A0A087XVH9_POEFO Loading...

Nucleolar protein 56

Involved in the early to middle stages of 60S ribosomal subunit biogenesis. Required for the biogenesis of box C/D snoRNAs such U3, U8 and U14 snoRNAs. Part of the small subunit (SSU) processome, first precursor of the small eukaryotic ribosomal subunit. During the assembly of the SSU processome in the nucleolus, many ribosome biogenesis factors, an RNA chaperone and ribosomal proteins associate with the nascent pre-rRNA and work in concert to generate RNA folding, modifications, rearrangements and cleavage as well as targeted degradation of pre-ribosomal RNA by the RNA exosome. Core component of box C/D small nucleolar ribonucleoprotein (snoRNP) complexes that function in methylation of multiple sites on ribosomal RNAs (rRNAs) and messenger RNAs (mRNAs).

AlphaFold DB (A0A3B3U8L9), UniProt , Accession A0A087XVH9, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 536 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
1M50.6Low83.4Confident179 Ų17946.3 Ų46.388%0.88224%0.24SC*.  0114.70-164.5174.9-16900105.9L3 K90M1-L3 PolarHBondContact O-N 3.48Å; M1-K90 HydrophobicContact CE-CB 4.34Å; M1-K90 HydrophobicContact CE-CD 4.35Å; M1-K90 HydrophobicContact SD-CB 4.36Å; M1-K90 HydrophobicContact SD-CD 3.42Å; M1-K90 WeakPolarHBondContact SD-CD 3.32Å
2V58.7Low84.1Confident59 Ų5944.3 Ų44.336%0.35823%0.234SC..  trans-66.3121.3-175177.40000108.5L4 A18 V19V2-L4 WeakPolarHBondContact CG1-O 3.3Å; V2-A18 HydrophobicContact CG1-CB 3.84Å; V2-A18 HydrophobicContact CG2-CB 4.39Å; V2-V19 WeakPolarHBondContact CG1-O 3.27Å
3L73.9Confident84.8Confident111 Ų11140.9 Ų40.958%0.58122%0.216SC*.  trans-90.1-32.8-178.6-77.2157.3000112.1M1 V93M1-L3 PolarHBondContact O-N 3.48Å; L3-V93 WeakPolarHBondContact O-CB 3.35Å; L3-V93 PolarHBondContact O-N 3.47Å
4L85.9Confident85.5Confident22 Ų2238.1 Ų38.112%0.11520%0.2CC..EExtended strand (participates in β ladder)trans-114.6125.9-174.8-17965.8000111.8V2 V6 V19 V93 V119 I122V2-L4 WeakPolarHBondContact CG1-O 3.3Å; L4-V6 HydrophobicContact CG-CG2 4.43Å; L4-V19 HydrophobicContact CB-CB 4.26Å; L4-V19 HydrophobicContact CD2-CB 4.35Å; L4-V19 HydrophobicContact CD2-CG1 4.44Å; L4-V19 HydrophobicContact CD2-CG2 4.19Å; L4-V19 HydrophobicContact CG-CB 4.39Å; L4-V19 HydrophobicContact CG-CG2 4.2Å; L4-V19 WeakPolarHBondContact O-CB 3.32Å; L4-V19 PolarHBondContact O-N 3.08Å; L4-V93 WeakPolarHBondContact CA-O 2.91Å; L4-V93 HydrophobicContact CD1-CB 4.1Å; L4-V93 HydrophobicContact CD1-CG1 3.76Å; L4-V119 HydrophobicContact CD2-CG2 4.41Å; L4-I122 HydrophobicContact CD2-CD1 4.37Å
5H90.1Very high86.1Confident29 Ų2935.5 Ų35.513%0.13419%0.187CC..EExtended strand (participates in β ladder)trans-111.9137.8168.2-65.174.1000109L16 F17 L84 V93 L94 G95H5-L16 HydrophobicContact CB-CD1 3.92Å; H5-L16 HydrophobicContact CB-CD2 4.49Å; H5-L16 HydrophobicContact CB-CG 4.19Å; H5-F17 CarbonylContact C-O 3.52Å; H5-F17 WeakPolarHBondContact CA-O 3.49Å; H5-L84 HydrophobicContact CB-CD2 4.13Å; H5-V93 PolarHBondContact N-O 3.46Å; H5-L94 HydrophobicContact CB-CD1 4.29Å; H5-L94 CarbonylContact O-C 3.47Å; H5-L94 WeakPolarHBondContact O-CA 3.45Å; H5-G95 PolarHBondContact O-N 2.84Å
6V92Very high86.5Confident0 Ų033.4 Ų33.40%018%0.176CC..EExtended strand (participates in β ladder)trans-110124.4177.7176.70000109.3L4 F17 V19 G95 V119 I122L4-V6 HydrophobicContact CG-CG2 4.43Å; V6-F17 PolarHBondContact N-O 3.45Å; V6-F17 PolarHBondContact O-N 3.01Å; V6-V19 HydrophobicContact CG2-CG2 3.68Å; V6-G95 WeakPolarHBondContact CA-O 3.08Å; V6-V119 HydrophobicContact CG1-CG1 4.39Å; V6-V119 HydrophobicContact CG2-CG1 4.45Å; V6-I122 HydrophobicContact CB-CG2 4.4Å; V6-I122 HydrophobicContact CG1-CG2 4.46Å; V6-I122 HydrophobicContact CG2-CD1 4.45Å; V6-I122 HydrophobicContact CG2-CG2 3.98Å
7L93.3Very high86.9Confident2 Ų231.4 Ų31.41%0.0117%0.165CC..EExtended strand (participates in β ladder)trans-82.8126.1172.6178.165.4000109.3E9 L76 F79 L80 L94 G95 L105L7-E9 HydrophobicContact CG-CG 4.47Å; L7-L76 HydrophobicContact CD1-CD1 4.06Å; L7-L76 HydrophobicContact CD2-CD1 3.94Å; L7-L76 HydrophobicContact CD2-CD2 4.49Å; L7-F79 HydrophobicContact CD1-CE1 4.14Å; L7-L80 HydrophobicContact CD1-CD2 4.37Å; L7-L94 HydrophobicContact CB-CD1 4.21Å; L7-G95 PolarHBondContact N-O 2.93Å; L7-L105 HydrophobicContact CD2-CD1 4.28Å
8F94.2Very high87.1Confident9 Ų930.2 Ų30.24%0.03916%0.16CC..EExtended strand (participates in β ladder)trans-122.3123.9174-174.5-101.4000110.6H10 A15 F17 T123 V126 R127 F130F8-H10 HydrophobicContact CD1-CB 4.31Å; F8-H10 HydrophobicContact CE1-CB 3.96Å; F8-A15 HydrophobicContact CB-CB 4.44Å; F8-A15 PolarHBondContact N-O 3.16Å; F8-A15 PolarHBondContact O-N 3.44Å; F8-F17 HydrophobicContact CB-CD2 4.06Å; F8-F17 HydrophobicContact CB-CE2 3.9Å; F8-F17 HydrophobicContact CG-CE2 4.49Å; F8-T123 HydrophobicContact CD2-CG2 4Å; F8-T123 HydrophobicContact CE2-CG2 4.24Å; F8-V126 HydrophobicContact CB-CG1 3.92Å; F8-V126 HydrophobicContact CD1-CG1 3.8Å; F8-V126 HydrophobicContact CD2-CB 4.36Å; F8-V126 HydrophobicContact CD2-CG1 3.72Å; F8-V126 HydrophobicContact CE1-CG1 4.21Å; F8-V126 HydrophobicContact CE2-CG1 4.14Å; F8-V126 HydrophobicContact CG-CG1 3.52Å; F8-V126 HydrophobicContact CZ-CG1 4.37Å; F8-R127 HydrophobicContact CE2-CB 3.9Å; F8-R127 HydrophobicContact CE2-CG 4.44Å; F8-R127 HydrophobicContact CZ-CB 4Å; F8-R127 HydrophobicContact CZ-CG 4.23Å; F8-F130 AromaticContact CD1-CD2 3.43Å; F8-F130 HydrophobicContact CD1-CD2 3.43Å; F8-F130 VanDerWaalsContact CD1-CD2 3.43Å; F8-F130 AromaticContact CD1-CE2 3.39Å; F8-F130 HydrophobicContact CD1-CE2 3.39Å; F8-F130 HydrophobicContact CD1-CG 4.21Å; F8-F130 HydrophobicContact CD1-CZ 4.13Å; F8-F130 HydrophobicContact CE1-CB 4.21Å; F8-F130 HydrophobicContact CE1-CD1 4.19Å; F8-F130 AromaticContact CE1-CD2 3.33Å; F8-F130 HydrophobicContact CE1-CD2 3.33Å; F8-F130 HydrophobicContact CE1-CE1 4.45Å; F8-F130 AromaticContact CE1-CE2 3.65Å; F8-F130 HydrophobicContact CE1-CE2 3.65Å; F8-F130 AromaticContact CE1-CG 3.64Å; F8-F130 HydrophobicContact CE1-CG 3.64Å; F8-F130 HydrophobicContact CE1-CZ 4.2Å; F8-F130 HydrophobicContact CZ-CD2 4.4Å
