact O-CB 3.41Å; V256-N260 PolarHBondContact O-N 3.15Å; V256-N260 PolarHBondContact O-ND2 3.06Å
257N87.5Confident88.5Confident30 Ų3041.7 Ų41.716%0.1622%0.218CC..Hα-helixtrans-63.2-41.4177.8-75.3-19.3000111.5S253 V254 N260 T261 Q351 T355S253-N257 WeakPolarHBondContact O-CB 3.35Å; S253-N257 VanDerWaalsContact O-CG 3.23Å; S253-N257 PolarHBondContact O-N 3.32Å; S253-N257 PolarHBondContact O-ND2 3.26Å; V254-N257 PolarHBondContact O-N 2.91Å; V254-N257 VanDerWaalsContact O-N 3.12Å; N257-N260 PolarHBondContact O-N 2.75Å; N257-T261 WeakPolarHBondContact O-CB 3.44Å; N257-T261 WeakPolarHBondContact O-CG2 3.49Å; N257-T261 PolarHBondContact O-N 2.95Å; N257-T261 PolarHBondContact O-OG1 3.16Å; N257-Q351 HydrophobicContact CB-CB 3.96Å; N257-Q351 HydrophobicContact CB-CG 4.43Å; N257-T355 PolarHBondContact ND2-OG1 3.47Å
258D88.6Confident88Confident1 Ų141.4 Ų41.41%0.00522%0.217CC..Hα-helixtrans-63.5-46.4179.4-82.524.2000111.8F197 V201 V254 V256 N260 T261 L262 G263 W348 Q352F197-D258 HydrophobicContact CE1-CB 4.1Å; F197-D258 WeakPolarHBondContact CE1-O 3.21Å; F197-D258 HydrophobicContact CZ-CB 3.7Å; V201-D258 HydrophobicContact CG2-CB 3.79Å; V254-D258 WeakPolarHBondContact O-CB 3.2Å; V254-D258 PolarHBondContact O-N 2.97Å; V256-D258 VanDerWaalsContact C-N 3.33Å; V256-D258 PolarHBondContact O-N 3.26Å; D258-N260 VanDerWaalsContact C-N 3.34Å; D258-N260 PolarHBondContact O-N 3.21Å; D258-T261 PolarHBondContact O-N 2.87Å; D258-L262 PolarHBondContact O-N 3.49Å; D258-G263 PolarHBondContact O-N 2.89Å; D258-W348 PolarHBondContact OD1-NE1 3.48Å; D258-W348 PolarHBondContact OD2-NE1 2.9Å; D258-Q352 VanDerWaalsContact CG-NE2 3.3Å; D258-Q352 PolarHBondContact OD1-NE2 3.01Å; D258-Q352 PolarHBondContact OD2-NE2 3.5Å
259M85.3Confident87.9Confident72 Ų7237.7 Ų37.736%0.35520%0.201SC..Iπ-helixtrans-59-46.2172.3-73.2-61.5-6500111.8L198 V201 A255 V256 T261 G263 L264L198-M259 HydrophobicContact CD1-CE 4.24Å; L198-M259 HydrophobicContact CD1-SD 3.84Å; V201-M259 HydrophobicContact CB-CG 4.45Å; V201-M259 HydrophobicContact CB-SD 4.25Å; V201-M259 HydrophobicContact CG1-CG 3.56Å; V201-M259 HydrophobicContact CG1-SD 3.83Å; V201-M259 HydrophobicContact CG2-CG 4.22Å; V201-M259 HydrophobicContact CG2-SD 4.03Å; A255-M259 WeakPolarHBondContact O-CG 3.39Å; A255-M259 PolarHBondContact O-N 2.87Å; A255-M259 VanDerWaalsContact O-N 3.13Å; V256-M259 PolarHBondContact O-N 3.43Å; M259-T261 VanDerWaalsContact C-N 3.27Å; M259-T261 PolarHBondContact O-N 3.39Å; M259-G263 CarbonylContact O-C 3.59Å; M259-L264 WeakPolarHBondContact O-CG 3.44Å; M259-L264 PolarHBondContact O-N 3.47Å
260N82.6Confident87.8Confident53 Ų5331.5 Ų31.528%0.28318%0.177SC..Iπ-helixtrans-75.6-10.2-174.1-72.6-24.1000114.8P110 V256 N257 D258P110-N260 HydrophobicContact CB-CB 4.2Å; P110-N260 HydrophobicContact CG-CB 3.79Å; V256-N260 VanDerWaalsContact CG1-ND2 3.35Å; V256-N260 WeakPolarHBondContact CG1-ND2 3.29Å; V256-N260 VanDerWaalsContact O-CB 3.26Å; V256-N260 WeakPolarHBondContact O-CB 3.41Å; V256-N260 PolarHBondContact O-N 3.15Å; V256-N260 PolarHBondContact O-ND2 3.06Å; N257-N260 PolarHBondContact O-N 2.75Å; D258-N260 VanDerWaalsContact C-N 3.34Å; D258-N260 PolarHBondContact O-N 3.21Å
261T88.1Confident87.7Confident13 Ų1333.9 Ų33.98%0.0818%0.184CC..Iπ-helixtrans-112.6-92.7-179.754.70000110.8N257 D258 M259 G265 Q347 W348 Q351N257-T261 WeakPolarHBondContact O-CB 3.44Å; N257-T261 WeakPolarHBondContact O-CG2 3.49Å; N257-T261 PolarHBondContact O-N 2.95Å; N257-T261 PolarHBondContact O-OG1 3.16Å; D258-T261 PolarHBondContact O-N 2.87Å; M259-T261 VanDerWaalsContact C-N 3.27Å; M259-T261 PolarHBondContact O-N 3.39Å; T261-G265 PolarHBondContact O-N 2.93Å; T261-Q347 HydrophobicContact CG2-CB 4Å; T261-W348 WeakPolarHBondContact OG1-CA 3.34Å; T261-Q351 HydrophobicContact CG2-CG 3.88Å
262L90.8Very high87.8Confident13 Ų1332.8 Ų32.87%0.06818%0.177CC..Iπ-helixtrans-68.7-35.3-177.4-176.759.1000112.2F197 D258 L264 G265 L266 C344 L345 W348F197-L262 HydrophobicContact CD2-CD2 3.9Å; F197-L262 HydrophobicContact CD2-CG 4.39Å; F197-L262 HydrophobicContact CE1-CB 4.19Å; F197-L262 HydrophobicContact CE2-CB 4.19Å; F197-L262 HydrophobicContact CE2-CD2 3.64Å; F197-L262 HydrophobicContact CE2-CG 4.15Å; F197-L262 HydrophobicContact CZ-CB 3.81Å; F197-L262 HydrophobicContact CZ-CD2 4.15Å; F197-L262 HydrophobicContact CZ-CG 4.2Å; D258-L262 PolarHBondContact O-N 3.49Å; L262-L264 PolarHBondContact O-N 3.4Å; L262-G265 PolarHBondContact O-N 3.43Å; L262-G265 VanDerWaalsContact O-N 3.16Å; L262-L266 HydrophobicContact CD1-CD1 4.16Å; L262-L266 HydrophobicContact CD1-CD2 4.28Å; L262-L266 HydrophobicContact CD1-CG 3.89Å; L262-L266 HydrophobicContact CD2-CD1 4.4Å; L262-L266 HydrophobicContact CG-CD1 3.84Å; L262-L266 HydrophobicContact CG-CG 4.06Å; L262-L266 WeakPolarHBondContact O-CG 3.5Å; L262-L266 PolarHBondContact O-N 3.33Å; L262-C344 HydrophobicContact CD1-CB 4.35Å; L262-L345 HydrophobicContact CD1-CD2 3.87Å; L262-L345 HydrophobicContact CD1-CG 4.21Å; L262-L345 HydrophobicContact CD2-CD2 3.98Å; L262-W348 HydrophobicContact CB-CB 3.81Å; L262-W348 HydrophobicContact CB-CD2 4.27Å; L262-W348 HydrophobicContact CB-CG 3.85Å; L262-W348 HydrophobicContact CD2-CD2 3.89Å; L262-W348 HydrophobicContact CD2-CE3 3.72Å; L262-W348 HydrophobicContact CD2-CG 4.36Å; L262-W348 HydrophobicContact CD2-CZ3 4.1Å
263G87.9Confident88Confident13 Ų1329.5 Ų29.513%0.13416%0.161CC..Iπ-helixtrans-57.8-51.1178.900000112.8D258 M259 G265 L266 D267D258-G263 PolarHBondContact O-N 2.89Å; M259-G263 CarbonylContact O-C 3.59Å; G263-G265 VanDerWaalsContact C-N 3.33Å; G263-G265 PolarHBondContact O-N 3.5Å; G263-L266 PolarHBondContact O-N 3.11Å; G263-D267 PolarHBondContact O-N 3.16Å
264L82.5Confident88.2Confident54 Ų5430.4 Ų30.428%0.28316%0.16SC..Hα-helixtrans-62-39.3174.1-77.7174.7000112.5P110 M259 L262 L268P110-L264 HydrophobicContact CB-CD1 3.37Å; M259-L264 WeakPolarHBondContact O-CG 3.44Å; M259-L264 PolarHBondContact O-N 3.47Å; L262-L264 PolarHBondContact O-N 3.4Å; L264-L268 VanDerWaalsContact O-CB 3.31Å; L264-L268 WeakPolarHBondContact O-CB 3.34Å; L264-L268 PolarHBondContact O-N 3.27Å
265G86.8Confident88.3Confident6 Ų630.7 Ų30.76%0.06216%0.164CC..Hα-helixtrans-62.2-42.5177.200000113.2T261 L262 G263 L268 D269 C344T261-G265 PolarHBondContact O-N 2.93Å; L262-G265 PolarHBondContact O-N 3.43Å; L262-G265 VanDerWaalsContact O-N 3.16Å; G263-G265 VanDerWaalsContact C-N 3.33Å; G263-G265 PolarHBondContact O-N 3.5Å; G265-L268 PolarHBondContact O-N 3.1Å; G265-D269 WeakPolarHBondContact O-CB 3.34Å; G265-D269 PolarHBondContact O-N 3.08Å; G265-C344 VanDerWaalsContact CA-SG 3.52Å
266L89.7Confident88.7Confident26 Ų2631.3 Ų31.314%0.13617%0.167CC..Hα-helixtrans-71-39.6178.5-69174.2000112.4A193 F197 L262 G263 L268 S270A193-L266 HydrophobicContact CB-CD2 4.43Å; F197-L266 HydrophobicContact CB-CD1 3.72Å; F197-L266 HydrophobicContact CD1-CD1 4.28Å; F197-L266 HydrophobicContact CG-CD1 3.93Å; L262-L266 HydrophobicContact CD1-CD1 4.16Å; L262-L266 HydrophobicContact CD1-CD2 4.28Å; L262-L266 HydrophobicContact CD1-CG 3.89Å; L262-L266 HydrophobicContact CD2-CD1 4.4Å; L262-L266 HydrophobicContact CG-CD1 3.84Å; L262-L266 HydrophobicContact CG-CG 4.06Å; L262-L266 WeakPolarHBondContact O-CG 3.5Å; L262-L266 PolarHBondContact O-N 3.33Å; G263-L266 PolarHBondContact O-N 3.11Å; L266-L268 VanDerWaalsContact C-N 3.34Å; L266-S270 WeakPolarHBondContact O-CB 3.37Å; L266-S270 PolarHBondContact O-N 3.23Å
267D86.1Confident89.2Confident61 Ų6132.1 Ų32.133%0.32617%0.166SC..Hα-helixtrans-61.2-45.5172.3176.571.4000110.5G263 S270 R271G263-D267 PolarHBondContact O-N 3.16Å; D267-S270 PolarHBondContact O-N 3.42Å; D267-R271 VanDerWaalsContact O-CG 3.28Å; D267-R271 WeakPolarHBondContact O-CG 3.29Å; D267-R271 PolarHBondContact O-N 2.99Å; D267-R271 IonicContact OD1-CZ 2.97Å; D267-R271 IonicContact OD1-NE 2.63Å; D267-R271 PolarHBondContact OD1-NE 3.36Å; D267-R271 IonicContact OD1-NH2 3.47Å; D267-R271 PolarHBondContact OD1-NH2 2.82Å; D267-R271 IonicContact OD2-CZ 2.73Å; D267-R271 IonicContact OD2-NE 3.72Å; D267-R271 PolarHBondContact OD2-NE 3.12Å; D267-R271 IonicContact OD2-NH2 2.88Å
268L86.6Confident89.4Confident37 Ų3733.1 Ų33.119%0.19417%0.169CC..Hα-helixtrans-63.3-47.1178.6-17558.1000111.8P78 L264 G265 L266 S270 R271 Y272 M340P78-L268 HydrophobicContact CG-CD1 3.94Å; L264-L268 VanDerWaalsContact O-CB 3.31Å; L264-L268 WeakPolarHBondContact O-CB 3.34Å; L264-L268 PolarHBondContact O-N 3.27Å; G265-L268 PolarHBondContact O-N 3.1Å; L266-L268 VanDerWaalsContact C-N 3.34Å; L268-S270 PolarHBondContact O-N 2.83Å; L268-R271 PolarHBondContact O-N 2.87Å; L268-Y272 HydrophobicContact CD1-CD2 3.98Å; L268-Y272 HydrophobicContact CD1-CE2 3.55Å; L268-Y272 HydrophobicContact CD2-CE2 4.29Å; L268-Y272 HydrophobicContact CG-CD2 3.97Å; L268-Y272 HydrophobicContact CG-CE2 3.71Å; L268-Y272 VanDerWaalsContact O-CD2 3.26Å; L268-Y272 WeakPolarHBondContact O-CD2 3.26Å; L268-Y272 PolarHBondContact O-N 3.24Å; L268-M340 HydrophobicContact CB-SD 4.39Å; L268-M340 HydrophobicContact CD2-SD 3.63Å; L268-M340 HydrophobicContact CG-SD 3.9Å