9E93.1Very high87.1Confident58 Ų5829.1 Ų29.127%0.27116%0.155SC..EExtended strand (participates in β ladder)trans-99.8124-178.7-57.1167.9173.700108.9L7 Y14 I67 I101L7-E9 HydrophobicContact CG-CG 4.47Å; E9-Y14 HydrophobicContact CB-CD1 4.29Å; E9-Y14 HydrophobicContact CB-CE1 4.35Å; E9-Y14 HydrophobicContact CG-CD1 3.87Å; E9-Y14 HydrophobicContact CG-CE1 3.88Å; E9-I67 HydrophobicContact CB-CD1 4.27Å; E9-I67 HydrophobicContact CG-CD1 4.24Å; E9-I67 WeakPolarHBondContact OE2-CG2 3.43Å; E9-I101 WeakPolarHBondContact OE1-CD1 3.39Å
10H93.1Very high86.9Confident22 Ų2235.8 Ų35.810%0.10218%0.178CC..EExtended strand (participates in β ladder)trans-128.2159.5178.5-170.5-101.7000111.1F8 S12 G13 F130 Q146F8-H10 HydrophobicContact CD1-CB 4.31Å; F8-H10 HydrophobicContact CE1-CB 3.96Å; H10-S12 PolarHBondContact CE1-OG 3.44Å; H10-S12 WeakPolarHBondContact ND1-CB 3.4Å; H10-S12 PolarHBondContact ND1-N 3.08Å; H10-S12 VanDerWaalsContact ND1-N 3.14Å; H10-S12 PolarHBondContact ND1-OG 3.45Å; H10-S12 VanDerWaalsContact ND1-OG 3.07Å; H10-S12 PolarHBondContact O-N 3.18Å; H10-G13 PolarHBondContact N-O 3.03Å; H10-G13 PolarHBondContact O-N 3.09Å; H10-G13 VanDerWaalsContact O-O 3.05Å; H10-F130 HydrophobicContact CB-CD1 4.22Å; H10-F130 HydrophobicContact CB-CE1 3.51Å; H10-F130 HydrophobicContact CB-CE2 4.42Å; H10-F130 HydrophobicContact CB-CZ 3.62Å; H10-F130 AromaticContact CD2-CD1 3.65Å; H10-F130 AromaticContact CD2-CE1 3.74Å; H10-F130 AromaticContact CE1-CE1 3.98Å; H10-F130 AromaticContact CG-CD1 3.66Å; H10-F130 AromaticContact CG-CE1 3.22Å; H10-F130 AromaticContact CG-CZ 3.9Å; H10-F130 AromaticContact ND1-CD1 3.93Å; H10-F130 AromaticContact ND1-CE1 3.39Å; H10-F130 WeakPolarHBondContact ND1-CE1 3.47Å; H10-F130 AromaticContact NE2-CD1 3.96Å; H10-Q146 PolarHBondContact NE2-NE2 3.47Å
11A92.8Very high86.2Confident18 Ų1841.9 Ų41.915%0.14921%0.206CC..THydrogen-bonded Turntrans-57.8-19.5175.200000114A145 Q146 L149A11-A145 HydrophobicContact CB-CB 4.29Å; A11-Q146 HydrophobicContact CB-CB 4.37Å; A11-Q146 HydrophobicContact CB-CG 3.83Å; A11-L149 HydrophobicContact CB-CB 4.25Å; A11-L149 HydrophobicContact CB-CD2 3.69Å
12S91.8Very high87Confident23 Ų2336 Ų3616%0.16118%0.18CC..THydrogen-bonded Turntrans-93-14.2179.3-49.70000113.3H10 P53 F54H10-S12 PolarHBondContact CE1-OG 3.44Å; H10-S12 WeakPolarHBondContact ND1-CB 3.4Å; H10-S12 PolarHBondContact ND1-N 3.08Å; H10-S12 VanDerWaalsContact ND1-N 3.14Å; H10-S12 PolarHBondContact ND1-OG 3.45Å; H10-S12 VanDerWaalsContact ND1-OG 3.07Å; H10-S12 PolarHBondContact O-N 3.18Å; S12-P53 WeakPolarHBondContact O-CA 3.34Å; S12-F54 PolarHBondContact O-N 2.9Å
13G93.3Very high87.5Confident0 Ų039.7 Ų39.70%019%0.193CC..EExtended strand (participates in β ladder)trans150.7-177.5-173.100000114.4H10 F52H10-G13 PolarHBondContact N-O 3.03Å; H10-G13 PolarHBondContact O-N 3.09Å; H10-G13 VanDerWaalsContact O-O 3.05Å; G13-F52 CarbonylContact C-O 3.59Å; G13-F52 WeakPolarHBondContact CA-O 3.48Å
14Y94.5Very high87.3Confident1 Ų140.4 Ų40.40%0.00419%0.194CC..EExtended strand (participates in β ladder)trans-93.7136.8173.4-60.3-63000110.9E9 F51 F52 F54 N63 I67 L76E9-Y14 HydrophobicContact CB-CD1 4.29Å; E9-Y14 HydrophobicContact CB-CE1 4.35Å; E9-Y14 HydrophobicContact CG-CD1 3.87Å; E9-Y14 HydrophobicContact CG-CE1 3.88Å; Y14-F51 WeakPolarHBondContact O-CA 3.04Å; Y14-F51 VanDerWaalsContact O-CD2 3.26Å; Y14-F51 WeakPolarHBondContact O-CD2 3.42Å; Y14-F52 HydrophobicContact CD2-CD1 4.06Å; Y14-F52 PolarHBondContact N-O 3.49Å; Y14-F52 PolarHBondContact O-N 3.14Å; Y14-F54 HydrophobicContact CD1-CZ 4.49Å; Y14-F54 AromaticContact CD2-CE1 3.8Å; Y14-F54 HydrophobicContact CD2-CE1 3.8Å; Y14-F54 HydrophobicContact CD2-CZ 4.06Å; Y14-F54 HydrophobicContact CE1-CZ 4.2Å; Y14-F54 AromaticContact CE2-CE1 3.52Å; Y14-F54 HydrophobicContact CE2-CE1 3.52Å; Y14-F54 AromaticContact CE2-CZ 3.72Å; Y14-F54 HydrophobicContact CE2-CZ 3.72Å; Y14-F54 HydrophobicContact CG-CZ 4.42Å; Y14-F54 AromaticContact CZ-CZ 3.8Å; Y14-N63 VanDerWaalsContact CE2-OD1 3.28Å; Y14-N63 WeakPolarHBondContact CE2-OD1 3.32Å; Y14-N63 WeakPolarHBondContact OH-CB 3.36Å; Y14-N63 PolarHBondContact OH-OD1 2.87Å; Y14-I67 HydrophobicContact CE1-CD1 3.63Å; Y14-I67 HydrophobicContact CE1-CG1 4.38Å; Y14-I67 WeakPolarHBondContact OH-CD1 3.3Å; Y14-L76 HydrophobicContact CD1-CD1 3.97Å; Y14-L76 HydrophobicContact CD2-CB 4.42Å; Y14-L76 HydrophobicContact CD2-CD1 4.12Å; Y14-L76 HydrophobicContact CE1-CD1 4.05Å; Y14-L76 HydrophobicContact CE1-CD2 4.5Å; Y14-L76 HydrophobicContact CE2-CB 3.82Å; Y14-L76 HydrophobicContact CE2-CD1 4.2Å; Y14-L76 HydrophobicContact CG-CD1 4.01Å
15A94.3Very high86.7Confident0 Ų047.7 Ų47.70%023%0.231CC..EExtended strand (participates in β ladder)trans-122.6136.4174.200000110F8 F17 L48 F51 F130F8-A15 HydrophobicContact CB-CB 4.44Å; F8-A15 PolarHBondContact N-O 3.16Å; F8-A15 PolarHBondContact O-N 3.44Å; A15-F17 HydrophobicContact CB-CD2 4.17Å; A15-F17 HydrophobicContact CB-CE2 3.48Å; A15-F17 VanDerWaalsContact CB-CE2 3.48Å; A15-F17 HydrophobicContact CB-CZ 4.03Å; A15-L48 HydrophobicContact CB-CD1 4.16Å; A15-F51 HydrophobicContact CB-CD2 3.92Å; A15-F130 HydrophobicContact CB-CE2 3.79Å; A15-F130 HydrophobicContact CB-CZ 4.31Å
16L93.3Very high85.8Confident1 Ų146.6 Ų46.61%0.00523%0.228CC..EExtended strand (participates in β ladder)trans-111.7124.3172.7-167.969.4000108.5H5 A49 A50 F79 L80 N83 L84 L94H5-L16 HydrophobicContact CB-CD1 3.92Å; H5-L16 HydrophobicContact CB-CD2 4.49Å; H5-L16 HydrophobicContact CB-CG 4.19Å; L16-A49 WeakPolarHBondContact O-CA 3.4Å; L16-A49 WeakPolarHBondContact O-CB 3.49Å; L16-A49 PolarHBondContact O-N 3.11Å; L16-A50 HydrophobicContact CB-CB 4.36Å; L16-A50 PolarHBondContact N-O 2.96Å; L16-A50 PolarHBondContact O-N 3.31Å; L16-A50 VanDerWaalsContact O-N 3.16Å; L16-F79 HydrophobicContact CB-CE1 3.93Å; L16-F79 HydrophobicContact CB-CZ 3.71Å; L16-L80 HydrophobicContact CD1-CD2 4.44Å; L16-N83 HydrophobicContact CD2-CB 3.86Å; L16-L84 HydrophobicContact CD2-CD2 3.99Å; L16-L84 HydrophobicContact CD2-CG 4.28Å; L16-L94 HydrophobicContact CD1-CD1 3.81Å
17F92.1Very high84.9Confident0 Ų049 Ų490%024%0.24CC..EExtended strand (participates in β ladder)trans-112.2130.6-178.7-71.6-80.1000110.7H5 V6 F8 A15 V46 S47 L48 V126 F130 L133H5-F17 CarbonylContact C-O 3.52Å; H5-F17 WeakPolarHBondContact CA-O 3.49Å; V6-F17 PolarHBondContact N-O 3.45Å; V6-F17 PolarHBondContact O-N 3.01Å; F8-F17 HydrophobicContact CB-CD2 4.06Å; F8-F17 HydrophobicContact CB-CE2 3.9Å; F8-F17 HydrophobicContact CG-CE2 4.49Å; A15-F17 HydrophobicContact CB-CD2 4.17Å; A15-F17 HydrophobicContact CB-CE2 3.48Å; A15-F17 VanDerWaalsContact CB-CE2 3.48Å; A15-F17 HydrophobicContact CB-CZ 4.03Å; F17-V46 HydrophobicContact CB-CG1 3.56Å; F17-V46 HydrophobicContact CD1-CG1 3.65Å; F17-V46 HydrophobicContact CG-CG1 3.87Å; F17-S47 CarbonylContact C-O 3.46Å; F17-S47 WeakPolarHBondContact CA-O 3.43Å; F17-L48 HydrophobicContact CD1-CB 4.17Å; F17-L48 HydrophobicContact CD1-CD1 4.03Å; F17-L48 HydrophobicContact CE1-CB 3.91Å; F17-L48 HydrophobicContact CE1-CD1 3.54Å; F17-L48 HydrophobicContact CE1-CG 4.34Å; F17-L48 HydrophobicContact CE2-CD1 4.32Å; F17-L48 HydrophobicContact CZ-CD1 3.72Å; F17-V126 HydrophobicContact CD2-CG1 3.88Å; F17-V126 HydrophobicContact CD2-CG2 4.05Å; F17-V126 HydrophobicContact CE2-CB 4.47Å; F17-V126 HydrophobicContact CE2-CG1 3.33Å; F17-V126 HydrophobicContact CE2-CG2 4.23Å; F17-V126 HydrophobicContact CG-CG2 4.22Å; F17-V126 HydrophobicContact CZ-CG1 3.78Å; F17-F130 HydrophobicContact CE2-CD2 4.41Å; F17-F130 HydrophobicContact CE2-CE2 4.24Å; F17-F130 HydrophobicContact CZ-CD2 4.23Å; F17-F130 HydrophobicContact CZ-CE2 4.19Å; F17-L133 HydrophobicContact CE1-CB 3.97Å; F17-L133 HydrophobicContact CE1-CD1 3.96Å; F17-L133 HydrophobicContact CE1-CG 4.42Å; F17-L133 HydrophobicContact CZ-CB 4.15Å; F17-L133 HydrophobicContact CZ-CD1 4.08Å
18A90.3Very high83.8Confident9 Ų957 Ų577%0.07428%0.281CS..EExtended strand (participates in β ladder)trans-88.9123.6172.800000109.8V2 S47 A49V2-A18 HydrophobicContact CG1-CB 3.84Å; V2-A18 HydrophobicContact CG2-CB 4.39Å; A18-S47 PolarHBondContact N-O 2.97Å; A18-S47 PolarHBondContact O-N 3.2Å; A18-S47 PolarHBondContact O-OG 3.11Å; A18-A49 HydrophobicContact CB-CB 4.19Å
19V88.1Confident83.3Confident9 Ų960.8 Ų60.86%0.05530%0.302CS..EExtended strand (participates in β ladder)trans-93118.1-179.4-177.90000109.4V2 L4 V6 V22 I122V2-V19 WeakPolarHBondContact CG1-O 3.27Å; L4-V19 HydrophobicContact CB-CB 4.26Å; L4-V19 HydrophobicContact CD2-CB 4.35Å; L4-V19 HydrophobicContact CD2-CG1 4.44Å; L4-V19 HydrophobicContact CD2-CG2 4.19Å; L4-V19 HydrophobicContact CG-CB 4.39Å; L4-V19 HydrophobicContact CG-CG2 4.2Å; L4-V19 WeakPolarHBondContact O-CB 3.32Å; L4-V19 PolarHBondContact O-N 3.08Å; V6-V19 HydrophobicContact CG2-CG2 3.68Å; V19-V22 HydrophobicContact CG1-CB 4.24Å; V19-V22 HydrophobicContact CG1-CG2 3.27Å; V19-I122 HydrophobicContact CG1-CD1 3.98Å; V19-I122 HydrophobicContact CG2-CD1 3.97Å; V19-I122 HydrophobicContact CG2-CG2 4.31Å
20R82.7Confident82.8Confident163 Ų16361.7 Ų61.762%0.61531%0.312SS*.  trans-81.5-59.4-175.1-66.5-177.4179.7-170-1.1112M45R20-M45 PolarHBondContact N-O 3.37Å
21E71.4Confident82.3Confident165 Ų16566.8 Ų66.877%0.77134%0.336SS*.  trans-144.3125.7-177.3-69.8179.7170.900108.4
22V68Low81.6Confident56 Ų5667.6 Ų67.634%0.33934%0.339SS..  trans-138.3128.9174.1174.80000108.4V19 A118 I122V19-V22 HydrophobicContact CG1-CB 4.24Å; V19-V22 HydrophobicContact CG1-CG2 3.27Å; V22-A118 HydrophobicContact CG1-CB 4.02Å; V22-I122 HydrophobicContact CG1-CD1 4.45Å; V22-I122 HydrophobicContact CG2-CD1 3.82Å; V22-I122 HydrophobicContact CG2-CG1 4.24Å
23E69.4Low81Confident135 Ų13572.8 Ų72.863%0.63136%0.361SS*.  trans-91.5101.7179.5-167.5171.7-157.200109.4I25 M27E23-I25 PolarHBondContact O-N 3.24Å; E23-M27 WeakPolarHBondContact O-CG 3.43Å