269D90.6Very high89.7Confident4 Ų433.1 Ų33.12%0.02117%0.169CC..Hα-helixtrans-57.5-49.3176.1-169.430.9000110.9T190 G265 R271 Y272 Q273 R337 M340T190-D269 WeakPolarHBondContact CG2-OD2 3.27Å; G265-D269 WeakPolarHBondContact O-CB 3.34Å; G265-D269 PolarHBondContact O-N 3.08Å; D269-R271 VanDerWaalsContact C-N 3.29Å; D269-R271 PolarHBondContact O-N 3.46Å; D269-Y272 WeakPolarHBondContact O-CB 3.5Å; D269-Y272 PolarHBondContact O-N 3.37Å; D269-Y272 VanDerWaalsContact O-N 3.09Å; D269-Q273 WeakPolarHBondContact O-CG 3.39Å; D269-Q273 PolarHBondContact O-N 3.43Å; D269-Q273 PolarHBondContact OD1-NE2 3.37Å; D269-R337 VanDerWaalsContact OD1-CD 3.28Å; D269-R337 WeakPolarHBondContact OD1-CD 3.5Å; D269-R337 WeakPolarHBondContact OD1-CG 3.39Å; D269-R337 IonicContact OD1-CZ 2.75Å; D269-R337 IonicContact OD1-NE 2.87Å; D269-R337 PolarHBondContact OD1-NE 3.13Å; D269-R337 IonicContact OD1-NH2 3.21Å; D269-R337 IonicContact OD2-CZ 3.62Å; D269-R337 IonicContact OD2-NE 2.91Å; D269-R337 PolarHBondContact OD2-NE 3.41Å; D269-R337 IonicContact OD2-NH2 3.5Å; D269-R337 PolarHBondContact OD2-NH2 3.44Å; D269-M340 HydrophobicContact CB-CE 3.66Å
270S90.4Very high90.1Very high21 Ų2129.8 Ų29.815%0.14715%0.153CC..Hα-helixtrans-58.7-39.4179.3-177.70000112.4L266 D267 L268 Q273 E274L266-S270 WeakPolarHBondContact O-CB 3.37Å; L266-S270 PolarHBondContact O-N 3.23Å; D267-S270 PolarHBondContact O-N 3.42Å; L268-S270 PolarHBondContact O-N 2.83Å; S270-Q273 PolarHBondContact O-N 3.16Å; S270-E274 PolarHBondContact O-N 2.9Å; S270-E274 VanDerWaalsContact O-N 3.13Å
271R90.1Very high90.5Very high75 Ų7528.7 Ų28.728%0.28315%0.146SC..Hα-helixtrans-67.8-36.9176.4-69.1170.5-177.3-81.7-30.6112.7P78 L79 D267 L268 D269 Q273 E274 A275P78-R271 HydrophobicContact CB-CB 3.5Å; P78-R271 VanDerWaalsContact CB-CB 3.5Å; P78-R271 HydrophobicContact CB-CG 4.42Å; P78-R271 HydrophobicContact CG-CB 3.86Å; L79-R271 PolarHBondContact O-NH1 2.91Å; D267-R271 VanDerWaalsContact O-CG 3.28Å; D267-R271 WeakPolarHBondContact O-CG 3.29Å; D267-R271 PolarHBondContact O-N 2.99Å; D267-R271 IonicContact OD1-CZ 2.97Å; D267-R271 IonicContact OD1-NE 2.63Å; D267-R271 PolarHBondContact OD1-NE 3.36Å; D267-R271 IonicContact OD1-NH2 3.47Å; D267-R271 PolarHBondContact OD1-NH2 2.82Å; D267-R271 IonicContact OD2-CZ 2.73Å; D267-R271 IonicContact OD2-NE 3.72Å; D267-R271 PolarHBondContact OD2-NE 3.12Å; D267-R271 IonicContact OD2-NH2 2.88Å; L268-R271 PolarHBondContact O-N 2.87Å; D269-R271 VanDerWaalsContact C-N 3.29Å; D269-R271 PolarHBondContact O-N 3.46Å; R271-Q273 VanDerWaalsContact C-N 3.34Å; R271-E274 PolarHBondContact O-N 3.4Å; R271-A275 WeakPolarHBondContact O-CB 3.33Å; R271-A275 PolarHBondContact O-N 3.44Å
272Y93.1Very high90.7Very high21 Ų2128.5 Ų28.58%0.08214%0.143CC..Hα-helixtrans-64.2-40.7173.1-86.5-68000112P78 Q121 L268 D269 E274 A275 E276 L333P78-Y272 HydrophobicContact CG-CD1 3.98Å; P78-Y272 HydrophobicContact CG-CD2 3.91Å; P78-Y272 HydrophobicContact CG-CE1 3.93Å; P78-Y272 HydrophobicContact CG-CE2 3.85Å; P78-Y272 HydrophobicContact CG-CG 3.96Å; Q121-Y272 PolarHBondContact NE2-OH 2.89Å; Q121-Y272 PolarHBondContact OE1-OH 3.37Å; L268-Y272 HydrophobicContact CD1-CD2 3.98Å; L268-Y272 HydrophobicContact CD1-CE2 3.55Å; L268-Y272 HydrophobicContact CD2-CE2 4.29Å; L268-Y272 HydrophobicContact CG-CD2 3.97Å; L268-Y272 HydrophobicContact CG-CE2 3.71Å; L268-Y272 VanDerWaalsContact O-CD2 3.26Å; L268-Y272 WeakPolarHBondContact O-CD2 3.26Å; L268-Y272 PolarHBondContact O-N 3.24Å; D269-Y272 WeakPolarHBondContact O-CB 3.5Å; D269-Y272 PolarHBondContact O-N 3.37Å; D269-Y272 VanDerWaalsContact O-N 3.09Å; Y272-E274 VanDerWaalsContact C-N 3.31Å; Y272-E274 PolarHBondContact O-N 3.3Å; Y272-A275 PolarHBondContact O-N 3.22Å; Y272-A275 VanDerWaalsContact O-N 3.12Å; Y272-E276 PolarHBondContact O-N 3.01Å; Y272-L333 HydrophobicContact CD1-CD1 3.63Å; Y272-L333 HydrophobicContact CE1-CD1 4.28Å; Y272-L333 HydrophobicContact CG-CD1 3.8Å
273Q92.6Very high90.8Very high2 Ų228 Ų281%0.00914%0.14CC..Hα-helixtrans-59.6-42.4175.5-62.7-49.6-55.100111.5N183 L186 T190 D269 S270 R271 K277N183-Q273 PolarHBondContact ND2-O 3.41Å; N183-Q273 PolarHBondContact ND2-OE1 3.19Å; L186-Q273 VanDerWaalsContact CD2-OE1 3.23Å; L186-Q273 HydrophobicContact CG-CG 4.41Å; T190-Q273 HydrophobicContact CG2-CG 4.02Å; D269-Q273 WeakPolarHBondContact O-CG 3.39Å; D269-Q273 PolarHBondContact O-N 3.43Å; D269-Q273 PolarHBondContact OD1-NE2 3.37Å; S270-Q273 PolarHBondContact O-N 3.16Å; R271-Q273 VanDerWaalsContact C-N 3.34Å; Q273-K277 WeakPolarHBondContact O-CB 3.36Å; Q273-K277 PolarHBondContact O-N 3.45Å
274E91.4Very high91Very high62 Ų6227.3 Ų27.329%0.2913%0.134SC..Hα-helixtrans-67.7-36173.6-65.7-65164.600112.8T187 R191 S270 R271 Y272 K277 E278T187-E274 HydrophobicContact CG2-CG 4.46Å; T187-E274 WeakPolarHBondContact CG2-OE1 3.47Å; R191-E274 IonicContact CZ-OE1 3.77Å; R191-E274 IonicContact NH2-OE1 3.88Å; R191-E274 PolarHBondContact NH2-OE1 2.98Å; S270-E274 PolarHBondContact O-N 2.9Å; S270-E274 VanDerWaalsContact O-N 3.13Å; R271-E274 PolarHBondContact O-N 3.4Å; Y272-E274 VanDerWaalsContact C-N 3.31Å; Y272-E274 PolarHBondContact O-N 3.3Å; E274-K277 WeakPolarHBondContact O-CB 3.35Å; E274-K277 PolarHBondContact O-N 2.97Å; E274-K277 IonicContact OE2-NZ 3.22Å; E274-K277 PolarHBondContact OE2-NZ 3.47Å; E274-E278 VanDerWaalsContact O-CB 3.24Å; E274-E278 WeakPolarHBondContact O-CB 3.36Å; E274-E278 PolarHBondContact O-N 3.49Å
275A93.8Very high91.4Very high18 Ų1825.6 Ų25.615%0.14913%0.126CC..Hα-helixtrans-66.7-39.7177.200000112.3I75 R271 Y272 M279I75-A275 HydrophobicContact CG2-CB 3.92Å; R271-A275 WeakPolarHBondContact O-CB 3.33Å; R271-A275 PolarHBondContact O-N 3.44Å; Y272-A275 PolarHBondContact O-N 3.22Å; Y272-A275 VanDerWaalsContact O-N 3.12Å; A275-M279 WeakPolarHBondContact O-CB 3.39Å; A275-M279 PolarHBondContact O-N 3.46Å
276E95.7Very high91.6Very high13 Ų1326.5 Ų26.56%0.06113%0.128CC..Hα-helixtrans-64.4-48.4172.7178.4179.9-152.700111I75 N183 Y272 E278 M279 L280 L333I75-E276 HydrophobicContact CD1-CB 3.99Å; I75-E276 HydrophobicContact CD1-CG 3.96Å; N183-E276 PolarHBondContact ND2-OE2 2.96Å; Y272-E276 PolarHBondContact O-N 3.01Å; E276-E278 VanDerWaalsContact C-N 3.26Å; E276-E278 PolarHBondContact O-N 2.92Å; E276-M279 WeakPolarHBondContact O-CB 3.23Å; E276-M279 PolarHBondContact O-N 3.03Å; E276-M279 VanDerWaalsContact O-N 3.1Å; E276-L280 HydrophobicContact CG-CD1 4.02Å; E276-L280 HydrophobicContact CG-CG 4.4Å; E276-L280 WeakPolarHBondContact O-CG 3.49Å; E276-L280 PolarHBondContact O-N 3.12Å; E276-L333 HydrophobicContact CB-CD2 3.99Å; E276-L333 HydrophobicContact CG-CD2 4.45Å
277K92.9Very high91.7Very high80 Ų8025.5 Ų25.535%0.34812%0.123SC..Hα-helixtrans-54-44.9175.7-173178.4165.6-166.50112.2N183 Q273 E274 L280 F281N183-K277 WeakPolarHBondContact OD1-CB 3.5Å; Q273-K277 WeakPolarHBondContact O-CB 3.36Å; Q273-K277 PolarHBondContact O-N 3.45Å; E274-K277 WeakPolarHBondContact O-CB 3.35Å; E274-K277 PolarHBondContact O-N 2.97Å; E274-K277 IonicContact OE2-NZ 3.22Å; E274-K277 PolarHBondContact OE2-NZ 3.47Å; K277-L280 PolarHBondContact O-N 2.91Å; K277-F281 WeakPolarHBondContact O-CB 3.23Å; K277-F281 PolarHBondContact O-N 3.5Å
278E92Very high91.9Very high51 Ų5123.8 Ų23.824%0.23812%0.115CC..Hα-helixtrans-65-41.8177.5177.666.1-177.300111.9F154 L157 E274 E276 F281 R282F154-E278 HydrophobicContact CE1-CG 4.36Å; F154-E278 VanDerWaalsContact CE1-OE1 3.23Å; F154-E278 WeakPolarHBondContact CE1-OE1 3.29Å; L157-E278 WeakPolarHBondContact CD1-OE1 3.36Å; L157-E278 VanDerWaalsContact CD2-CD 3.44Å; L157-E278 WeakPolarHBondContact CD2-OE1 3.29Å; L157-E278 WeakPolarHBondContact CD2-OE2 3.45Å; E274-E278 VanDerWaalsContact O-CB 3.24Å; E274-E278 WeakPolarHBondContact O-CB 3.36Å; E274-E278 PolarHBondContact O-N 3.49Å; E276-E278 VanDerWaalsContact C-N 3.26Å; E276-E278 PolarHBondContact O-N 2.92Å; E278-F281 PolarHBondContact O-N 3.31Å; E278-R282 WeakPolarHBondContact O-CG 3.33Å; E278-R282 PolarHBondContact O-N 3.46Å
279M95.3Very high92.1Very high0 Ų025.8 Ų25.80%012%0.123CC..Hα-helixtrans-62.1-47.9173.4-179-75.2-67.700111.5G73 I75 A275 E276 F281 R282 R283 A326 I330G73-M279 WeakPolarHBondContact O-CG 3.3Å; I75-M279 HydrophobicContact CD1-CE 4.02Å; I75-M279 HydrophobicContact CG1-CB 4.07Å; I75-M279 HydrophobicContact CG1-CE 3.79Å; I75-M279 HydrophobicContact CG1-CG 4.08Å; A275-M279 WeakPolarHBondContact O-CB 3.39Å; A275-M279 PolarHBondContact O-N 3.46Å; E276-M279 WeakPolarHBondContact O-CB 3.23Å; E276-M279 PolarHBondContact O-N 3.03Å; E276-M279 VanDerWaalsContact O-N 3.1Å; M279-F281 PolarHBondContact O-N 3.27Å; M279-R282 PolarHBondContact O-N 3.43Å; M279-R282 VanDerWaalsContact O-N 3.13Å; M279-R283 PolarHBondContact O-N 2.92Å; M279-A326 HydrophobicContact CE-CB 3.92Å; M279-A326 HydrophobicContact SD-CB 3.53Å; M279-A326 VanDerWaalsContact SD-CB 3.53Å; M279-I330 HydrophobicContact CE-CD1 3.95Å; M279-I330 HydrophobicContact CE-CG1 3.88Å
280L94.2Very high92.2Very high3 Ų325.8 Ų25.82%0.01612%0.123CC..Hα-helixtrans-59.1-36176.7-70.4169.6000111.3F176 R180 N183 E276 K277 I284 I330F176-L280 HydrophobicContact CD1-CD2 3.96Å; R180-L280 HydrophobicContact CG-CB 3.86Å; R180-L280 HydrophobicContact CG-CD1 3.8Å; R180-L280 HydrophobicContact CG-CD2 4.2Å; R180-L280 HydrophobicContact CG-CG 4.17Å; R180-L280 PolarHBondContact NH1-O 2.97Å; N183-L280 HydrophobicContact CB-CD1 4.18Å; E276-L280 HydrophobicContact CG-CD1 4.02Å; E276-L280 HydrophobicContact CG-CG 4.4Å; E276-L280 WeakPolarHBondContact O-CG 3.49Å; E276-L280 PolarHBondContact O-N 3.12Å; K277-L280 PolarHBondContact O-N 2.91Å; L280-I284 WeakPolarHBondContact O-CG1 3.44Å; L280-I284 PolarHBondContact O-N 3.49Å; L280-I330 HydrophobicContact CD2-CD1 4.12Å