24E69.8Low80.5Confident126 Ų12678.7 Ų78.759%0.58939%0.389SS*.SBendtrans-69.4-31.6-175-67.9-174.2162.800113.3M27 A118E24-M27 HydrophobicContact CB-CE 4.46Å; E24-M27 VanDerWaalsContact O-CE 3.3Å; E24-M27 WeakPolarHBondContact O-CE 3.42Å; E24-A118 HydrophobicContact CG-CB 4.29Å
25I73.3Confident79.9Confident175 Ų17579.2 Ų79.290%0.89739%0.392SS*.THydrogen-bonded Turntrans-76.7-31.6-174.5-57.3172.3000111.2E23E23-I25 PolarHBondContact O-N 3.24Å
26G71.8Confident79.5Confident7 Ų780.5 Ų80.57%0.07240%0.4CS..THydrogen-bonded Turntrans-986.8-175.800000115.4L28 L29 V32G26-L28 PolarHBondContact O-N 3.47Å; G26-L28 VanDerWaalsContact O-N 3.08Å; G26-L29 WeakPolarHBondContact O-CB 3.44Å; G26-L29 WeakPolarHBondContact O-CG 3.41Å; G26-L29 PolarHBondContact O-N 2.91Å; G26-V32 WeakPolarHBondContact O-CG2 3.46Å
27M71.8Confident79.1Confident50 Ų5085.7 Ų85.725%0.24643%0.428CS..THydrogen-bonded Turntrans-58.3-28.8-171.3-70.2-169.3-72.800114.9E23 E24 L29 A118E23-M27 WeakPolarHBondContact O-CG 3.43Å; E24-M27 HydrophobicContact CB-CE 4.46Å; E24-M27 VanDerWaalsContact O-CE 3.3Å; E24-M27 WeakPolarHBondContact O-CE 3.42Å; M27-L29 VanDerWaalsContact C-N 3.3Å; M27-A118 HydrophobicContact CE-CB 4.2Å; M27-A118 WeakPolarHBondContact SD-CA 3.24Å; M27-A118 HydrophobicContact SD-CB 3.59Å; M27-A118 VanDerWaalsContact SD-CB 3.59Å
28L71.8Confident79Confident169 Ų16988.2 Ų88.289%0.88545%0.445SS*.THydrogen-bonded Turntrans-87.31.4-179.9-63173.8000113.1G26G26-L28 PolarHBondContact O-N 3.47Å; G26-L28 VanDerWaalsContact O-N 3.08Å
29L83.4Confident78.8Confident89 Ų8990.7 Ų90.747%0.46646%0.457SS..SBendtrans-72.5132.2174.7-68.5171.6000109.5G26 M27 Q31 V32 E33G26-L29 WeakPolarHBondContact O-CB 3.44Å; G26-L29 WeakPolarHBondContact O-CG 3.41Å; G26-L29 PolarHBondContact O-N 2.91Å; M27-L29 VanDerWaalsContact C-N 3.3Å; L29-Q31 PolarHBondContact O-N 3.38Å; L29-Q31 VanDerWaalsContact O-N 3.07Å; L29-V32 HydrophobicContact CB-CG2 4.18Å; L29-V32 WeakPolarHBondContact O-CB 3.48Å; L29-V32 PolarHBondContact O-N 2.9Å; L29-E33 PolarHBondContact O-N 3.07Å
30P81.6Confident78.8Confident77 Ų7793 Ų9350%0.548%0.482SS..Hα-helixtrans-54-32.6179.4-27.534.2000113.7V32 E33 E34P30-V32 VanDerWaalsContact C-N 3.29Å; P30-V32 PolarHBondContact O-N 3.49Å; P30-E33 PolarHBondContact O-N 3.31Å; P30-E34 WeakPolarHBondContact O-CG 3.16Å; P30-E34 PolarHBondContact O-N 3.06Å
31Q82.8Confident78.9Confident129 Ų12990.4 Ų90.460%0.60348%0.475SS*.Hα-helixtrans-64.5-34.5178-60.583.8-3.400112.4L29 S35L29-Q31 PolarHBondContact O-N 3.38Å; L29-Q31 VanDerWaalsContact O-N 3.07Å; Q31-S35 PolarHBondContact O-N 3.33Å
32V77.8Confident79.7Confident35 Ų3582.7 Ų82.721%0.21244%0.439CS..Hα-helixtrans-76-38.2177.4-179.60000109.8G26 L29 P30 S35 V36G26-V32 WeakPolarHBondContact O-CG2 3.46Å; L29-V32 HydrophobicContact CB-CG2 4.18Å; L29-V32 WeakPolarHBondContact O-CB 3.48Å; L29-V32 PolarHBondContact O-N 2.9Å; P30-V32 VanDerWaalsContact C-N 3.29Å; P30-V32 PolarHBondContact O-N 3.49Å; V32-S35 WeakPolarHBondContact O-CB 3.33Å; V32-S35 PolarHBondContact O-N 3.38Å; V32-S35 PolarHBondContact O-OG 2.88Å; V32-V36 PolarHBondContact O-N 3.42Å
33E80.1Confident80.7Confident132 Ų13283.3 Ų83.362%0.61744%0.441SS*.Hα-helixtrans-61.4-47.5174-171.2177.8-177.900112L29 P30 S35 V36 L37L29-E33 PolarHBondContact O-N 3.07Å; P30-E33 PolarHBondContact O-N 3.31Å; E33-S35 PolarHBondContact O-N 2.83Å; E33-V36 PolarHBondContact O-N 3.48Å; E33-L37 PolarHBondContact O-N 2.89Å
34E83.2Confident81.4Confident125 Ų12580.5 Ų80.558%0.58444%0.436SS*.Hα-helixtrans-59.7-30.2175.8-76.1-176.6-179.800112.8P30 V36 L37 S38P30-E34 WeakPolarHBondContact O-CG 3.16Å; P30-E34 PolarHBondContact O-N 3.06Å; E34-V36 VanDerWaalsContact C-N 3.32Å; E34-L37 PolarHBondContact O-N 3.27Å; E34-S38 PolarHBondContact O-N 3.17Å
35S82Confident82.2Confident11 Ų1176.8 Ų76.88%0.07742%0.419CS..Hα-helixtrans-69.3-30.4178.380.70000112.8Q31 V32 E33 K41 M45Q31-S35 PolarHBondContact O-N 3.33Å; V32-S35 WeakPolarHBondContact O-CB 3.33Å; V32-S35 PolarHBondContact O-N 3.38Å; V32-S35 PolarHBondContact O-OG 2.88Å; E33-S35 PolarHBondContact O-N 2.83Å; S35-K41 WeakPolarHBondContact O-CB 3.48Å; S35-M45 WeakPolarHBondContact OG-CE 3.18Å
36V84.1Confident82.9Confident28 Ų2868.5 Ų68.517%0.1738%0.377CS..Hα-helixtrans-74.3-32.6176177.80000111.4V32 E33 E34 S38 F42 G125 H129V32-V36 PolarHBondContact O-N 3.42Å; E33-V36 PolarHBondContact O-N 3.48Å; E34-V36 VanDerWaalsContact C-N 3.32Å; V36-S38 VanDerWaalsContact C-N 3.29Å; V36-S38 PolarHBondContact O-N 3Å; V36-F42 HydrophobicContact CB-CD2 4.37Å; V36-F42 HydrophobicContact CG1-CD2 4.01Å; V36-F42 HydrophobicContact CG1-CE2 4.07Å; V36-F42 HydrophobicContact CG2-CD2 4.39Å; V36-G125 VanDerWaalsContact CG1-CA 3.43Å; V36-H129 PolarHBondContact O-CD2 3.18Å; V36-H129 PolarHBondContact O-NE2 3.11Å
37L86.8Confident83.7Confident110 Ų11069.7 Ų69.758%0.57638%0.384SS*.Hα-helixtrans-67.4-30.2177.3-63.9178.5000112.6E33 E34 L128 H129E33-L37 PolarHBondContact O-N 2.89Å; E34-L37 PolarHBondContact O-N 3.27Å; L37-L128 HydrophobicContact CD2-CD2 3.94Å; L37-H129 PolarHBondContact O-CE1 3.13Å; L37-H129 PolarHBondContact O-NE2 3.45Å
38S89.3Confident84.7Confident53 Ų5370.2 Ų70.237%0.37139%0.387SS..SBendtrans-89.4117.1179.6-175.20000112.1E34 V36 G40 K41 F42E34-S38 PolarHBondContact O-N 3.17Å; V36-S38 VanDerWaalsContact C-N 3.29Å; V36-S38 PolarHBondContact O-N 3Å; S38-G40 VanDerWaalsContact C-N 3.26Å; S38-G40 PolarHBondContact O-N 3.33Å; S38-K41 PolarHBondContact O-N 3.33Å; S38-K41 VanDerWaalsContact O-N 3.17Å; S38-F42 WeakPolarHBondContact O-CB 3.3Å; S38-F42 PolarHBondContact O-N 2.66Å