281F90.8Very high92.3Very high30 Ų3026.9 Ų26.913%0.13213%0.126CC..Hα-helixtrans-66-50.8173-177.4-87.3000112.2L157 A160 V161 M164 K277 E278 M279 R283 I284 C285L157-F281 HydrophobicContact CB-CE1 4.29Å; L157-F281 HydrophobicContact CD2-CD1 3.1Å; L157-F281 HydrophobicContact CD2-CE1 3.33Å; L157-F281 HydrophobicContact CD2-CG 4.13Å; L157-F281 HydrophobicContact CG-CD1 3.73Å; L157-F281 HydrophobicContact CG-CE1 3.7Å; A160-F281 HydrophobicContact CB-CE1 4.38Å; A160-F281 HydrophobicContact CB-CZ 4.33Å; V161-F281 HydrophobicContact CB-CZ 4.08Å; V161-F281 HydrophobicContact CG2-CE1 3.75Å; V161-F281 HydrophobicContact CG2-CE2 3.79Å; V161-F281 HydrophobicContact CG2-CZ 3.23Å; M164-F281 HydrophobicContact CB-CE2 4.44Å; M164-F281 HydrophobicContact CE-CE2 4.48Å; M164-F281 HydrophobicContact CG-CE2 4.46Å; M164-F281 HydrophobicContact SD-CD2 4.06Å; M164-F281 HydrophobicContact SD-CE2 3.43Å; M164-F281 WeakPolarHBondContact SD-CE2 3.36Å; M164-F281 HydrophobicContact SD-CZ 3.86Å; K277-F281 WeakPolarHBondContact O-CB 3.23Å; K277-F281 PolarHBondContact O-N 3.5Å; E278-F281 PolarHBondContact O-N 3.31Å; M279-F281 PolarHBondContact O-N 3.27Å; F281-R283 PolarHBondContact O-N 3.39Å; F281-I284 PolarHBondContact O-N 3.09Å; F281-C285 WeakPolarHBondContact CE1-SG 3.23Å; F281-C285 PolarHBondContact O-N 3.37Å; F281-C285 PolarHBondContact O-SG 3.02Å; F281-C285 VanDerWaalsContact O-SG 3.33Å
282R91.4Very high92.4Very high8 Ų826.8 Ų26.83%0.0313%0.131CC..Hα-helixtrans-55.6-40177.2-73.1-178.4-63.4135.4-5.2112.1I71 V74 F76 I153 L157 E278 M279 C285 K286I71-R282 PolarHBondContact O-NH1 3.22Å; V74-R282 PolarHBondContact O-NH2 3.13Å; F76-R282 VanDerWaalsContact CE2-NH1 3.31Å; I153-R282 HydrophobicContact CG2-CG 4.48Å; L157-R282 HydrophobicContact CD1-CG 3.42Å; L157-R282 VanDerWaalsContact CD1-CG 3.42Å; L157-R282 HydrophobicContact CG-CG 4.1Å; E278-R282 WeakPolarHBondContact O-CG 3.33Å; E278-R282 PolarHBondContact O-N 3.46Å; M279-R282 PolarHBondContact O-N 3.43Å; M279-R282 VanDerWaalsContact O-N 3.13Å; R282-C285 WeakPolarHBondContact O-CB 3.42Å; R282-C285 PolarHBondContact O-N 2.98Å; R282-K286 PolarHBondContact O-N 3.46Å
283R93.8Very high92.5Very high2 Ų226.3 Ų26.31%0.00813%0.131CC..Hα-helixtrans-61.4-43.9174.4-175.6-179.6161.1-74.6-3.3111.8D171 F176 M279 F281 C285 K286 L287 F319 I322 C323D171-R283 VanDerWaalsContact CG-NH1 3.26Å; D171-R283 IonicContact OD1-CZ 3Å; D171-R283 IonicContact OD1-NH1 2.97Å; D171-R283 PolarHBondContact OD1-NH1 2.69Å; D171-R283 IonicContact OD1-NH2 3.87Å; D171-R283 PolarHBondContact OD1-NH2 3.43Å; D171-R283 IonicContact OD2-CZ 3.67Å; D171-R283 IonicContact OD2-NH1 3.05Å; D171-R283 PolarHBondContact OD2-NH1 3.46Å; F176-R283 VanDerWaalsContact CE2-NH2 3.28Å; F176-R283 VanDerWaalsContact CG-NH1 3.34Å; M279-R283 PolarHBondContact O-N 2.92Å; F281-R283 PolarHBondContact O-N 3.39Å; R283-C285 VanDerWaalsContact C-N 3.35Å; R283-C285 PolarHBondContact O-N 2.86Å; R283-K286 WeakPolarHBondContact O-CB 3.41Å; R283-K286 PolarHBondContact O-N 3.29Å; R283-K286 VanDerWaalsContact O-N 3.14Å; R283-L287 PolarHBondContact O-N 3.05Å; R283-F319 HydrophobicContact CG-CE2 4.02Å; R283-I322 HydrophobicContact CB-CG2 4.27Å; R283-I322 HydrophobicContact CG-CG2 3.97Å; R283-C323 PolarHBondContact NE-SG 2.77Å; R283-C323 PolarHBondContact NH2-SG 2.72Å
284I91.6Very high92.6Very high0 Ų031 Ų310%015%0.149CC..Hα-helixtrans-64.8-38.5176.6-63.2-159.2000111.9M164 H169 D171 L280 F281 K286 L287 V288M164-I284 HydrophobicContact CE-CB 3.93Å; M164-I284 HydrophobicContact CE-CD1 4.23Å; M164-I284 HydrophobicContact CE-CG2 3.23Å; M164-I284 HydrophobicContact SD-CB 4.14Å; M164-I284 HydrophobicContact SD-CG2 3.68Å; H169-I284 HydrophobicContact CB-CG2 4.44Å; D171-I284 HydrophobicContact CB-CD1 4.42Å; L280-I284 WeakPolarHBondContact O-CG1 3.44Å; L280-I284 PolarHBondContact O-N 3.49Å; F281-I284 PolarHBondContact O-N 3.09Å; I284-K286 PolarHBondContact O-N 2.9Å; I284-L287 WeakPolarHBondContact O-CA 3.45Å; I284-L287 WeakPolarHBondContact O-CB 3.38Å; I284-L287 PolarHBondContact O-N 3.24Å; I284-V288 HydrophobicContact CG2-CG2 4.33Å; I284-V288 PolarHBondContact O-N 2.89Å
285C89.8Confident92.7Very high17 Ų1732.6 Ų32.612%0.11516%0.155CC..Hα-helixtrans-55.1-41.4173.7-56.20000111.3A160 F281 R282 R283 V288 E289A160-C285 HydrophobicContact CB-CB 4.13Å; A160-C285 WeakPolarHBondContact CB-SG 3.4Å; F281-C285 WeakPolarHBondContact CE1-SG 3.23Å; F281-C285 PolarHBondContact O-N 3.37Å; F281-C285 PolarHBondContact O-SG 3.02Å; F281-C285 VanDerWaalsContact O-SG 3.33Å; R282-C285 WeakPolarHBondContact O-CB 3.42Å; R282-C285 PolarHBondContact O-N 2.98Å; R283-C285 VanDerWaalsContact C-N 3.35Å; R283-C285 PolarHBondContact O-N 2.86Å; C285-V288 PolarHBondContact O-N 3.09Å; C285-E289 WeakPolarHBondContact O-CG 3.26Å; C285-E289 PolarHBondContact O-N 3.37Å
286K91.8Very high92.8Very high25 Ų2536.2 Ų36.211%0.10917%0.172CC..Hα-helixtrans-69.7-31.8176.8-72.6-79.4170.2-173.70113.5Q72 R282 R283 I284 E289 L290 E318 F319 I322Q72-K286 HydrophobicContact CG-CG 4.46Å; R282-K286 PolarHBondContact O-N 3.46Å; R283-K286 WeakPolarHBondContact O-CB 3.41Å; R283-K286 PolarHBondContact O-N 3.29Å; R283-K286 VanDerWaalsContact O-N 3.14Å; I284-K286 PolarHBondContact O-N 2.9Å; K286-E289 WeakPolarHBondContact CD-OE2 3.43Å; K286-E289 WeakPolarHBondContact CE-OE2 3.37Å; K286-E289 IonicContact NZ-OE2 3.75Å; K286-E289 PolarHBondContact NZ-OE2 3.13Å; K286-E289 PolarHBondContact O-N 3.09Å; K286-L290 WeakPolarHBondContact O-CB 3.32Å; K286-L290 PolarHBondContact O-N 3.42Å; K286-E318 WeakPolarHBondContact CE-OE1 3.46Å; K286-E318 IonicContact NZ-OE1 2.61Å; K286-E318 PolarHBondContact NZ-OE1 3.3Å; K286-E318 IonicContact NZ-OE2 3.36Å; K286-E318 PolarHBondContact NZ-OE2 2.91Å; K286-F319 HydrophobicContact CB-CD2 4.03Å; K286-I322 HydrophobicContact CB-CD1 4.07Å; K286-I322 HydrophobicContact CD-CD1 3.93Å; K286-I322 HydrophobicContact CG-CD1 3.77Å
287L92.4Very high92.7Very high6 Ų635.7 Ų35.73%0.03117%0.169CC..Hα-helixtrans-62.6-45.4170177.459.7000111V172 R283 I284 L290 E291 F319V172-L287 HydrophobicContact CG2-CD1 4.25Å; V172-L287 HydrophobicContact CG2-CD2 4.18Å; R283-L287 PolarHBondContact O-N 3.05Å; I284-L287 WeakPolarHBondContact O-CA 3.45Å; I284-L287 WeakPolarHBondContact O-CB 3.38Å; I284-L287 PolarHBondContact O-N 3.24Å; L287-L290 WeakPolarHBondContact O-CB 3.28Å; L287-L290 PolarHBondContact O-N 3.34Å; L287-E291 HydrophobicContact CD1-CG 4.41Å; L287-E291 WeakPolarHBondContact O-CG 3.32Å; L287-E291 PolarHBondContact O-N 3.1Å; L287-F319 HydrophobicContact CB-CD2 4.45Å; L287-F319 HydrophobicContact CB-CE2 3.58Å; L287-F319 HydrophobicContact CB-CZ 3.71Å; L287-F319 HydrophobicContact CD1-CE1 3.91Å; L287-F319 HydrophobicContact CD1-CE2 4.3Å; L287-F319 HydrophobicContact CD1-CZ 3.67Å; L287-F319 HydrophobicContact CG-CE2 4.5Å; L287-F319 HydrophobicContact CG-CZ 4.16Å
288V90.3Very high92.8Very high24 Ų2438.6 Ų38.615%0.14519%0.185CC..Hα-helixtrans-63.8-42.3178.1174.50000111.2I284 C285 L290 E291 N292I284-V288 HydrophobicContact CG2-CG2 4.33Å; I284-V288 PolarHBondContact O-N 2.89Å; C285-V288 PolarHBondContact O-N 3.09Å; V288-L290 VanDerWaalsContact C-N 3.31Å; V288-L290 PolarHBondContact O-N 2.97Å; V288-E291 PolarHBondContact O-N 3.41Å; V288-N292 WeakPolarHBondContact O-CB 3.42Å; V288-N292 VanDerWaalsContact O-CG 3.31Å; V288-N292 PolarHBondContact O-N 2.89Å; V288-N292 PolarHBondContact O-ND2 3.27Å
289E90.7Very high93Very high80 Ų8044.2 Ų44.237%0.37421%0.208SC..Hα-helixtrans-56.9-44.7172.7-73.6179-169.600111.5C285 K286 N292 A293C285-E289 WeakPolarHBondContact O-CG 3.26Å; C285-E289 PolarHBondContact O-N 3.37Å; K286-E289 WeakPolarHBondContact CD-OE2 3.43Å; K286-E289 WeakPolarHBondContact CE-OE2 3.37Å; K286-E289 IonicContact NZ-OE2 3.75Å; K286-E289 PolarHBondContact NZ-OE2 3.13Å; K286-E289 PolarHBondContact O-N 3.09Å; E289-N292 PolarHBondContact O-N 3.28Å; E289-A293 WeakPolarHBondContact O-CB 3.33Å; E289-A293 PolarHBondContact O-N 3.24Å
290L93.2Very high93Very high3 Ų345.3 Ų45.32%0.01622%0.217CC..Hα-helixtrans-62.5-47.1176.216860.5000112.3K286 L287 V288 N292 A293 R294 A315 E316 F319K286-L290 WeakPolarHBondContact O-CB 3.32Å; K286-L290 PolarHBondContact O-N 3.42Å; L287-L290 WeakPolarHBondContact O-CB 3.28Å; L287-L290 PolarHBondContact O-N 3.34Å; V288-L290 VanDerWaalsContact C-N 3.31Å; V288-L290 PolarHBondContact O-N 2.97Å; L290-N292 VanDerWaalsContact C-N 3.28Å; L290-N292 PolarHBondContact O-N 3.27Å; L290-A293 PolarHBondContact O-N 3.31Å; L290-R294 HydrophobicContact CD1-CG 4.17Å; L290-R294 WeakPolarHBondContact O-CG 3.42Å; L290-R294 PolarHBondContact O-N 2.95Å; L290-A315 HydrophobicContact CD1-CB 4.11Å; L290-E316 HydrophobicContact CD1-CB 4.29Å; L290-E316 HydrophobicContact CD1-CG 3.35Å; L290-F319 HydrophobicContact CD2-CB 3.94Å; L290-F319 HydrophobicContact CD2-CD1 3.55Å; L290-F319 HydrophobicContact CD2-CE1 4.25Å; L290-F319 HydrophobicContact CD2-CG 3.82Å
291E92.4Very high93Very high45 Ų4553 Ų5321%0.2125%0.25CS..Hα-helixtrans-60.9-39.5177.9-72.9-178.8174.300111.9L287 V288 R294 K295L287-E291 HydrophobicContact CD1-CG 4.41Å; L287-E291 WeakPolarHBondContact O-CG 3.32Å; L287-E291 PolarHBondContact O-N 3.1Å; V288-E291 PolarHBondContact O-N 3.41Å; E291-R294 PolarHBondContact O-N 3.4Å; E291-K295 WeakPolarHBondContact O-CG 3.43Å; E291-K295 PolarHBondContact O-N 2.88Å
292N91.8Very high93.1Very high73 Ų7357.3 Ų57.339%0.3928%0.282SS..Hα-helixtrans-66.3-42.7174.9-73.8-26.8000111.7V288 E289 L290 R294 K295 N296V288-N292 WeakPolarHBondContact O-CB 3.42Å; V288-N292 VanDerWaalsContact O-CG 3.31Å; V288-N292 PolarHBondContact O-N 2.89Å; V288-N292 PolarHBondContact O-ND2 3.27Å; E289-N292 PolarHBondContact O-N 3.28Å; L290-N292 VanDerWaalsContact C-N 3.28Å; L290-N292 PolarHBondContact O-N 3.27Å; N292-R294 VanDerWaalsContact C-N 3.31Å; N292-R294 PolarHBondContact O-N 2.92Å; N292-K295 PolarHBondContact O-N 2.76Å; N292-N296 VanDerWaalsContact O-CB 3.3Å; N292-N296 WeakPolarHBondContact O-CB 3.34Å; N292-N296 PolarHBondContact O-N 2.82Å; N292-N296 PolarHBondContact O-ND2 3.2Å