39L86.2Confident85.6Confident61 Ų6164.9 Ų64.932%0.31937%0.367SS..Hα-helixtrans-53.2-41.4179.4179.467.8000113.2K41 F42 N43 H129L39-K41 PolarHBondContact O-N 3Å; L39-F42 PolarHBondContact O-N 2.93Å; L39-N43 WeakPolarHBondContact O-CB 3.34Å; L39-N43 PolarHBondContact O-N 2.7Å; L39-N43 PolarHBondContact O-ND2 3.11Å; L39-H129 HydrophobicContact CD1-CB 3.79Å
40G86.7Confident86Confident56 Ų5661.2 Ų61.258%0.57735%0.35SS*.Hα-helixtrans-62.9-43.6-178.300000112.5S38S38-G40 VanDerWaalsContact C-N 3.26Å; S38-G40 PolarHBondContact O-N 3.33Å
41K86.1Confident86.5Confident110 Ų11060.5 Ų60.548%0.47834%0.339SS..Hα-helixtrans-74.4-33.7177-64.9-180179.8179.20111.8S35 S38 L39 S44S35-K41 WeakPolarHBondContact O-CB 3.48Å; S38-K41 PolarHBondContact O-N 3.33Å; S38-K41 VanDerWaalsContact O-N 3.17Å; L39-K41 PolarHBondContact O-N 3Å; K41-S44 PolarHBondContact O-N 3.07Å; K41-S44 PolarHBondContact O-OG 3.43Å
42F87.9Confident87Confident2 Ų256.7 Ų56.71%0.00932%0.321CS..Hα-helixtrans-68.4-37.9176.8-167.9-107.1000112.5V36 S38 L39 S44 M45 V46 V126 H129 L133V36-F42 HydrophobicContact CB-CD2 4.37Å; V36-F42 HydrophobicContact CG1-CD2 4.01Å; V36-F42 HydrophobicContact CG1-CE2 4.07Å; V36-F42 HydrophobicContact CG2-CD2 4.39Å; S38-F42 WeakPolarHBondContact O-CB 3.3Å; S38-F42 PolarHBondContact O-N 2.66Å; L39-F42 PolarHBondContact O-N 2.93Å; F42-S44 PolarHBondContact O-N 2.91Å; F42-M45 WeakPolarHBondContact O-CB 3.46Å; F42-M45 PolarHBondContact O-N 3.07Å; F42-V46 HydrophobicContact CE1-CB 4.14Å; F42-V46 HydrophobicContact CE1-CG2 4.11Å; F42-V46 HydrophobicContact CE2-CG2 4.01Å; F42-V46 HydrophobicContact CZ-CB 4.21Å; F42-V46 HydrophobicContact CZ-CG2 3.67Å; F42-V46 PolarHBondContact O-N 3.19Å; F42-V126 HydrophobicContact CE1-CG2 4.01Å; F42-V126 HydrophobicContact CZ-CG2 3.9Å; F42-V126 VanDerWaalsContact CZ-N 3.29Å; F42-H129 AromaticContact CD1-CD2 3.93Å; F42-L133 HydrophobicContact CD1-CD1 4.47Å; F42-L133 HydrophobicContact CE1-CD1 4.04Å
43N87.9Confident87.7Confident70 Ų7058.4 Ų58.437%0.37433%0.333SS..Hα-helixtrans-63.7-23.6175.8-81.3-20.5000113.8L39 V46 L133L39-N43 WeakPolarHBondContact O-CB 3.34Å; L39-N43 PolarHBondContact O-N 2.7Å; L39-N43 PolarHBondContact O-ND2 3.11Å; N43-V46 VanDerWaalsContact O-O 3.14Å; N43-L133 WeakPolarHBondContact OD1-CD2 3.32Å
44S86.1Confident88.3Confident76 Ų7653.7 Ų53.753%0.53131%0.31SS..Hα-helixtrans-74.8-27.317249.10000112.7K41 F42K41-S44 PolarHBondContact O-N 3.07Å; K41-S44 PolarHBondContact O-OG 3.43Å; F42-S44 PolarHBondContact O-N 2.91Å
45M84.9Confident88.6Confident48 Ų4857.3 Ų57.324%0.23632%0.324CS..Hα-helixtrans-82.6-40.6179-59.9180-176.500112.1R20 S35 F42R20-M45 PolarHBondContact N-O 3.37Å; S35-M45 WeakPolarHBondContact OG-CE 3.18Å; F42-M45 WeakPolarHBondContact O-CB 3.46Å; F42-M45 PolarHBondContact O-N 3.07Å
46V88.7Confident89.1Confident1 Ų159.6 Ų59.61%0.00634%0.34CS..EExtended strand (participates in β ladder)trans-127.4133.5-170.4-173.10000110.6F17 F42 N43 I122 V126F17-V46 HydrophobicContact CB-CG1 3.56Å; F17-V46 HydrophobicContact CD1-CG1 3.65Å; F17-V46 HydrophobicContact CG-CG1 3.87Å; F42-V46 HydrophobicContact CE1-CB 4.14Å; F42-V46 HydrophobicContact CE1-CG2 4.11Å; F42-V46 HydrophobicContact CE2-CG2 4.01Å; F42-V46 HydrophobicContact CZ-CB 4.21Å; F42-V46 HydrophobicContact CZ-CG2 3.67Å; F42-V46 PolarHBondContact O-N 3.19Å; N43-V46 VanDerWaalsContact O-O 3.14Å; V46-I122 HydrophobicContact CG2-CG2 3.85Å; V46-V126 HydrophobicContact CG1-CG2 4.29Å
47S89.6Confident89.4Confident32 Ų3262 Ų6222%0.22436%0.362CS..EExtended strand (participates in β ladder)trans-125.9138.3173.853.70000111.2F17 A18 A49F17-S47 CarbonylContact C-O 3.46Å; F17-S47 WeakPolarHBondContact CA-O 3.43Å; A18-S47 PolarHBondContact N-O 2.97Å; A18-S47 PolarHBondContact O-N 3.2Å; A18-S47 PolarHBondContact O-OG 3.11Å; S47-A49 PolarHBondContact O-N 3.31Å
48L91.3Very high89.6Confident61 Ų6163 Ų6332%0.31936%0.364SS..EExtended strand (participates in β ladder)trans-67.1119.3175.9-177.570.5000109.5A15 F17 F51 V134A15-L48 HydrophobicContact CB-CD1 4.16Å; F17-L48 HydrophobicContact CD1-CB 4.17Å; F17-L48 HydrophobicContact CD1-CD1 4.03Å; F17-L48 HydrophobicContact CE1-CB 3.91Å; F17-L48 HydrophobicContact CE1-CD1 3.54Å; F17-L48 HydrophobicContact CE1-CG 4.34Å; F17-L48 HydrophobicContact CE2-CD1 4.32Å; F17-L48 HydrophobicContact CZ-CD1 3.72Å; L48-F51 HydrophobicContact CD1-CB 4.45Å; L48-F51 HydrophobicContact CD2-CB 4.35Å; L48-V134 HydrophobicContact CD2-CG2 4.47Å
49A90.6Very high89.7Confident56 Ų5661.3 Ų61.346%0.46335%0.354SS..EExtended strand (participates in β ladder)trans-89.7-48.417700000110.8L16 A18 S47L16-A49 WeakPolarHBondContact O-CA 3.4Å; L16-A49 WeakPolarHBondContact O-CB 3.49Å; L16-A49 PolarHBondContact O-N 3.11Å; A18-A49 HydrophobicContact CB-CB 4.19Å; S47-A49 PolarHBondContact O-N 3.31Å
50A91.6Very high90.1Very high12 Ų1258.7 Ų58.710%0.09934%0.341CS..EExtended strand (participates in β ladder)trans-150.9151.3-179.600000111.5L16 F79 N83L16-A50 HydrophobicContact CB-CB 4.36Å; L16-A50 PolarHBondContact N-O 2.96Å; L16-A50 PolarHBondContact O-N 3.31Å; L16-A50 VanDerWaalsContact O-N 3.16Å; A50-F79 HydrophobicContact CB-CE2 3.71Å; A50-F79 HydrophobicContact CB-CZ 3.96Å; A50-N83 HydrophobicContact CB-CB 4.07Å; A50-N83 WeakPolarHBondContact CB-OD1 3.47Å