293A94.3Very high93.2Very high11 Ų1163.9 Ų63.99%0.09132%0.322CS..Hα-helixtrans-60.4-41.2174.800000111.7E289 L290 N296 A297 V311 A315E289-A293 WeakPolarHBondContact O-CB 3.33Å; E289-A293 PolarHBondContact O-N 3.24Å; L290-A293 PolarHBondContact O-N 3.31Å; A293-N296 PolarHBondContact O-N 3.06Å; A293-A297 WeakPolarHBondContact O-CB 3.37Å; A293-A297 PolarHBondContact O-N 2.99Å; A293-V311 HydrophobicContact CB-CG1 4.49Å; A293-A315 HydrophobicContact CB-CB 4.12Å
294R94.9Very high93.2Very high99 Ų9970.3 Ų70.337%0.37435%0.35SS..Hα-helixtrans-61.3-52.5174.6-74175.6171.8166.61112.2L290 E291 N292 N296 A297 E298 K312 E316L290-R294 HydrophobicContact CD1-CG 4.17Å; L290-R294 WeakPolarHBondContact O-CG 3.42Å; L290-R294 PolarHBondContact O-N 2.95Å; E291-R294 PolarHBondContact O-N 3.4Å; N292-R294 VanDerWaalsContact C-N 3.31Å; N292-R294 PolarHBondContact O-N 2.92Å; R294-N296 VanDerWaalsContact C-N 3.28Å; R294-N296 PolarHBondContact O-N 3.35Å; R294-A297 PolarHBondContact O-N 3.38Å; R294-E298 WeakPolarHBondContact O-CG 3.47Å; R294-E298 PolarHBondContact O-N 2.95Å; R294-K312 HydrophobicContact CG-CD 4.04Å; R294-K312 HydrophobicContact CG-CG 3.93Å; R294-E316 IonicContact CZ-OE1 3.57Å; R294-E316 IonicContact NE-OE1 2.7Å; R294-E316 PolarHBondContact NE-OE1 3.47Å; R294-E316 IonicContact NH2-OE1 2.78Å; R294-E316 PolarHBondContact NH2-OE1 3.41Å
295K94.9Very high93.3Very high97 Ų9773.4 Ų73.442%0.42236%0.363SS..Hα-helixtrans-57.6-40.7177-72.4169.7-175.1165.70111.9E291 N292 E298 K299E291-K295 WeakPolarHBondContact O-CG 3.43Å; E291-K295 PolarHBondContact O-N 2.88Å; N292-K295 PolarHBondContact O-N 2.76Å; K295-E298 PolarHBondContact O-N 3.38Å; K295-K299 WeakPolarHBondContact O-CB 3.28Å; K295-K299 WeakPolarHBondContact O-CG 3.42Å; K295-K299 PolarHBondContact O-N 3.44Å; K295-K299 VanDerWaalsContact O-N 3.09Å
296N94.3Very high93.5Very high94 Ų9478.8 Ų78.850%0.50339%0.391SS..Hα-helixtrans-68-40.8179.1-73.2-20.6000112.1N292 A293 R294 K299 A300N292-N296 VanDerWaalsContact O-CB 3.3Å; N292-N296 WeakPolarHBondContact O-CB 3.34Å; N292-N296 PolarHBondContact O-N 2.82Å; N292-N296 PolarHBondContact O-ND2 3.2Å; A293-N296 PolarHBondContact O-N 3.06Å; R294-N296 VanDerWaalsContact C-N 3.28Å; R294-N296 PolarHBondContact O-N 3.35Å; N296-K299 PolarHBondContact O-N 3.47Å; N296-A300 WeakPolarHBondContact O-CB 3.34Å; N296-A300 PolarHBondContact O-N 2.93Å
297A94.9Very high93.6Very high1 Ų180 Ų801%0.00841%0.406CS..Hα-helixtrans-63.3-43.2174.300000111.8A293 R294 K299 A300 K305 M308 K312A293-A297 WeakPolarHBondContact O-CB 3.37Å; A293-A297 PolarHBondContact O-N 2.99Å; R294-A297 PolarHBondContact O-N 3.38Å; A297-K299 PolarHBondContact O-N 2.94Å; A297-A300 WeakPolarHBondContact O-CB 3.44Å; A297-A300 PolarHBondContact O-N 3.26Å; A297-K305 PolarHBondContact O-NZ 2.98Å; A297-M308 HydrophobicContact CB-CB 4.19Å; A297-K312 HydrophobicContact CB-CB 4.12Å; A297-K312 HydrophobicContact CB-CD 4.03Å
298E94.9Very high93.7Very high142 Ų14282.8 Ų82.866%0.66442%0.42SS*.Hα-helixtrans-60.3-42.7176.5-73.7170.6-174.700112.6R294 K295 A300R294-E298 WeakPolarHBondContact O-CG 3.47Å; R294-E298 PolarHBondContact O-N 2.95Å; K295-E298 PolarHBondContact O-N 3.38Å; E298-A300 VanDerWaalsContact C-N 3.35Å
299K95.6Very high94Very high168 Ų16884.7 Ų84.773%0.7343%0.427SS*.Hα-helixtrans-85.5-2.8-178.1-65.5176.2-177.7177.90114.1K295 N296 A297 K301K295-K299 WeakPolarHBondContact O-CB 3.28Å; K295-K299 WeakPolarHBondContact O-CG 3.42Å; K295-K299 PolarHBondContact O-N 3.44Å; K295-K299 VanDerWaalsContact O-N 3.09Å; N296-K299 PolarHBondContact O-N 3.47Å; A297-K299 PolarHBondContact O-N 2.94Å; K299-K301 PolarHBondContact O-N 3.1Å
300A94.8Very high94.2Very high23 Ų2387.7 Ų87.719%0.1944%0.441CS..  trans-67.4132.2-174.600000112.1N296 A297 E298 K305 M308N296-A300 WeakPolarHBondContact O-CB 3.34Å; N296-A300 PolarHBondContact O-N 2.93Å; A297-A300 WeakPolarHBondContact O-CB 3.44Å; A297-A300 PolarHBondContact O-N 3.26Å; E298-A300 VanDerWaalsContact C-N 3.35Å; A300-K305 HydrophobicContact CB-CD 4.21Å; A300-M308 HydrophobicContact CB-CB 4Å; A300-M308 HydrophobicContact CB-CG 3.89Å
301K95Very high94.3Very high165 Ų16591.4 Ų91.472%0.71746%0.464SS*.  trans-60.9153.5170.9-65-176-179.9-177.40110.5K299 V303 K304 K305K299-K301 PolarHBondContact O-N 3.1Å; K301-V303 PolarHBondContact O-N 2.94Å; K301-K304 PolarHBondContact O-N 3.01Å; K301-K305 PolarHBondContact O-N 3.33Å
302P93.6Very high94.5Very high121 Ų12191.6 Ų91.679%0.78646%0.464SS*.Hα-helixtrans-49-41.5-175.9-30.135.2000114.5K304 K305P302-K304 VanDerWaalsContact C-N 3.29Å; P302-K304 PolarHBondContact O-N 3.36Å; P302-K305 WeakPolarHBondContact O-CB 3.49Å; P302-K305 PolarHBondContact O-N 3.37Å
303V92.9Very high94.8Very high145 Ų14595.6 Ų95.688%0.87948%0.478SS*.Hα-helixtrans-62.8-31.3-179.7-1770000113.3K301K301-V303 PolarHBondContact O-N 2.94Å
304K93Very high94.8Very high138 Ų13898.2 Ų98.260%0.650%0.499SS*.Hα-helixtrans-104.80.2-179.8-65.8-170.6177.3-173.20113.1K301 P302 N306 A307 M308K301-K304 PolarHBondContact O-N 3.01Å; P302-K304 VanDerWaalsContact C-N 3.29Å; P302-K304 PolarHBondContact O-N 3.36Å; K304-N306 PolarHBondContact O-N 3.34Å; K304-A307 PolarHBondContact O-N 2.96Å; K304-M308 WeakPolarHBondContact O-CG 3.41Å; K304-M308 PolarHBondContact O-N 3.46Å; K304-M308 VanDerWaalsContact O-N 3.09Å
305K93.9Very high94.8Very high64 Ų6494.4 Ų94.428%0.27849%0.489SS..Hα-helixtrans-60.8-49.6-171.3-176.264.8-179167.20111.6A297 A300 K301 P302 A307 M308 E309A297-K305 PolarHBondContact O-NZ 2.98Å; A300-K305 HydrophobicContact CB-CD 4.21Å; K301-K305 PolarHBondContact O-N 3.33Å; P302-K305 WeakPolarHBondContact O-CB 3.49Å; P302-K305 PolarHBondContact O-N 3.37Å; K305-A307 PolarHBondContact O-N 3.4Å; K305-M308 PolarHBondContact O-N 2.67Å; K305-E309 VanDerWaalsContact CE-OE1 3.24Å; K305-E309 WeakPolarHBondContact CE-OE1 3.29Å; K305-E309 IonicContact NZ-OE1 3.81Å; K305-E309 PolarHBondContact NZ-OE1 2.96Å; K305-E309 WeakPolarHBondContact O-CG 3.46Å; K305-E309 PolarHBondContact O-N 3Å
306N93.8Very high94.9Very high130 Ų13092.6 Ų92.670%0.69548%0.482SS*.Hα-helixtrans-60.3-47-179.7-67.7-7000112.2K304 M308 E309 E310K304-N306 PolarHBondContact O-N 3.34Å; N306-M308 VanDerWaalsContact C-N 3.32Å; N306-M308 PolarHBondContact O-N 2.9Å; N306-E309 PolarHBondContact O-N 3.26Å; N306-E310 PolarHBondContact O-N 3.5Å; N306-E310 VanDerWaalsContact O-N 3.08Å
307A94.6Very high95Very high51 Ų5189.9 Ų89.942%0.42148%0.477SS..Hα-helixtrans-61.8-38.317900000112.6K304 K305 E310 V311K304-A307 PolarHBondContact O-N 2.96Å; K305-A307 PolarHBondContact O-N 3.4Å; A307-E310 PolarHBondContact O-N 3.01Å; A307-V311 WeakPolarHBondContact O-CG2 3.45Å; A307-V311 PolarHBondContact O-N 2.95Å
308M94.9Very high95.1Very high65 Ų6593.5 Ų93.532%0.3249%0.493SS..Hα-helixtrans-73.8-32.1178.2-66.3-69.8140.200112.7A297 A300 K304 K305 N306 E310 V311 K312A297-M308 HydrophobicContact CB-CB 4.19Å; A300-M308 HydrophobicContact CB-CB 4Å; A300-M308 HydrophobicContact CB-CG 3.89Å; K304-M308 WeakPolarHBondContact O-CG 3.41Å; K304-M308 PolarHBondContact O-N 3.46Å; K304-M308 VanDerWaalsContact O-N 3.09Å; K305-M308 PolarHBondContact O-N 2.67Å; N306-M308 VanDerWaalsContact C-N 3.32Å; N306-M308 PolarHBondContact O-N 2.9Å; M308-E310 VanDerWaalsContact C-N 3.34Å; M308-V311 PolarHBondContact O-N 3.45Å; M308-K312 WeakPolarHBondContact O-CB 3.39Å; M308-K312 PolarHBondContact O-N 3.44Å
309E94.9Very high95.1Very high64 Ų6487.9 Ų87.930%0.29947%0.467SS..Hα-helixtrans-66.7-34.7171.9-69.9-65.9168.100111.8K305 N306 K312 K313K305-E309 VanDerWaalsContact CE-OE1 3.24Å; K305-E309 WeakPolarHBondContact CE-OE1 3.29Å; K305-E309 IonicContact NZ-OE1 3.81Å; K305-E309 PolarHBondContact NZ-OE1 2.96Å; K305-E309 WeakPolarHBondContact O-CG 3.46Å; K305-E309 PolarHBondContact O-N 3Å; N306-E309 PolarHBondContact O-N 3.26Å; E309-K312 PolarHBondContact O-N 3.23Å; E309-K312 IonicContact OE2-NZ 3.79Å; E309-K312 PolarHBondContact OE2-NZ 2.86Å; E309-K313 WeakPolarHBondContact O-CB 3.38Å; E309-K313 PolarHBondContact O-N 2.98Å
310E95.9Very high95.2Very high143 Ų14386.7 Ų86.767%0.66846%0.464SS*.Hα-helixtrans-64.7-44.1172.8-71.3-179.4153.500112N306 A307 M308 K313 A314N306-E310 PolarHBondContact O-N 3.5Å; N306-E310 VanDerWaalsContact O-N 3.08Å; A307-E310 PolarHBondContact O-N 3.01Å; M308-E310 VanDerWaalsContact C-N 3.34Å; E310-K313 PolarHBondContact O-N 3.42Å; E310-A314 WeakPolarHBondContact O-CB 3.47Å; E310-A314 PolarHBondContact O-N 3.49Å
311V95.2Very high95.3Very high81 Ų8188.9 Ų88.949%0.49147%0.47SS..Hα-helixtrans-61-45.4175.1172.20000111.1A293 A307 M308 A314 A315A293-V311 HydrophobicContact CB-CG1 4.49Å; A307-V311 WeakPolarHBondContact O-CG2 3.45Å; A307-V311 PolarHBondContact O-N 2.95Å; M308-V311 PolarHBondContact O-N 3.45Å; V311-A314 PolarHBondContact O-N 2.86Å; V311-A315 PolarHBondContact O-N 3.04Å
312K96.8Very high95.4Very high48 Ų4881.1 Ų81.121%0.20944%0.436CS..Hα-helixtrans-58.6-48.5175174.4-168.8152.9-164.90111.1R294 A297 M308 E309 A314 A315 E316R294-K312 HydrophobicContact CG-CD 4.04Å; R294-K312 HydrophobicContact CG-CG 3.93Å; A297-K312 HydrophobicContact CB-CB 4.12Å; A297-K312 HydrophobicContact CB-CD 4.03Å; M308-K312 WeakPolarHBondContact O-CB 3.39Å; M308-K312 PolarHBondContact O-N 3.44Å; E309-K312 PolarHBondContact O-N 3.23Å; E309-K312 IonicContact OE2-NZ 3.79Å; E309-K312 PolarHBondContact OE2-NZ 2.86Å; K312-A314 VanDerWaalsContact C-N 3.3Å; K312-A314 PolarHBondContact O-N 3.01Å; K312-A315 PolarHBondContact O-N 3.17Å; K312-E316 WeakPolarHBondContact CE-OE1 3.44Å; K312-E316 HydrophobicContact CG-CG 4.46Å; K312-E316 WeakPolarHBondContact O-CG 3.39Å; K312-E316 PolarHBondContact O-N 3.02Å
313K97.1Very high95.7Very high158 Ų15876 Ų7669%0.68740%0.404SS*.Hα-helixtrans-62-38.8-179.4-172.9178.8179.7-177.70112E309 E310 E316 G317E309-K313 WeakPolarHBondContact O-CB 3.38Å; E309-K313 PolarHBondContact O-N 2.98Å; E310-K313 PolarHBondContact O-N 3.42Å; K313-E316 PolarHBondContact O-N 3.44Å; K313-G317 PolarHBondContact O-N 3.34Å
314A95.4Very high95.9Very high66 Ų6674.8 Ų74.855%0.54539%0.386SS..Hα-helixtrans-63.6-46.1174.400000111.7E310 V311 K312 E316 G317 E318E310-A314 WeakPolarHBondContact O-CB 3.47Å; E310-A314 PolarHBondContact O-N 3.49Å; V311-A314 PolarHBondContact O-N 2.86Å; K312-A314 VanDerWaalsContact C-N 3.3Å; K312-A314 PolarHBondContact O-N 3.01Å; A314-E316 VanDerWaalsContact C-N 3.32Å; A314-E316 PolarHBondContact O-N 3.27Å; A314-G317 PolarHBondContact O-N 2.91Å; A314-E318 WeakPolarHBondContact O-CB 3.32Å; A314-E318 PolarHBondContact O-N 3.5Å
315A95.3Very high96.1Very high19 Ų1968.5 Ų68.516%0.15736%0.359CS..Hα-helixtrans-62.9-37.2176.500000112.4L290 A293 V311 K312 F319L290-A315 HydrophobicContact CD1-CB 4.11Å; A293-A315 HydrophobicContact CB-CB 4.12Å; V311-A315 PolarHBondContact O-N 3.04Å; K312-A315 PolarHBondContact O-N 3.17Å; A315-F319 VanDerWaalsContact O-CB 3.26Å; A315-F319 WeakPolarHBondContact O-CB 3.39Å; A315-F319 PolarHBondContact O-N 3.32Å
316E96.8Very high96.4Very high58 Ų5865.4 Ų65.427%0.27135%0.346SS..Hα-helixtrans-62.6-48.7175-75.6177.1158.700111.5L290 R294 K312 K313 A314 F319 E320L290-E316 HydrophobicContact CD1-CB 4.29Å; L290-E316 HydrophobicContact CD1-CG 3.35Å; R294-E316 IonicContact CZ-OE1 3.57Å; R294-E316 IonicContact NE-OE1 2.7Å; R294-E316 PolarHBondContact NE-OE1 3.47Å; R294-E316 IonicContact NH2-OE1 2.78Å; R294-E316 PolarHBondContact NH2-OE1 3.41Å; K312-E316 WeakPolarHBondContact CE-OE1 3.44Å; K312-E316 HydrophobicContact CG-CG 4.46Å; K312-E316 WeakPolarHBondContact O-CG 3.39Å; K312-E316 PolarHBondContact O-N 3.02Å; K313-E316 PolarHBondContact O-N 3.44Å; A314-E316 VanDerWaalsContact C-N 3.32Å; A314-E316 PolarHBondContact O-N 3.27Å; E316-F319 PolarHBondContact O-N 3.07Å; E316-E320 WeakPolarHBondContact O-CB 3.37Å; E316-E320 PolarHBondContact O-N 3.22Å
317G96.7Very high96.6Very high38 Ų3863.3 Ų63.339%0.39233%0.33SS..Hα-helixtrans-64.7-40.2177.700000113.2K313 A314 Q321K313-G317 PolarHBondContact O-N 3.34Å; A314-G317 PolarHBondContact O-N 2.91Å; G317-Q321 WeakPolarHBondContact O-CB 3.44Å; G317-Q321 PolarHBondContact O-N 2.89Å; G317-Q321 VanDerWaalsContact O-N 3.15Å
318E95.4Very high96.7Very high76 Ų7666.1 Ų66.136%0.35534%0.335SS..Hα-helixtrans-62-49175.2-168.7-168.9167.900110.8K286 A314 E320 Q321 I322K286-E318 WeakPolarHBondContact CE-OE1 3.46Å; K286-E318 IonicContact NZ-OE1 2.61Å; K286-E318 PolarHBondContact NZ-OE1 3.3Å; K286-E318 IonicContact NZ-OE2 3.36Å; K286-E318 PolarHBondContact NZ-OE2 2.91Å; A314-E318 WeakPolarHBondContact O-CB 3.32Å; A314-E318 PolarHBondContact O-N 3.5Å; E318-E320 PolarHBondContact O-N 3.37Å; E318-Q321 PolarHBondContact O-N 3.41Å; E318-I322 HydrophobicContact CG-CD1 3.92Å; E318-I322 WeakPolarHBondContact O-CD1 3.33Å; E318-I322 VanDerWaalsContact O-CG1 3.24Å; E318-I322 WeakPolarHBondContact O-CG1 3.49Å; E318-I322 PolarHBondContact O-N 2.87Å
319F96.4Very high96.9Very high24 Ų2464.3 Ų64.311%0.10533%0.326CS..Hα-helixtrans-64.6-40.4-178.7-174.5-108.5000112.7R283 K286 L287 L290 A315 E316 Q321 I322 C323R283-F319 HydrophobicContact CG-CE2 4.02Å; K286-F319 HydrophobicContact CB-CD2 4.03Å; L287-F319 HydrophobicContact CB-CD2 4.45Å; L287-F319 HydrophobicContact CB-CE2 3.58Å; L287-F319 HydrophobicContact CB-CZ 3.71Å; L287-F319 HydrophobicContact CD1-CE1 3.91Å; L287-F319 HydrophobicContact CD1-CE2 4.3Å; L287-F319 HydrophobicContact CD1-CZ 3.67Å; L287-F319 HydrophobicContact CG-CE2 4.5Å; L287-F319 HydrophobicContact CG-CZ 4.16Å; L290-F319 HydrophobicContact CD2-CB 3.94Å; L290-F319 HydrophobicContact CD2-CD1 3.55Å; L290-F319 HydrophobicContact CD2-CE1 4.25Å; L290-F319 HydrophobicContact CD2-CG 3.82Å; A315-F319 VanDerWaalsContact O-CB 3.26Å; A315-F319 WeakPolarHBondContact O-CB 3.39Å; A315-F319 PolarHBondContact O-N 3.32Å; E316-F319 PolarHBondContact O-N 3.07Å; F319-Q321 PolarHBondContact O-N 2.99Å; F319-I322 PolarHBondContact O-N 3.33Å; F319-C323 VanDerWaalsContact CE1-SG 3.53Å; F319-C323 VanDerWaalsContact CZ-SG 3.59Å; F319-C323 PolarHBondContact O-N 2.98Å; F319-C323 PolarHBondContact O-SG 3.46Å
320E97.4Very high97Very high143 Ų14361.6 Ų61.667%0.66831%0.313SS*.Hα-helixtrans-60.6-45.6175.7-175.7176.3-17500111.3E316 E318 I322 C323 K324E316-E320 WeakPolarHBondContact O-CB 3.37Å; E316-E320 PolarHBondContact O-N 3.22Å; E318-E320 PolarHBondContact O-N 3.37Å; E320-I322 PolarHBondContact O-N 2.91Å; E320-C323 PolarHBondContact O-N 2.95Å; E320-K324 PolarHBondContact O-N 2.9Å
321Q97Very high97Very high70 Ų7057.6 Ų57.633%0.32731%0.305SS..Hα-helixtrans-64.6-40177.6-176.959.323.800111.9P69 G317 E318 F319 K324 V325P69-Q321 HydrophobicContact CB-CG 4.38Å; G317-Q321 WeakPolarHBondContact O-CB 3.44Å; G317-Q321 PolarHBondContact O-N 2.89Å; G317-Q321 VanDerWaalsContact O-N 3.15Å; E318-Q321 PolarHBondContact O-N 3.41Å; F319-Q321 PolarHBondContact O-N 2.99Å; Q321-K324 PolarHBondContact O-N 3.19Å; Q321-V325 WeakPolarHBondContact O-CG2 3.49Å; Q321-V325 PolarHBondContact O-N 3.37Å
322I97.3Very high96.9Very high1 Ų158.7 Ų58.71%0.00530%0.304CS..Hα-helixtrans-60.2-47173.9-70.6164.9000110.6Q72 R283 K286 E318 F319 E320 K324 V325 A326Q72-I322 HydrophobicContact CB-CD1 3.74Å; Q72-I322 HydrophobicContact CB-CG1 3.94Å; Q72-I322 HydrophobicContact CB-CG2 4.24Å; Q72-I322 HydrophobicContact CG-CD1 4.16Å; R283-I322 HydrophobicContact CB-CG2 4.27Å; R283-I322 HydrophobicContact CG-CG2 3.97Å; K286-I322 HydrophobicContact CB-CD1 4.07Å; K286-I322 HydrophobicContact CD-CD1 3.93Å; K286-I322 HydrophobicContact CG-CD1 3.77Å; E318-I322 HydrophobicContact CG-CD1 3.92Å; E318-I322 WeakPolarHBondContact O-CD1 3.33Å; E318-I322 VanDerWaalsContact O-CG1 3.24Å; E318-I322 WeakPolarHBondContact O-CG1 3.49Å; E318-I322 PolarHBondContact O-N 2.87Å; F319-I322 PolarHBondContact O-N 3.33Å; E320-I322 PolarHBondContact O-N 2.91Å; I322-K324 VanDerWaalsContact C-N 3.3Å; I322-K324 PolarHBondContact O-N 3.2Å; I322-V325 PolarHBondContact O-N 3.03Å; I322-A326 VanDerWaalsContact O-CB 3.29Å; I322-A326 WeakPolarHBondContact O-CB 3.38Å; I322-A326 PolarHBondContact O-N 2.93Å
323C98Very high96.8Very high15 Ų1557.2 Ų57.210%0.10130%0.299CS..Hα-helixtrans-60.7-40.7178.2-68.20000111.9F176 R283 F319 E320 A326 K327F176-C323 HydrophobicContact CE2-CB 4.09Å; F176-C323 HydrophobicContact CZ-CB 4.06Å; R283-C323 PolarHBondContact NE-SG 2.77Å; R283-C323 PolarHBondContact NH2-SG 2.72Å; F319-C323 VanDerWaalsContact CE1-SG 3.53Å; F319-C323 VanDerWaalsContact CZ-SG 3.59Å; F319-C323 PolarHBondContact O-N 2.98Å; F319-C323 PolarHBondContact O-SG 3.46Å; E320-C323 PolarHBondContact O-N 2.95Å; C323-A326 PolarHBondContact O-N 3.47Å; C323-K327 WeakPolarHBondContact O-CG 3.27Å; C323-K327 PolarHBondContact O-N 3.41Å
324K98.1Very high96.5Very high119 Ų11953.4 Ų53.452%0.51729%0.292SS..Hα-helixtrans-61.9-48.8177.7-178.2179.6177.4179.90111.6E320 Q321 I322 Q328E320-K324 PolarHBondContact O-N 2.9Å; Q321-K324 PolarHBondContact O-N 3.19Å; I322-K324 VanDerWaalsContact C-N 3.3Å; I322-K324 PolarHBondContact O-N 3.2Å; K324-Q328 WeakPolarHBondContact O-CG 3.42Å; K324-Q328 PolarHBondContact O-N 3.49Å
325V98.3Very high96.3Very high5 Ų557.4 Ų57.43%0.0330%0.299CS..Hα-helixtrans-63.4-48177.2175.80000110.1V74 I127 Q321 I322 K327 Q328 E329V74-V325 HydrophobicContact CG2-CG1 3.88Å; I127-V325 HydrophobicContact CD1-CG1 4.01Å; I127-V325 HydrophobicContact CD1-CG2 3.98Å; Q321-V325 WeakPolarHBondContact O-CG2 3.49Å; Q321-V325 PolarHBondContact O-N 3.37Å; I322-V325 PolarHBondContact O-N 3.03Å; V325-K327 VanDerWaalsContact C-N 3.31Å; V325-K327 PolarHBondContact O-N 3.01Å; V325-Q328 WeakPolarHBondContact O-CA 3.37Å; V325-Q328 WeakPolarHBondContact O-CB 3.36Å; V325-Q328 PolarHBondContact O-N 3.46Å; V325-E329 HydrophobicContact CG1-CG 3.98Å; V325-E329 WeakPolarHBondContact O-CG 3.34Å; V325-E329 PolarHBondContact O-N 2.78Å
326A98.3Very high96Very high0 Ų060 Ų600%031%0.311CS..Hα-helixtrans-55.9-42.9179.800000113G73 F176 M279 I322 C323 Q328 E329 I330G73-A326 VanDerWaalsContact O-CA 3.27Å; G73-A326 WeakPolarHBondContact O-CA 3.39Å; G73-A326 PolarHBondContact O-N 3.39Å; F176-A326 HydrophobicContact CE1-CB 3.72Å; F176-A326 HydrophobicContact CZ-CB 4.1Å; M279-A326 HydrophobicContact CE-CB 3.92Å; M279-A326 HydrophobicContact SD-CB 3.53Å; M279-A326 VanDerWaalsContact SD-CB 3.53Å; I322-A326 VanDerWaalsContact O-CB 3.29Å; I322-A326 WeakPolarHBondContact O-CB 3.38Å; I322-A326 PolarHBondContact O-N 2.93Å; C323-A326 PolarHBondContact O-N 3.47Å; A326-Q328 VanDerWaalsContact C-N 3.33Å; A326-Q328 PolarHBondContact O-N 2.87Å; A326-E329 PolarHBondContact O-N 3.49Å; A326-I330 WeakPolarHBondContact O-CB 3.46Å; A326-I330 WeakPolarHBondContact O-CD1 3.41Å; A326-I330 WeakPolarHBondContact O-CG1 3.45Å; A326-I330 PolarHBondContact O-N 3.28Å