51F93.3Very high90.4Very high62 Ų6257.7 Ų57.727%0.27232%0.322SS..EExtended strand (participates in β ladder)trans-137128.1175.1-179.8-116.4000110Y14 A15 L48 P53 F130 V134Y14-F51 WeakPolarHBondContact O-CA 3.04Å; Y14-F51 VanDerWaalsContact O-CD2 3.26Å; Y14-F51 WeakPolarHBondContact O-CD2 3.42Å; A15-F51 HydrophobicContact CB-CD2 3.92Å; L48-F51 HydrophobicContact CD1-CB 4.45Å; L48-F51 HydrophobicContact CD2-CB 4.35Å; F51-P53 HydrophobicContact CD1-CB 4.43Å; F51-P53 HydrophobicContact CE1-CB 3.76Å; F51-P53 HydrophobicContact CE1-CG 4.31Å; F51-P53 HydrophobicContact CZ-CB 4.26Å; F51-P53 WeakPolarHBondContact O-CD 3.22Å; F51-F130 HydrophobicContact CE2-CZ 4.05Å; F51-V134 HydrophobicContact CD1-CG1 3.68Å; F51-V134 HydrophobicContact CD2-CG1 4.32Å; F51-V134 HydrophobicContact CD2-CG2 4.21Å; F51-V134 HydrophobicContact CE1-CG1 3.74Å; F51-V134 HydrophobicContact CE2-CG1 4.39Å; F51-V134 HydrophobicContact CE2-CG2 4.37Å; F51-V134 HydrophobicContact CG-CG1 3.99Å; F51-V134 HydrophobicContact CZ-CG1 4.11Å
52F93.1Very high90.7Very high50 Ų5056.6 Ų56.622%0.21932%0.319CS..EExtended strand (participates in β ladder)trans-112.999.2176.4-179.6-96.8000109.7G13 Y14 F54 D75 F79G13-F52 CarbonylContact C-O 3.59Å; G13-F52 WeakPolarHBondContact CA-O 3.48Å; Y14-F52 HydrophobicContact CD2-CD1 4.06Å; Y14-F52 PolarHBondContact N-O 3.49Å; Y14-F52 PolarHBondContact O-N 3.14Å; F52-F54 HydrophobicContact CD1-CD1 4.4Å; F52-F54 HydrophobicContact CD1-CE1 4.44Å; F52-F54 HydrophobicContact CE1-CD1 4.21Å; F52-F54 HydrophobicContact CE1-CE1 4.44Å; F52-D75 HydrophobicContact CE1-CB 3.9Å; F52-D75 HydrophobicContact CZ-CB 4.19Å; F52-F79 HydrophobicContact CB-CD2 3.47Å; F52-F79 VanDerWaalsContact CB-CD2 3.47Å; F52-F79 HydrophobicContact CB-CE2 3.75Å; F52-F79 HydrophobicContact CB-CG 4.01Å; F52-F79 HydrophobicContact CB-CZ 4.49Å; F52-F79 HydrophobicContact CG-CD2 4.3Å
53P92.8Very high91Very high71 Ų7156.5 Ų56.546%0.46132%0.318SS..EExtended strand (participates in β ladder)trans-74.1139.1177.428.3-32.3000111.6S12 F51 K55S12-P53 WeakPolarHBondContact O-CA 3.34Å; F51-P53 HydrophobicContact CD1-CB 4.43Å; F51-P53 HydrophobicContact CE1-CB 3.76Å; F51-P53 HydrophobicContact CE1-CG 4.31Å; F51-P53 HydrophobicContact CZ-CB 4.26Å; F51-P53 WeakPolarHBondContact O-CD 3.22Å; P53-K55 PolarHBondContact O-N 3.44Å
54F93.1Very high91.2Very high32 Ų3256 Ų5614%0.1431%0.314CS..  trans-70.6127.9171.7-62.7-43000110.8S12 Y14 F52 A60 N63S12-F54 PolarHBondContact O-N 2.9Å; Y14-F54 HydrophobicContact CD1-CZ 4.49Å; Y14-F54 AromaticContact CD2-CE1 3.8Å; Y14-F54 HydrophobicContact CD2-CE1 3.8Å; Y14-F54 HydrophobicContact CD2-CZ 4.06Å; Y14-F54 HydrophobicContact CE1-CZ 4.2Å; Y14-F54 AromaticContact CE2-CE1 3.52Å; Y14-F54 HydrophobicContact CE2-CE1 3.52Å; Y14-F54 AromaticContact CE2-CZ 3.72Å; Y14-F54 HydrophobicContact CE2-CZ 3.72Å; Y14-F54 HydrophobicContact CG-CZ 4.42Å; Y14-F54 AromaticContact CZ-CZ 3.8Å; F52-F54 HydrophobicContact CD1-CD1 4.4Å; F52-F54 HydrophobicContact CD1-CE1 4.44Å; F52-F54 HydrophobicContact CE1-CD1 4.21Å; F52-F54 HydrophobicContact CE1-CE1 4.44Å; F54-A60 HydrophobicContact CB-CB 4.02Å; F54-A60 HydrophobicContact CD2-CB 3.52Å; F54-A60 HydrophobicContact CE2-CB 4.24Å; F54-A60 HydrophobicContact CG-CB 3.97Å; F54-N63 HydrophobicContact CE1-CB 3.9Å; F54-N63 HydrophobicContact CE2-CB 4.48Å; F54-N63 HydrophobicContact CZ-CB 3.74Å
55K88.9Confident91.5Very high201 Ų20154.8 Ų54.887%0.87430%0.302SS*.SBendtrans-73-30.5-177.3-63179.8-178.1174.70113.1P53P53-K55 PolarHBondContact O-N 3.44Å
56S92.7Very high91.9Very high60 Ų6053.1 Ų53.142%0.4230%0.296SS..SBendtrans-140.9155.7-176.874.40000111.6Q58 A59 A60S56-Q58 PolarHBondContact O-N 3.04Å; S56-A59 PolarHBondContact O-N 3.46Å; S56-A59 WeakPolarHBondContact OG-CB 3.5Å; S56-A59 PolarHBondContact OG-N 2.69Å; S56-A60 PolarHBondContact O-N 2.93Å
57A90Very high92Very high77 Ų7754.7 Ų54.764%0.63630%0.304SS*.Hα-helixtrans-63.3-28.8174.700000112.4L61A57-L61 WeakPolarHBondContact O-CB 3.37Å; A57-L61 PolarHBondContact O-N 3.48Å
58Q90.9Very high92.1Very high131 Ų13156.1 Ų56.161%0.61231%0.314SS*.Hα-helixtrans-69-47.1175.5-178173.5-9.400111.2S56 A60 L61 E62S56-Q58 PolarHBondContact O-N 3.04Å; Q58-A60 VanDerWaalsContact C-N 3.28Å; Q58-A60 PolarHBondContact O-N 3.16Å; Q58-L61 WeakPolarHBondContact O-CB 3.21Å; Q58-L61 PolarHBondContact O-N 3.04Å; Q58-L61 VanDerWaalsContact O-N 3.11Å; Q58-E62 WeakPolarHBondContact CG-OE1 3.38Å; Q58-E62 PolarHBondContact NE2-OE1 2.94Å; Q58-E62 WeakPolarHBondContact O-CG 3.28Å; Q58-E62 PolarHBondContact O-N 3.48Å
59A92.3Very high92Very high19 Ų1960.3 Ų60.316%0.15733%0.332CS..Hα-helixtrans-60.3-41.2175.100000111S56 L61 E62 N63S56-A59 PolarHBondContact O-N 3.46Å; S56-A59 WeakPolarHBondContact OG-CB 3.5Å; S56-A59 PolarHBondContact OG-N 2.69Å; A59-L61 VanDerWaalsContact C-N 3.32Å; A59-L61 PolarHBondContact O-N 2.97Å; A59-E62 PolarHBondContact O-N 3.14Å; A59-N63 WeakPolarHBondContact O-CB 3.18Å; A59-N63 PolarHBondContact O-N 3.21Å; A59-N63 PolarHBondContact O-ND2 2.75Å
60A93.7Very high92Very high6 Ų658.2 Ų58.25%0.0532%0.316CS..Hα-helixtrans-61.1-39.6175.100000112.5F54 S56 Q58 M64 L149F54-A60 HydrophobicContact CB-CB 4.02Å; F54-A60 HydrophobicContact CD2-CB 3.52Å; F54-A60 HydrophobicContact CE2-CB 4.24Å; F54-A60 HydrophobicContact CG-CB 3.97Å; S56-A60 PolarHBondContact O-N 2.93Å; Q58-A60 VanDerWaalsContact C-N 3.28Å; Q58-A60 PolarHBondContact O-N 3.16Å; A60-M64 VanDerWaalsContact O-CB 3.29Å; A60-M64 WeakPolarHBondContact O-CB 3.39Å; A60-M64 PolarHBondContact O-N 2.97Å; A60-L149 HydrophobicContact CB-CD1 3.97Å