327K98.3Very high95.7Very high85 Ų8560.3 Ų60.337%0.3731%0.309SS..Hα-helixtrans-61.6-40.3175.2-77.2178.7-1801780112.4D173 F175 F176 C323 V325 A331D173-K327 IonicContact OD2-NZ 3.22Å; D173-K327 PolarHBondContact OD2-NZ 3.36Å; F175-K327 HydrophobicContact CD1-CD 4.44Å; F175-K327 HydrophobicContact CD1-CG 4.08Å; F175-K327 HydrophobicContact CE1-CD 4.44Å; F175-K327 HydrophobicContact CE1-CG 3.64Å; F175-K327 HydrophobicContact CZ-CG 4.23Å; F176-K327 HydrophobicContact CE1-CG 4.32Å; F176-K327 HydrophobicContact CE2-CD 4.42Å; F176-K327 VanDerWaalsContact CE2-CE 3.41Å; F176-K327 HydrophobicContact CE2-CG 4.31Å; F176-K327 HydrophobicContact CZ-CD 4.28Å; F176-K327 HydrophobicContact CZ-CG 3.72Å; C323-K327 WeakPolarHBondContact O-CG 3.27Å; C323-K327 PolarHBondContact O-N 3.41Å; V325-K327 VanDerWaalsContact C-N 3.31Å; V325-K327 PolarHBondContact O-N 3.01Å; K327-A331 WeakPolarHBondContact O-CB 3.45Å; K327-A331 PolarHBondContact O-N 2.96Å; K327-A331 VanDerWaalsContact O-N 3.16Å
328Q97.8Very high95.4Very high111 Ų11162.9 Ų62.952%0.51932%0.317SS..Hα-helixtrans-67-44177.6-69174.6-22.600111.5K324 V325 A326 A331 H332K324-Q328 WeakPolarHBondContact O-CG 3.42Å; K324-Q328 PolarHBondContact O-N 3.49Å; V325-Q328 WeakPolarHBondContact O-CA 3.37Å; V325-Q328 WeakPolarHBondContact O-CB 3.36Å; V325-Q328 PolarHBondContact O-N 3.46Å; A326-Q328 VanDerWaalsContact C-N 3.33Å; A326-Q328 PolarHBondContact O-N 2.87Å; Q328-A331 PolarHBondContact O-N 3.06Å; Q328-H332 WeakPolarHBondContact O-CB 3.3Å; Q328-H332 PolarHBondContact O-N 3.49Å
329E97.9Very high95.2Very high26 Ų2661.1 Ų61.112%0.12132%0.319CS..Hα-helixtrans-64.9-44.1179-65.3-63.9144.800112.4I75 H125 V325 A326 A331 H332 L333I75-E329 HydrophobicContact CB-CB 4.17Å; I75-E329 HydrophobicContact CD1-CB 3.81Å; I75-E329 HydrophobicContact CG1-CB 3.74Å; H125-E329 IonicContact CD2-OE1 2.76Å; H125-E329 IonicContact CE1-OE1 3.47Å; H125-E329 IonicContact NE2-OE1 3.37Å; H125-E329 PolarHBondContact NE2-OE1 2.95Å; H125-E329 IonicContact NE2-OE2 2.77Å; V325-E329 HydrophobicContact CG1-CG 3.98Å; V325-E329 WeakPolarHBondContact O-CG 3.34Å; V325-E329 PolarHBondContact O-N 2.78Å; A326-E329 PolarHBondContact O-N 3.49Å; E329-A331 VanDerWaalsContact C-N 3.35Å; E329-A331 PolarHBondContact O-N 3.48Å; E329-H332 PolarHBondContact O-N 2.77Å; E329-L333 VanDerWaalsContact O-CB 3.31Å; E329-L333 WeakPolarHBondContact O-CB 3.41Å; E329-L333 PolarHBondContact O-N 2.85Å
330I97.3Very high94.9Very high8 Ų861.8 Ų61.84%0.04132%0.323CS..Hα-helixtrans-60.5-46176.4-68.3164.1000110.3I75 F175 F176 E179 M279 L280 A326 H332 L333 S334I75-I330 HydrophobicContact CD1-CG1 4.21Å; F175-I330 HydrophobicContact CE1-CD1 3.92Å; F175-I330 HydrophobicContact CZ-CD1 4.21Å; F175-I330 HydrophobicContact CZ-CG2 4.23Å; F176-I330 HydrophobicContact CD1-CD1 4.35Å; F176-I330 HydrophobicContact CE1-CD1 4.16Å; E179-I330 HydrophobicContact CB-CD1 4.47Å; E179-I330 HydrophobicContact CG-CD1 4.28Å; E179-I330 HydrophobicContact CG-CG2 4.23Å; M279-I330 HydrophobicContact CE-CD1 3.95Å; M279-I330 HydrophobicContact CE-CG1 3.88Å; L280-I330 HydrophobicContact CD2-CD1 4.12Å; A326-I330 WeakPolarHBondContact O-CB 3.46Å; A326-I330 WeakPolarHBondContact O-CD1 3.41Å; A326-I330 WeakPolarHBondContact O-CG1 3.45Å; A326-I330 PolarHBondContact O-N 3.28Å; I330-H332 PolarHBondContact O-N 2.79Å; I330-L333 PolarHBondContact O-N 3.42Å; I330-S334 VanDerWaalsContact O-CB 3.32Å; I330-S334 WeakPolarHBondContact O-CB 3.45Å; I330-S334 PolarHBondContact O-N 3.02Å
331A95.9Very high94.6Very high59 Ų5956.8 Ų56.849%0.48830%0.302SS..Hα-helixtrans-61.6-44.5178.400000112K327 Q328 E329 Q335K327-A331 WeakPolarHBondContact O-CB 3.45Å; K327-A331 PolarHBondContact O-N 2.96Å; K327-A331 VanDerWaalsContact O-N 3.16Å; Q328-A331 PolarHBondContact O-N 3.06Å; E329-A331 VanDerWaalsContact C-N 3.35Å; E329-A331 PolarHBondContact O-N 3.48Å; A331-Q335 PolarHBondContact O-N 3.02Å; A331-Q335 VanDerWaalsContact O-N 3.15Å
332H94.3Very high94.5Very high103 Ų10359.4 Ų59.448%0.47732%0.315SS..Hα-helixtrans-65.5-46.4178.5-174.2-146000111.9Q328 E329 I330 S334 Q335 D336Q328-H332 WeakPolarHBondContact O-CB 3.3Å; Q328-H332 PolarHBondContact O-N 3.49Å; E329-H332 PolarHBondContact O-N 2.77Å; I330-H332 PolarHBondContact O-N 2.79Å; H332-S334 VanDerWaalsContact C-N 3.35Å; H332-S334 PolarHBondContact O-N 3.47Å; H332-Q335 PolarHBondContact O-N 3.19Å; H332-D336 IonicContact CD2-OD1 3.29Å; H332-D336 IonicContact CD2-OD2 3.25Å; H332-D336 IonicContact CE1-OD2 2.83Å; H332-D336 IonicContact NE2-OD1 3.79Å; H332-D336 IonicContact NE2-OD2 3.82Å; H332-D336 PolarHBondContact NE2-OD2 3.04Å; H332-D336 WeakPolarHBondContact O-CB 3.48Å; H332-D336 PolarHBondContact O-N 3.03Å
333L93.6Very high94.3Very high18 Ų1865.2 Ų65.29%0.09434%0.34CS..Hα-helixtrans-59.7-45.6177.5177.261.5000111.5I75 Y272 E276 E329 I330 Q335 D336 R337I75-L333 HydrophobicContact CD1-CB 4.36Å; I75-L333 HydrophobicContact CD1-CD2 3.9Å; I75-L333 HydrophobicContact CG2-CD2 4.41Å; Y272-L333 HydrophobicContact CD1-CD1 3.63Å; Y272-L333 HydrophobicContact CE1-CD1 4.28Å; Y272-L333 HydrophobicContact CG-CD1 3.8Å; E276-L333 HydrophobicContact CB-CD2 3.99Å; E276-L333 HydrophobicContact CG-CD2 4.45Å; E329-L333 VanDerWaalsContact O-CB 3.31Å; E329-L333 WeakPolarHBondContact O-CB 3.41Å; E329-L333 PolarHBondContact O-N 2.85Å; I330-L333 PolarHBondContact O-N 3.42Å; L333-Q335 VanDerWaalsContact C-N 3.31Å; L333-Q335 PolarHBondContact O-N 3.18Å; L333-D336 PolarHBondContact O-N 3.37Å; L333-R337 WeakPolarHBondContact O-CB 3.48Å; L333-R337 PolarHBondContact O-N 3.35Å
334S91.1Very high94Very high77 Ų7765.2 Ų65.254%0.53834%0.34SS..Hα-helixtrans-59.4-43179-174.80000111.8I330 H332I330-S334 VanDerWaalsContact O-CB 3.32Å; I330-S334 WeakPolarHBondContact O-CB 3.45Å; I330-S334 PolarHBondContact O-N 3.02Å; H332-S334 VanDerWaalsContact C-N 3.35Å; H332-S334 PolarHBondContact O-N 3.47Å
335Q90.2Very high93.9Very high150 Ų15063 Ų6370%0.70133%0.333SS*.Hα-helixtrans-65.8-48.5177.2-176.6174.6-2.800112.3A331 H332 L333A331-Q335 PolarHBondContact O-N 3.02Å; A331-Q335 VanDerWaalsContact O-N 3.15Å; H332-Q335 PolarHBondContact O-N 3.19Å; L333-Q335 VanDerWaalsContact C-N 3.31Å; L333-Q335 PolarHBondContact O-N 3.18Å
336D90.6Very high93.8Very high75 Ų7565.9 Ų65.940%0.40135%0.351SS..Hα-helixtrans-69.7-37.6-175.9-801.1000112.5H332 L333 V338 G339 M340H332-D336 IonicContact CD2-OD1 3.29Å; H332-D336 IonicContact CD2-OD2 3.25Å; H332-D336 IonicContact CE1-OD2 2.83Å; H332-D336 IonicContact NE2-OD1 3.79Å; H332-D336 IonicContact NE2-OD2 3.82Å; H332-D336 PolarHBondContact NE2-OD2 3.04Å; H332-D336 WeakPolarHBondContact O-CB 3.48Å; H332-D336 PolarHBondContact O-N 3.03Å; L333-D336 PolarHBondContact O-N 3.37Å; D336-V338 VanDerWaalsContact C-N 3.34Å; D336-V338 PolarHBondContact O-N 2.88Å; D336-G339 PolarHBondContact O-N 3.41Å; D336-M340 PolarHBondContact O-N 2.88Å
337R90.9Very high93.6Very high63 Ų6369.3 Ų69.324%0.23837%0.367CS..Hα-helixtrans-57.9-44.8-177.3177.9-179.6177.2-99.2-13.6112.2D269 L333 G339 M340 V341D269-R337 VanDerWaalsContact OD1-CD 3.28Å; D269-R337 WeakPolarHBondContact OD1-CD 3.5Å; D269-R337 WeakPolarHBondContact OD1-CG 3.39Å; D269-R337 IonicContact OD1-CZ 2.75Å; D269-R337 IonicContact OD1-NE 2.87Å; D269-R337 PolarHBondContact OD1-NE 3.13Å; D269-R337 IonicContact OD1-NH2 3.21Å; D269-R337 IonicContact OD2-CZ 3.62Å; D269-R337 IonicContact OD2-NE 2.91Å; D269-R337 PolarHBondContact OD2-NE 3.41Å; D269-R337 IonicContact OD2-NH2 3.5Å; D269-R337 PolarHBondContact OD2-NH2 3.44Å; L333-R337 WeakPolarHBondContact O-CB 3.48Å; L333-R337 PolarHBondContact O-N 3.35Å; R337-G339 VanDerWaalsContact C-N 3.34Å; R337-G339 PolarHBondContact O-N 3.2Å; R337-M340 PolarHBondContact O-N 3.41Å; R337-V341 HydrophobicContact CG-CG2 4.35Å; R337-V341 WeakPolarHBondContact O-CG2 3.45Å; R337-V341 PolarHBondContact O-N 3.17Å
338V89.6Confident93.4Very high93 Ų9368.6 Ų68.656%0.56436%0.362SS*.Hα-helixtrans-60.8-46.3-179.7176.60000110.4D336 V341 Q342D336-V338 VanDerWaalsContact C-N 3.34Å; D336-V338 PolarHBondContact O-N 2.88Å; V338-V341 PolarHBondContact O-N 3.37Å; V338-Q342 VanDerWaalsContact O-CB 3.27Å; V338-Q342 WeakPolarHBondContact O-CB 3.39Å; V338-Q342 PolarHBondContact O-N 3.26Å
339G91.3Very high93.4Very high39 Ų3966.7 Ų66.740%0.40236%0.36SS..Hα-helixtrans-64.5-40.4178.100000112.9D336 R337 K343D336-G339 PolarHBondContact O-N 3.41Å; R337-G339 VanDerWaalsContact C-N 3.34Å; R337-G339 PolarHBondContact O-N 3.2Å; G339-K343 WeakPolarHBondContact O-CB 3.17Å; G339-K343 PolarHBondContact O-N 3.42Å
340M90.7Very high93.4Very high38 Ų3871 Ų7119%0.18738%0.38CS..Hα-helixtrans-61.8-52.8175.8-179.1-164.171.900111.6L268 D269 D336 R337 Q342 K343 C344L268-M340 HydrophobicContact CB-SD 4.39Å; L268-M340 HydrophobicContact CD2-SD 3.63Å; L268-M340 HydrophobicContact CG-SD 3.9Å; D269-M340 HydrophobicContact CB-CE 3.66Å; D336-M340 PolarHBondContact O-N 2.88Å; R337-M340 PolarHBondContact O-N 3.41Å; M340-Q342 VanDerWaalsContact C-N 3.35Å; M340-Q342 PolarHBondContact O-N 3.21Å; M340-K343 WeakPolarHBondContact O-CB 3.16Å; M340-K343 PolarHBondContact O-N 2.88Å; M340-C344 PolarHBondContact O-N 3.46Å; M340-C344 PolarHBondContact O-SG 3.29Å; M340-C344 VanDerWaalsContact O-SG 3.4Å
341V90.1Very high93.2Very high37 Ų3774 Ų7422%0.22439%0.394CS..Hα-helixtrans-63.1-42.8-178.3173.50000110.8R337 V338 K343 C344 L345R337-V341 HydrophobicContact CG-CG2 4.35Å; R337-V341 WeakPolarHBondContact O-CG2 3.45Å; R337-V341 PolarHBondContact O-N 3.17Å; V338-V341 PolarHBondContact O-N 3.37Å; V341-K343 VanDerWaalsContact C-N 3.34Å; V341-K343 PolarHBondContact O-N 3.27Å; V341-C344 PolarHBondContact O-N 3.09Å; V341-L345 HydrophobicContact CG1-CD1 3.9Å; V341-L345 HydrophobicContact CG1-CG 4.4Å; V341-L345 WeakPolarHBondContact O-CB 3.35Å; V341-L345 WeakPolarHBondContact O-CG 3.35Å; V341-L345 PolarHBondContact O-N 3.2Å
342Q94.3Very high93.2Very high126 Ų12674 Ų7459%0.58938%0.384SS*.Hα-helixtrans-56.9-48.3175.1-177.5-178.98.600111.2V338 M340 C344 L345 T346V338-Q342 VanDerWaalsContact O-CB 3.27Å; V338-Q342 WeakPolarHBondContact O-CB 3.39Å; V338-Q342 PolarHBondContact O-N 3.26Å; M340-Q342 VanDerWaalsContact C-N 3.35Å; M340-Q342 PolarHBondContact O-N 3.21Å; Q342-C344 PolarHBondContact O-N 2.95Å; Q342-L345 PolarHBondContact O-N 3.14Å; Q342-T346 PolarHBondContact O-N 3.47Å; Q342-T346 PolarHBondContact O-OG1 3.46Å; Q342-T346 VanDerWaalsContact O-OG1 3.1Å
343K93.1Very high93.3Very high122 Ų12273.7 Ų73.753%0.5339%0.385SS..Hα-helixtrans-60.1-45.7178.5-179.1-178.6176.6-177.30112G339 M340 V341 T346 Q347G339-K343 WeakPolarHBondContact O-CB 3.17Å; G339-K343 PolarHBondContact O-N 3.42Å; M340-K343 WeakPolarHBondContact O-CB 3.16Å; M340-K343 PolarHBondContact O-N 2.88Å; V341-K343 VanDerWaalsContact C-N 3.34Å; V341-K343 PolarHBondContact O-N 3.27Å; K343-T346 PolarHBondContact O-N 2.99Å; K343-Q347 HydrophobicContact CG-CG 4.46Å; K343-Q347 WeakPolarHBondContact O-CB 3.38Å; K343-Q347 VanDerWaalsContact O-CG 3.26Å; K343-Q347 WeakPolarHBondContact O-CG 3.43Å; K343-Q347 PolarHBondContact O-N 2.95Å
344C91.9Very high93.4Very high15 Ų1577 Ų7710%0.10140%0.4CS..Hα-helixtrans-62.8-42.1178.8-70.50000112.2L262 G265 M340 V341 Q342 Q347 W348L262-C344 HydrophobicContact CD1-CB 4.35Å; G265-C344 VanDerWaalsContact CA-SG 3.52Å; M340-C344 PolarHBondContact O-N 3.46Å; M340-C344 PolarHBondContact O-SG 3.29Å; M340-C344 VanDerWaalsContact O-SG 3.4Å; V341-C344 PolarHBondContact O-N 3.09Å; Q342-C344 PolarHBondContact O-N 2.95Å; C344-Q347 PolarHBondContact O-N 3.17Å; C344-W348 WeakPolarHBondContact O-CB 3.15Å; C344-W348 PolarHBondContact O-N 3.49Å
345L95.4Very high93.5Very high74 Ų7473.4 Ų73.439%0.38738%0.375SS..Hα-helixtrans-62.9-45.3175.4-75.2168.1000112L262 V341 Q342 W348 C349L262-L345 HydrophobicContact CD1-CD2 3.87Å; L262-L345 HydrophobicContact CD1-CG 4.21Å; L262-L345 HydrophobicContact CD2-CD2 3.98Å; V341-L345 HydrophobicContact CG1-CD1 3.9Å; V341-L345 HydrophobicContact CG1-CG 4.4Å; V341-L345 WeakPolarHBondContact O-CB 3.35Å; V341-L345 WeakPolarHBondContact O-CG 3.35Å; V341-L345 PolarHBondContact O-N 3.2Å; Q342-L345 PolarHBondContact O-N 3.14Å; L345-W348 HydrophobicContact CD2-CE3 4.44Å; L345-W348 PolarHBondContact O-N 2.7Å; L345-C349 PolarHBondContact O-N 3.05Å; L345-C349 PolarHBondContact O-SG 3.35Å; L345-C349 VanDerWaalsContact O-SG 3.36Å
346T96.9Very high93.8Very high64 Ų6469.1 Ų69.139%0.39337%0.365SS..Hα-helixtrans-60.6-49176.9-62.10000111.1Q342 K343 W348 C349 E350Q342-T346 PolarHBondContact O-N 3.47Å; Q342-T346 PolarHBondContact O-OG1 3.46Å; Q342-T346 VanDerWaalsContact O-OG1 3.1Å; K343-T346 PolarHBondContact O-N 2.99Å; T346-W348 VanDerWaalsContact C-N 3.31Å; T346-W348 PolarHBondContact O-N 3.19Å; T346-C349 PolarHBondContact O-N 3.43Å; T346-E350 HydrophobicContact CG2-CG 4.4Å; T346-E350 WeakPolarHBondContact O-CG 3.33Å; T346-E350 PolarHBondContact O-N 3.37Å
347Q93.5Very high94.1Very high73 Ų7370.9 Ų70.934%0.34137%0.369SS..Hα-helixtrans-60.8-40.4179.1-72.9178.3-32.600112.1T261 K343 C344 E350 Q351T261-Q347 HydrophobicContact CG2-CB 4Å; K343-Q347 HydrophobicContact CG-CG 4.46Å; K343-Q347 WeakPolarHBondContact O-CB 3.38Å; K343-Q347 VanDerWaalsContact O-CG 3.26Å; K343-Q347 WeakPolarHBondContact O-CG 3.43Å; K343-Q347 PolarHBondContact O-N 2.95Å; C344-Q347 PolarHBondContact O-N 3.17Å; Q347-E350 PolarHBondContact O-N 3.08Å; Q347-Q351 VanDerWaalsContact O-CG 3.32Å; Q347-Q351 WeakPolarHBondContact O-CG 3.43Å; Q347-Q351 PolarHBondContact O-N 2.92Å
348W95.4Very high94.3Very high70 Ų7072.2 Ų72.227%0.26538%0.378SS..Hα-helixtrans-61.9-49.9175.5175.756.8000111.8F197 D258 T261 L262 C344 L345 T346 E350 Q351 Q352F197-W348 AromaticContact CE2-CE2 3.88Å; F197-W348 AromaticContact CE2-CZ2 3.97Å; F197-W348 HydrophobicContact CE2-CZ2 3.97Å; F197-W348 AromaticContact CE2-NE1 3.92Å; F197-W348 AromaticContact CZ-NE1 3.86Å; D258-W348 PolarHBondContact OD1-NE1 3.48Å; D258-W348 PolarHBondContact OD2-NE1 2.9Å; T261-W348 WeakPolarHBondContact OG1-CA 3.34Å; L262-W348 HydrophobicContact CB-CB 3.81Å; L262-W348 HydrophobicContact CB-CD2 4.27Å; L262-W348 HydrophobicContact CB-CG 3.85Å; L262-W348 HydrophobicContact CD2-CD2 3.89Å; L262-W348 HydrophobicContact CD2-CE3 3.72Å; L262-W348 HydrophobicContact CD2-CG 4.36Å; L262-W348 HydrophobicContact CD2-CZ3 4.1Å; C344-W348 WeakPolarHBondContact O-CB 3.15Å; C344-W348 PolarHBondContact O-N 3.49Å; L345-W348 HydrophobicContact CD2-CE3 4.44Å; L345-W348 PolarHBondContact O-N 2.7Å; T346-W348 VanDerWaalsContact C-N 3.31Å; T346-W348 PolarHBondContact O-N 3.19Å; W348-E350 VanDerWaalsContact C-N 3.32Å; W348-E350 PolarHBondContact O-N 3.08Å; W348-Q351 PolarHBondContact O-N 3.43Å; W348-Q352 HydrophobicContact CD2-CG 4.48Å; W348-Q352 HydrophobicContact CG-CG 4.46Å; W348-Q352 WeakPolarHBondContact O-CB 3.42Å; W348-Q352 VanDerWaalsContact O-CG 3.28Å; W348-Q352 WeakPolarHBondContact O-CG 3.33Å; W348-Q352 PolarHBondContact O-N 3.38Å
349C97.5Very high94.5Very high71 Ų7167.9 Ų67.948%0.4835%0.353SS..Hα-helixtrans-59.2-40.8176.8-71.50000112.8L345 T346 Q352 L353L345-C349 PolarHBondContact O-N 3.05Å; L345-C349 PolarHBondContact O-SG 3.35Å; L345-C349 VanDerWaalsContact O-SG 3.36Å; T346-C349 PolarHBondContact O-N 3.43Å; C349-Q352 PolarHBondContact O-N 3.46Å; C349-L353 WeakPolarHBondContact O-CB 3.37Å; C349-L353 PolarHBondContact O-N 3.43Å
350E97.1Very high94.8Very high116 Ų11668.7 Ų68.754%0.54236%0.355SS..Hα-helixtrans-62.5-45.6176.2-73.8172.2168.400111.6T346 Q347 W348 L353 Q354T346-E350 HydrophobicContact CG2-CG 4.4Å; T346-E350 WeakPolarHBondContact O-CG 3.33Å; T346-E350 PolarHBondContact O-N 3.37Å; Q347-E350 PolarHBondContact O-N 3.08Å; W348-E350 VanDerWaalsContact C-N 3.32Å; W348-E350 PolarHBondContact O-N 3.08Å; E350-L353 PolarHBondContact O-N 2.85Å; E350-Q354 WeakPolarHBondContact O-CB 3.48Å; E350-Q354 PolarHBondContact O-N 3.29Å
351Q93.6Very high95Very high70 Ų7071.7 Ų71.733%0.32737%0.372SS..Hα-helixtrans-69-36.6178.3-68.4-56.6-35.200112.8N257 T261 Q347 W348 Q354 T355N257-Q351 HydrophobicContact CB-CB 3.96Å; N257-Q351 HydrophobicContact CB-CG 4.43Å; T261-Q351 HydrophobicContact CG2-CG 3.88Å; Q347-Q351 VanDerWaalsContact O-CG 3.32Å; Q347-Q351 WeakPolarHBondContact O-CG 3.43Å; Q347-Q351 PolarHBondContact O-N 2.92Å; W348-Q351 PolarHBondContact O-N 3.43Å; Q351-Q354 PolarHBondContact O-N 3.21Å; Q351-T355 WeakPolarHBondContact O-CB 3.46Å; Q351-T355 PolarHBondContact O-N 3.32Å; Q351-T355 PolarHBondContact O-OG1 3.1Å
352Q95.2Very high95.3Very high60 Ų6072.4 Ų72.428%0.2838%0.376SS..Hα-helixtrans-59.3-49.2172.7-77.1-70.5-39.300110.8D258 W348 C349 Q354 T355 A356D258-Q352 VanDerWaalsContact CG-NE2 3.3Å; D258-Q352 PolarHBondContact OD1-NE2 3.01Å; D258-Q352 PolarHBondContact OD2-NE2 3.5Å; W348-Q352 HydrophobicContact CD2-CG 4.48Å; W348-Q352 HydrophobicContact CG-CG 4.46Å; W348-Q352 WeakPolarHBondContact O-CB 3.42Å; W348-Q352 VanDerWaalsContact O-CG 3.28Å; W348-Q352 WeakPolarHBondContact O-CG 3.33Å; W348-Q352 PolarHBondContact O-N 3.38Å; C349-Q352 PolarHBondContact O-N 3.46Å; Q352-Q354 PolarHBondContact O-N 3.17Å; Q352-T355 PolarHBondContact O-N 3.28Å; Q352-A356 VanDerWaalsContact O-CB 3.27Å; Q352-A356 WeakPolarHBondContact O-CB 3.46Å; Q352-A356 PolarHBondContact O-N 3.02Å
353L97.4Very high95.3Very high97 Ų9770 Ų7051%0.50837%0.365SS..Hα-helixtrans-62.7-42.9177.7-179.461000112C349 E350 A356 K357C349-L353 WeakPolarHBondContact O-CB 3.37Å; C349-L353 PolarHBondContact O-N 3.43Å; E350-L353 PolarHBondContact O-N 2.85Å; L353-A356 PolarHBondContact O-N 3.23Å; L353-K357 HydrophobicContact CD1-CD 4.5Å; L353-K357 HydrophobicContact CG-CD 4.38Å; L353-K357 WeakPolarHBondContact O-CG 3.37Å; L353-K357 PolarHBondContact O-N 3.33Å; L353-K357 VanDerWaalsContact O-N 3.08Å
354Q95.7Very high95.5Very high86 Ų8668.2 Ų68.240%0.40236%0.36SS..Hα-helixtrans-62.7-49.7179-176.158.231.800111.3E350 Q351 Q352 A356 K357 E358E350-Q354 WeakPolarHBondContact O-CB 3.48Å; E350-Q354 PolarHBondContact O-N 3.29Å; Q351-Q354 PolarHBondContact O-N 3.21Å; Q352-Q354 PolarHBondContact O-N 3.17Å; Q354-A356 VanDerWaalsContact C-N 3.29Å; Q354-A356 PolarHBondContact O-N 2.89Å; Q354-K357 PolarHBondContact O-N 3.27Å; Q354-E358 PolarHBondContact NE2-OE1 3.06Å; Q354-E358 WeakPolarHBondContact O-CG 3.45Å; Q354-E358 PolarHBondContact O-N 2.93Å
355T93.5Very high95.7Very high2 Ų273.7 Ų73.71%0.01239%0.385CS..Hα-helixtrans-65.8-33.8-178.6-470000111.7N250 V254 N257 Q351 Q352 G359N250-T355 PolarHBondContact ND2-O 3.05Å; V254-T355 HydrophobicContact CG2-CG2 3.46Å; V254-T355 VanDerWaalsContact CG2-CG2 3.46Å; N257-T355 PolarHBondContact ND2-OG1 3.47Å; Q351-T355 WeakPolarHBondContact O-CB 3.46Å; Q351-T355 PolarHBondContact O-N 3.32Å; Q351-T355 PolarHBondContact O-OG1 3.1Å; Q352-T355 PolarHBondContact O-N 3.28Å; T355-G359 PolarHBondContact O-N 2.92Å
356A96.1Very high95.7Very high60 Ų6071.5 Ų71.550%0.49637%0.372SS..Hα-helixtrans-66.3-42.2174.500000112.4Q352 L353 Q354 G359 A360Q352-A356 VanDerWaalsContact O-CB 3.27Å; Q352-A356 WeakPolarHBondContact O-CB 3.46Å; Q352-A356 PolarHBondContact O-N 3.02Å; L353-A356 PolarHBondContact O-N 3.23Å; Q354-A356 VanDerWaalsContact C-N 3.29Å; Q354-A356 PolarHBondContact O-N 2.89Å; A356-G359 PolarHBondContact O-N 2.91Å; A356-A360 WeakPolarHBondContact O-CB 3.48Å; A356-A360 PolarHBondContact O-N 2.78Å