61L93Very high92Very high34 Ų3461.5 Ų61.518%0.17833%0.334CS..Hα-helixtrans-68.2-44.3177.2178.263.1000112.2A57 Q58 A59 M64 N65 L149 Y153 A156A57-L61 WeakPolarHBondContact O-CB 3.37Å; A57-L61 PolarHBondContact O-N 3.48Å; Q58-L61 WeakPolarHBondContact O-CB 3.21Å; Q58-L61 PolarHBondContact O-N 3.04Å; Q58-L61 VanDerWaalsContact O-N 3.11Å; A59-L61 VanDerWaalsContact C-N 3.32Å; A59-L61 PolarHBondContact O-N 2.97Å; L61-M64 PolarHBondContact O-N 3.01Å; L61-N65 WeakPolarHBondContact O-CB 3.16Å; L61-N65 VanDerWaalsContact O-CG 3.25Å; L61-N65 PolarHBondContact O-N 3.15Å; L61-N65 PolarHBondContact O-ND2 3.49Å; L61-L149 HydrophobicContact CB-CD1 4.28Å; L61-Y153 HydrophobicContact CD1-CD2 4.38Å; L61-A156 HydrophobicContact CD1-CB 4.41Å; L61-A156 HydrophobicContact CD2-CB 4.34Å
62E92.9Very high91.9Very high88 Ų8859.6 Ų59.641%0.41133%0.328SS..Hα-helixtrans-61.4-47176.9-72.7168.2-171.800110.9Q58 A59 N65 A66Q58-E62 WeakPolarHBondContact CG-OE1 3.38Å; Q58-E62 PolarHBondContact NE2-OE1 2.94Å; Q58-E62 WeakPolarHBondContact O-CG 3.28Å; Q58-E62 PolarHBondContact O-N 3.48Å; A59-E62 PolarHBondContact O-N 3.14Å; E62-N65 PolarHBondContact O-N 3.05Å; E62-A66 PolarHBondContact O-N 2.9Å
63N93.5Very high91.9Very high0 Ų059.3 Ų59.30%033%0.327CS..Hα-helixtrans-60.9-46174.6-82.7-84.3000111.8Y14 F54 A59 N65 A66 I67 H73 D75Y14-N63 VanDerWaalsContact CE2-OD1 3.28Å; Y14-N63 WeakPolarHBondContact CE2-OD1 3.32Å; Y14-N63 WeakPolarHBondContact OH-CB 3.36Å; Y14-N63 PolarHBondContact OH-OD1 2.87Å; F54-N63 HydrophobicContact CE1-CB 3.9Å; F54-N63 HydrophobicContact CE2-CB 4.48Å; F54-N63 HydrophobicContact CZ-CB 3.74Å; A59-N63 WeakPolarHBondContact O-CB 3.18Å; A59-N63 PolarHBondContact O-N 3.21Å; A59-N63 PolarHBondContact O-ND2 2.75Å; N63-N65 VanDerWaalsContact C-N 3.32Å; N63-N65 PolarHBondContact O-N 3.23Å; N63-A66 PolarHBondContact O-N 2.86Å; N63-I67 WeakPolarHBondContact O-CD1 3.27Å; N63-I67 WeakPolarHBondContact O-CG1 3.35Å; N63-I67 PolarHBondContact O-N 2.91Å; N63-H73 PolarHBondContact ND2-ND1 3.42Å; N63-H73 WeakPolarHBondContact OD1-CB 3.38Å; N63-H73 VanDerWaalsContact OD1-CG 3.3Å; N63-H73 PolarHBondContact OD1-ND1 2.97Å; N63-D75 PolarHBondContact ND2-OD2 3.21Å
64M92.9Very high91.9Very high59 Ų5959.2 Ų59.229%0.29133%0.333SS..Hα-helixtrans-62.1-37.3177.3-176.3179.9176.800112.8A60 L61 S68 L149 Y153A60-M64 VanDerWaalsContact O-CB 3.29Å; A60-M64 WeakPolarHBondContact O-CB 3.39Å; A60-M64 PolarHBondContact O-N 2.97Å; L61-M64 PolarHBondContact O-N 3.01Å; M64-S68 VanDerWaalsContact O-CB 3.24Å; M64-S68 WeakPolarHBondContact O-CB 3.25Å; M64-S68 PolarHBondContact O-N 2.7Å; M64-L149 HydrophobicContact CB-CD1 4.4Å; M64-L149 HydrophobicContact CB-CD2 4.33Å; M64-L149 HydrophobicContact SD-CD1 4.06Å; M64-L149 HydrophobicContact SD-CD2 3.74Å; M64-L149 HydrophobicContact SD-CG 3.59Å; M64-L149 VanDerWaalsContact SD-CG 3.59Å; M64-Y153 HydrophobicContact CE-CD1 3.6Å; M64-Y153 HydrophobicContact CE-CD2 3.69Å; M64-Y153 HydrophobicContact CE-CE1 4.01Å; M64-Y153 HydrophobicContact CE-CE2 4.08Å; M64-Y153 HydrophobicContact CE-CG 3.42Å; M64-Y153 VanDerWaalsContact CE-CG 3.42Å; M64-Y153 HydrophobicContact CG-CD2 3.86Å; M64-Y153 HydrophobicContact CG-CE2 4.2Å; M64-Y153 HydrophobicContact CG-CG 4.45Å; M64-Y153 HydrophobicContact SD-CD1 4.44Å; M64-Y153 HydrophobicContact SD-CD2 3.67Å; M64-Y153 HydrophobicContact SD-CE2 4.43Å; M64-Y153 HydrophobicContact SD-CG 3.67Å
65N92.4Very high91.8Very high50 Ų5059.9 Ų59.927%0.26734%0.337SS..Hα-helixtrans-65.5-45.6175.2-72.4-29.1000111.2L61 E62 N63 S68 E69 Y153L61-N65 WeakPolarHBondContact O-CB 3.16Å; L61-N65 VanDerWaalsContact O-CG 3.25Å; L61-N65 PolarHBondContact O-N 3.15Å; L61-N65 PolarHBondContact O-ND2 3.49Å; E62-N65 PolarHBondContact O-N 3.05Å; N63-N65 VanDerWaalsContact C-N 3.32Å; N63-N65 PolarHBondContact O-N 3.23Å; N65-S68 PolarHBondContact O-N 3.41Å; N65-E69 WeakPolarHBondContact O-CG 3.36Å; N65-E69 PolarHBondContact O-N 2.83Å; N65-Y153 VanDerWaalsContact OD1-CD2 3.24Å; N65-Y153 WeakPolarHBondContact OD1-CD2 3.44Å; N65-Y153 VanDerWaalsContact OD1-CE2 3.22Å; N65-Y153 WeakPolarHBondContact OD1-CE2 3.47Å
66A92.1Very high91.9Very high14 Ų1450.3 Ų50.312%0.11630%0.296CS..Hα-helixtrans-60.4-48.1177.700000111.7E62 N63 S68 E69 G70 V71 H73E62-A66 PolarHBondContact O-N 2.9Å; N63-A66 PolarHBondContact O-N 2.86Å; A66-S68 VanDerWaalsContact C-N 3.34Å; A66-S68 PolarHBondContact O-N 3.08Å; A66-E69 CarbonylContact O-C 3.56Å; A66-E69 PolarHBondContact O-N 3.04Å; A66-E69 VanDerWaalsContact O-N 3.15Å; A66-G70 PolarHBondContact O-N 3Å; A66-V71 CarbonylContact C-O 3.6Å; A66-V71 PolarHBondContact O-N 3.17Å; A66-H73 HydrophobicContact CB-CB 4.01Å
67I92.3Very high91.8Very high33 Ų3350.9 Ų50.917%0.16929%0.291CS..Hα-helixtrans-57.1-47.2174.5-66.1163.4000110.8E9 Y14 N63 E69 G70 I101E9-I67 HydrophobicContact CB-CD1 4.27Å; E9-I67 HydrophobicContact CG-CD1 4.24Å; E9-I67 WeakPolarHBondContact OE2-CG2 3.43Å; Y14-I67 HydrophobicContact CE1-CD1 3.63Å; Y14-I67 HydrophobicContact CE1-CG1 4.38Å; Y14-I67 WeakPolarHBondContact OH-CD1 3.3Å; N63-I67 WeakPolarHBondContact O-CD1 3.27Å; N63-I67 WeakPolarHBondContact O-CG1 3.35Å; N63-I67 PolarHBondContact O-N 2.91Å; I67-E69 PolarHBondContact O-N 3.35Å; I67-G70 PolarHBondContact O-N 3.39Å; I67-I101 HydrophobicContact CB-CD1 4.46Å; I67-I101 HydrophobicContact CG1-CD1 4.12Å; I67-I101 HydrophobicContact CG2-CD1 4.43Å