357K97.1Very high95.6Very high112 Ų11272.7 Ų72.749%0.48738%0.376SS..Hα-helixtrans-63.8-50176.2-73.9171.5179.3174.10111.5L353 Q354 G359 A360 D361L353-K357 HydrophobicContact CD1-CD 4.5Å; L353-K357 HydrophobicContact CG-CD 4.38Å; L353-K357 WeakPolarHBondContact O-CG 3.37Å; L353-K357 PolarHBondContact O-N 3.33Å; L353-K357 VanDerWaalsContact O-N 3.08Å; Q354-K357 PolarHBondContact O-N 3.27Å; K357-G359 VanDerWaalsContact C-N 3.29Å; K357-G359 PolarHBondContact O-N 3.45Å; K357-A360 PolarHBondContact O-N 3.49Å; K357-D361 PolarHBondContact O-N 3.24Å
358E94.4Very high95.6Very high91 Ų9173.8 Ų73.843%0.42538%0.381SS..Hα-helixtrans-58.8-42177.2-70.1174.1-174.800111.6Q354 D361 V362Q354-E358 PolarHBondContact NE2-OE1 3.06Å; Q354-E358 WeakPolarHBondContact O-CG 3.45Å; Q354-E358 PolarHBondContact O-N 2.93Å; E358-D361 PolarHBondContact O-N 3.43Å; E358-V362 WeakPolarHBondContact O-CG2 3.42Å; E358-V362 PolarHBondContact O-N 3.36Å; E358-V362 VanDerWaalsContact O-N 3.14Å
359G94.8Very high95.4Very high3 Ų372.1 Ų72.13%0.03138%0.382CS..Hα-helixtrans-61.7-46.5174.800000112.6N250 T355 A356 K357 D361 V362 F363N250-G359 WeakPolarHBondContact ND2-CA 3.34Å; T355-G359 PolarHBondContact O-N 2.92Å; A356-G359 PolarHBondContact O-N 2.91Å; K357-G359 VanDerWaalsContact C-N 3.29Å; K357-G359 PolarHBondContact O-N 3.45Å; G359-D361 VanDerWaalsContact C-N 3.34Å; G359-D361 PolarHBondContact O-N 3.35Å; G359-V362 PolarHBondContact O-N 3.11Å; G359-F363 WeakPolarHBondContact O-CD2 3.47Å; G359-F363 WeakPolarHBondContact O-CG 3.3Å; G359-F363 PolarHBondContact O-N 3.3Å
360A96.6Very high95Very high55 Ų5571.5 Ų71.546%0.45537%0.371SS..Hα-helixtrans-60.4-42.1178.500000112.2A356 K357 F363 N364A356-A360 WeakPolarHBondContact O-CB 3.48Å; A356-A360 PolarHBondContact O-N 2.78Å; K357-A360 PolarHBondContact O-N 3.49Å; A360-F363 PolarHBondContact O-N 2.96Å; A360-N364 WeakPolarHBondContact O-CB 3.49Å; A360-N364 PolarHBondContact O-N 3.48Å
361D96.3Very high94.7Very high102 Ų10271.5 Ų71.555%0.54537%0.37SS..Hα-helixtrans-62.2-45.6177.2-72.4-23.4000111.5K357 E358 G359 N364 Q365K357-D361 PolarHBondContact O-N 3.24Å; E358-D361 PolarHBondContact O-N 3.43Å; G359-D361 VanDerWaalsContact C-N 3.34Å; G359-D361 PolarHBondContact O-N 3.35Å; D361-N364 PolarHBondContact O-N 2.91Å; D361-Q365 WeakPolarHBondContact O-CG 3.36Å; D361-Q365 PolarHBondContact O-N 3.41Å
362V95.8Very high94.4Very high51 Ų5172.3 Ų72.331%0.30939%0.388SS..Hα-helixtrans-63.8-43.6177172.40000111.4E358 G359 N364 Q365 H366E358-V362 WeakPolarHBondContact O-CG2 3.42Å; E358-V362 PolarHBondContact O-N 3.36Å; E358-V362 VanDerWaalsContact O-N 3.14Å; G359-V362 PolarHBondContact O-N 3.11Å; V362-N364 VanDerWaalsContact C-N 3.32Å; V362-N364 PolarHBondContact O-N 2.99Å; V362-Q365 WeakPolarHBondContact O-CB 3.47Å; V362-Q365 PolarHBondContact O-N 3.19Å; V362-H366 PolarHBondContact O-CD2 3.36Å; V362-H366 PolarHBondContact O-N 3.37Å; V362-H366 VanDerWaalsContact O-N 3.08Å
363F94.9Very high93.8Very high77 Ų7773 Ų7334%0.33839%0.392SS..Hα-helixtrans-67.1-34.2178.1-60.1-30.1000112.5I247 G359 A360 H366 L367I247-F363 HydrophobicContact CB-CE1 4.44Å; I247-F363 HydrophobicContact CB-CZ 4.44Å; I247-F363 HydrophobicContact CG1-CD1 4.49Å; I247-F363 HydrophobicContact CG1-CE1 3.48Å; I247-F363 VanDerWaalsContact CG1-CE1 3.48Å; I247-F363 HydrophobicContact CG1-CZ 3.66Å; G359-F363 WeakPolarHBondContact O-CD2 3.47Å; G359-F363 WeakPolarHBondContact O-CG 3.3Å; G359-F363 PolarHBondContact O-N 3.3Å; A360-F363 PolarHBondContact O-N 2.96Å; F363-H366 PolarHBondContact O-N 2.91Å; F363-L367 WeakPolarHBondContact O-CB 3.36Å; F363-L367 PolarHBondContact O-N 2.89Å
364N96.3Very high92.3Very high83 Ų8375 Ų7544%0.44442%0.423SS..Hα-helixtrans-64.8-41.1173.1-175.645.6000111.3A360 D361 V362 H366 L367 Q368A360-N364 WeakPolarHBondContact O-CB 3.49Å; A360-N364 PolarHBondContact O-N 3.48Å; D361-N364 PolarHBondContact O-N 2.91Å; V362-N364 VanDerWaalsContact C-N 3.32Å; V362-N364 PolarHBondContact O-N 2.99Å; N364-H366 VanDerWaalsContact C-N 3.34Å; N364-H366 PolarHBondContact O-N 3.45Å; N364-L367 WeakPolarHBondContact O-CB 3.46Å; N364-L367 PolarHBondContact O-N 2.84Å; N364-Q368 WeakPolarHBondContact O-CG 3.49Å; N364-Q368 PolarHBondContact O-N 3.17Å
365Q95.8Very high92.1Very high131 Ų13174.5 Ų74.561%0.61242%0.424SS*.Hα-helixtrans-59.1-44.9174.1-68.9170.31800111.8D361 V362 L367 Q368 A369D361-Q365 WeakPolarHBondContact O-CG 3.36Å; D361-Q365 PolarHBondContact O-N 3.41Å; V362-Q365 WeakPolarHBondContact O-CB 3.47Å; V362-Q365 PolarHBondContact O-N 3.19Å; Q365-L367 PolarHBondContact O-N 3.28Å; Q365-Q368 PolarHBondContact O-N 3.32Å; Q365-A369 PolarHBondContact O-N 3.43Å
366H95.4Very high92Very high27 Ų2778.3 Ų78.313%0.12545%0.446CS..Hα-helixtrans-59.4-45.8174-75.1-57.2000111.9V243 S246 V362 F363 N364 Q368 A369 F370V243-H366 HydrophobicContact CG2-CB 3.69Å; S246-H366 WeakPolarHBondContact CB-NE2 3.13Å; S246-H366 PolarHBondContact OG-NE2 3.42Å; V362-H366 PolarHBondContact O-CD2 3.36Å; V362-H366 PolarHBondContact O-N 3.37Å; V362-H366 VanDerWaalsContact O-N 3.08Å; F363-H366 PolarHBondContact O-N 2.91Å; N364-H366 VanDerWaalsContact C-N 3.34Å; N364-H366 PolarHBondContact O-N 3.45Å; H366-Q368 VanDerWaalsContact C-N 3.32Å; H366-Q368 PolarHBondContact O-N 3Å; H366-A369 WeakPolarHBondContact O-CB 3.37Å; H366-A369 PolarHBondContact O-N 3.04Å; H366-A369 VanDerWaalsContact O-N 3.11Å; H366-F370 VanDerWaalsContact O-CD2 3.3Å; H366-F370 WeakPolarHBondContact O-CD2 3.48Å; H366-F370 PolarHBondContact O-N 3.41Å
367L94.2Very high91.8Very high90 Ų9079.3 Ų79.347%0.47144%0.443SS..Hα-helixtrans-58.9-41.8177.8-178.564.8000112.2F363 N364 Q365 F370 K371F363-L367 WeakPolarHBondContact O-CB 3.36Å; F363-L367 PolarHBondContact O-N 2.89Å; N364-L367 WeakPolarHBondContact O-CB 3.46Å; N364-L367 PolarHBondContact O-N 2.84Å; Q365-L367 PolarHBondContact O-N 3.28Å; L367-F370 PolarHBondContact O-N 2.92Å; L367-K371 WeakPolarHBondContact O-CG 3.44Å; L367-K371 PolarHBondContact O-N 3.38Å
368Q94.3Very high91.5Very high95 Ų9577.4 Ų77.444%0.44444%0.441SS..Hα-helixtrans-65.2-40.5175.3-61.7-54.5-32.300111.7N364 Q365 H366 F370 K371 A372N364-Q368 WeakPolarHBondContact O-CG 3.49Å; N364-Q368 PolarHBondContact O-N 3.17Å; Q365-Q368 PolarHBondContact O-N 3.32Å; H366-Q368 VanDerWaalsContact C-N 3.32Å; H366-Q368 PolarHBondContact O-N 3Å; Q368-F370 VanDerWaalsContact C-N 3.31Å; Q368-F370 PolarHBondContact O-N 3.17Å; Q368-K371 PolarHBondContact O-N 3.1Å; Q368-A372 PolarHBondContact O-N 3.38Å
369A90.6Very high91.3Very high36 Ų3676.6 Ų76.630%0.29844%0.442SS..Hα-helixtrans-61-40.3175.200000111.7Q365 H366 A372 M373Q365-A369 PolarHBondContact O-N 3.43Å; H366-A369 WeakPolarHBondContact O-CB 3.37Å; H366-A369 PolarHBondContact O-N 3.04Å; H366-A369 VanDerWaalsContact O-N 3.11Å; A369-A372 PolarHBondContact O-N 3.12Å; A369-M373 WeakPolarHBondContact O-CG 3.37Å; A369-M373 PolarHBondContact O-N 2.99Å
370F89.7Confident91.1Very high57 Ų5781.5 Ų81.525%0.2547%0.469CS..Hα-helixtrans-63.9-42.2173.9-88.6-80.6000113K239 L240 V243 H366 L367 Q368 A372 M373K239-F370 HydrophobicContact CB-CE1 4.02Å; K239-F370 HydrophobicContact CB-CE2 3.94Å; K239-F370 HydrophobicContact CB-CZ 3.52Å; L240-F370 HydrophobicContact CD2-CE1 4.35Å; L240-F370 HydrophobicContact CD2-CZ 3.75Å; L240-F370 HydrophobicContact CG-CE1 4.39Å; L240-F370 HydrophobicContact CG-CZ 3.9Å; V243-F370 HydrophobicContact CG2-CE2 3.79Å; H366-F370 VanDerWaalsContact O-CD2 3.3Å; H366-F370 WeakPolarHBondContact O-CD2 3.48Å; H366-F370 PolarHBondContact O-N 3.41Å; L367-F370 PolarHBondContact O-N 2.92Å; Q368-F370 VanDerWaalsContact C-N 3.31Å; Q368-F370 PolarHBondContact O-N 3.17Å; F370-A372 VanDerWaalsContact C-N 3.26Å; F370-A372 PolarHBondContact O-N 3.39Å; F370-M373 HydrophobicContact CB-CE 4.47Å; F370-M373 HydrophobicContact CD1-CE 3.23Å; F370-M373 HydrophobicContact CE1-CE 3.47Å; F370-M373 VanDerWaalsContact CE1-CE 3.47Å; F370-M373 HydrophobicContact CG-CE 3.94Å; F370-M373 HydrophobicContact CZ-CE 4.31Å; F370-M373 WeakPolarHBondContact O-CB 3.47Å; F370-M373 PolarHBondContact O-N 3.23Å; F370-M373 VanDerWaalsContact O-N 3.1Å
371K90.4Very high90.7Very high117 Ų11783.4 Ų83.451%0.50947%0.47SS..Hα-helixtrans-61.8-35.2176.2-73.3174.7-179.2175.10112.6L367 Q368 M373 A374L367-K371 WeakPolarHBondContact O-CG 3.44Å; L367-K371 PolarHBondContact O-N 3.38Å; Q368-K371 PolarHBondContact O-N 3.1Å; K371-M373 PolarHBondContact O-N 3.04Å; K371-A374 PolarHBondContact O-N 3.05Å
372A88.5Confident90.3Very high86 Ų8681.9 Ų81.971%0.71146%0.464SS*.THydrogen-bonded Turntrans-74.1-10.3177.500000113.8Q368 A369 F370Q368-A372 PolarHBondContact O-N 3.38Å; A369-A372 PolarHBondContact O-N 3.12Å; F370-A372 VanDerWaalsContact C-N 3.26Å; F370-A372 PolarHBondContact O-N 3.39Å
373M82.2Confident89.8Confident75 Ų7584.5 Ų84.537%0.36948%0.477SS..THydrogen-bonded Turntrans-89.8-19.1173.7-65.8-164.5-6100113.6K239 A369 F370 K371K239-M373 HydrophobicContact CB-CE 3.92Å; K239-M373 HydrophobicContact CB-SD 4.37Å; K239-M373 HydrophobicContact CG-CE 3.78Å; K239-M373 HydrophobicContact CG-SD 3.6Å; K239-M373 VanDerWaalsContact CG-SD 3.6Å; A369-M373 WeakPolarHBondContact O-CG 3.37Å; A369-M373 PolarHBondContact O-N 2.99Å; F370-M373 HydrophobicContact CB-CE 4.47Å; F370-M373 HydrophobicContact CD1-CE 3.23Å; F370-M373 HydrophobicContact CE1-CE 3.47Å; F370-M373 VanDerWaalsContact CE1-CE 3.47Å; F370-M373 HydrophobicContact CG-CE 3.94Å; F370-M373 HydrophobicContact CZ-CE 4.31Å; F370-M373 WeakPolarHBondContact O-CB 3.47Å; F370-M373 PolarHBondContact O-N 3.23Å; F370-M373 VanDerWaalsContact O-N 3.1Å; K371-M373 PolarHBondContact O-N 3.04Å
374A65.2Low89.3Confident140 Ų14085.2 Ų85.2100%1.15749%0.49SS*.  trans-81.5017300000109.8K371K371-A374 PolarHBondContact O-N 3.05Å

Retrieved 374 of 374 residues in 794.7 ms (Link to these results)

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