68S91.1Very high91.9Very high62 Ų6251.9 Ų51.943%0.43429%0.285SS..Hα-helixtrans-62.5-27.2-179.3178.70000113.2M64 N65 A66 Y153M64-S68 VanDerWaalsContact O-CB 3.24Å; M64-S68 WeakPolarHBondContact O-CB 3.25Å; M64-S68 PolarHBondContact O-N 2.7Å; N65-S68 PolarHBondContact O-N 3.41Å; A66-S68 VanDerWaalsContact C-N 3.34Å; A66-S68 PolarHBondContact O-N 3.08Å; S68-Y153 PolarHBondContact OG-OH 2.88Å
69E89.6Confident91.9Very high149 Ų14946 Ų4670%0.69626%0.257SS*.Hα-helixtrans-92.2-9.6176.8-68.5178.3-178.200112.3N65 A66 I67 V71N65-E69 WeakPolarHBondContact O-CG 3.36Å; N65-E69 PolarHBondContact O-N 2.83Å; A66-E69 CarbonylContact O-C 3.56Å; A66-E69 PolarHBondContact O-N 3.04Å; A66-E69 VanDerWaalsContact O-N 3.15Å; I67-E69 PolarHBondContact O-N 3.35Å; E69-V71 HydrophobicContact CB-CG2 4.3Å
70G89.8Confident91.8Very high12 Ų1245.1 Ų45.112%0.12425%0.25CC..THydrogen-bonded Turntrans80.221.3-177.800000113.8A66 I67 A104A66-G70 PolarHBondContact O-N 3Å; I67-G70 PolarHBondContact O-N 3.39Å; G70-A104 WeakPolarHBondContact O-CB 3.47Å
71V91.4Very high91.5Very high81 Ų8149 Ų4949%0.49127%0.267SS..PPolyproline II helixtrans-99136.4179.4-178.10000109.8A66 E69 H73A66-V71 CarbonylContact C-O 3.6Å; A66-V71 PolarHBondContact O-N 3.17Å; E69-V71 HydrophobicContact CB-CG2 4.3Å; V71-H73 PolarHBondContact O-N 2.66Å
72V91.1Very high91.3Very high23 Ų2352.1 Ų52.114%0.13929%0.288CS..PPolyproline II helixtrans-76.8116.6176.8-175.30000109.4L76 K77 A104 L105 E108V72-L76 HydrophobicContact CG1-CB 4.43Å; V72-L76 HydrophobicContact CG1-CD2 4.3Å; V72-L76 HydrophobicContact CG1-CG 4.39Å; V72-K77 HydrophobicContact CG1-CB 4.26Å; V72-A104 HydrophobicContact CG2-CB 3.82Å; V72-L105 HydrophobicContact CB-CD2 4.43Å; V72-L105 HydrophobicContact CG1-CD2 3.83Å; V72-L105 HydrophobicContact CG2-CD2 3.65Å; V72-L105 HydrophobicContact CG2-CG 3.9Å; V72-E108 VanDerWaalsContact CB-OE2 3.32Å; V72-E108 WeakPolarHBondContact CB-OE2 3.45Å; V72-E108 WeakPolarHBondContact CG1-OE2 3.44Å
73H93.6Very high91Very high43 Ų4351 Ų5120%0.19929%0.285CS..PPolyproline II helixtrans-76.2151175.5-170.3-103.2000111.4N63 A66 V71 D75 L76 K77N63-H73 PolarHBondContact ND2-ND1 3.42Å; N63-H73 WeakPolarHBondContact OD1-CB 3.38Å; N63-H73 VanDerWaalsContact OD1-CG 3.3Å; N63-H73 PolarHBondContact OD1-ND1 2.97Å; A66-H73 HydrophobicContact CB-CB 4.01Å; V71-H73 PolarHBondContact O-N 2.66Å; H73-D75 VanDerWaalsContact C-N 3.25Å; H73-D75 IonicContact CE1-OD2 2.7Å; H73-D75 PolarHBondContact CE1-OD2 3.19Å; H73-D75 WeakPolarHBondContact ND1-CB 3.2Å; H73-D75 PolarHBondContact ND1-N 3.37Å; H73-D75 IonicContact ND1-OD2 3.35Å; H73-D75 PolarHBondContact ND1-OD2 3.07Å; H73-D75 PolarHBondContact O-N 3.4Å; H73-L76 WeakPolarHBondContact O-CB 3.44Å; H73-L76 PolarHBondContact O-N 2.94Å; H73-K77 PolarHBondContact O-N 3.18Å
74A92Very high90.4Very high70 Ų7051.6 Ų51.658%0.57929%0.288SS*.Hα-helixtrans-57.4-36.6-179.300000113.1K77 L78A74-K77 WeakPolarHBondContact O-CB 3.36Å; A74-K77 PolarHBondContact O-N 2.57Å; A74-L78 WeakPolarHBondContact O-CB 3.14Å; A74-L78 PolarHBondContact O-N 3.41Å
75D91.7Very high89.4Confident45 Ų4552.2 Ų52.224%0.24130%0.297CS..Hα-helixtrans-64.7-40.9175.6-65.2-28.9000112.2F52 N63 H73 K77 F79F52-D75 HydrophobicContact CE1-CB 3.9Å; F52-D75 HydrophobicContact CZ-CB 4.19Å; N63-D75 PolarHBondContact ND2-OD2 3.21Å; H73-D75 VanDerWaalsContact C-N 3.25Å; H73-D75 IonicContact CE1-OD2 2.7Å; H73-D75 PolarHBondContact CE1-OD2 3.19Å; H73-D75 WeakPolarHBondContact ND1-CB 3.2Å; H73-D75 PolarHBondContact ND1-N 3.37Å; H73-D75 IonicContact ND1-OD2 3.35Å; H73-D75 PolarHBondContact ND1-OD2 3.07Å; H73-D75 PolarHBondContact O-N 3.4Å; D75-K77 VanDerWaalsContact C-N 3.35Å; D75-F79 VanDerWaalsContact O-CB 3.27Å; D75-F79 WeakPolarHBondContact O-CB 3.47Å; D75-F79 PolarHBondContact O-N 3.3Å
76L91.5Very high88.1Confident0 Ų053.6 Ų53.60%031%0.305CS..Hα-helixtrans-66.9-41.4177.7179.158.9000110.3L7 Y14 V72 H73 F79 L80 I101L7-L76 HydrophobicContact CD1-CD1 4.06Å; L7-L76 HydrophobicContact CD2-CD1 3.94Å; L7-L76 HydrophobicContact CD2-CD2 4.49Å; Y14-L76 HydrophobicContact CD1-CD1 3.97Å; Y14-L76 HydrophobicContact CD2-CB 4.42Å; Y14-L76 HydrophobicContact CD2-CD1 4.12Å; Y14-L76 HydrophobicContact CE1-CD1 4.05Å; Y14-L76 HydrophobicContact CE1-CD2 4.5Å; Y14-L76 HydrophobicContact CE2-CB 3.82Å; Y14-L76 HydrophobicContact CE2-CD1 4.2Å; Y14-L76 HydrophobicContact CG-CD1 4.01Å; V72-L76 HydrophobicContact CG1-CB 4.43Å; V72-L76 HydrophobicContact CG1-CD2 4.3Å; V72-L76 HydrophobicContact CG1-CG 4.39Å; H73-L76 WeakPolarHBondContact O-CB 3.44Å; H73-L76 PolarHBondContact O-N 2.94Å; L76-F79 HydrophobicContact CD1-CD1 4.41Å; L76-F79 PolarHBondContact O-N 2.98Å; L76-L80 HydrophobicContact CD1-CD1 4.11Å; L76-L80 HydrophobicContact CD1-CG 4.15Å; L76-L80 HydrophobicContact CG-CD1 4.16Å; L76-L80 WeakPolarHBondContact O-CG 3.37Å; L76-L80 PolarHBondContact O-N 3.37Å; L76-I101 HydrophobicContact CD2-CD1 3.92Å
77K90.6Very high86.3Confident73 Ų7358.8 Ų58.832%0.31734%0.34SS..Hα-helixtrans-57.4-54.4175.4-168.9-173.1-178.3150.60111.3V72 H73 A74 D75 F79 L80 E81 E108 F109V72-K77 HydrophobicContact CG1-CB 4.26Å; H73-K77 PolarHBondContact O-N 3.18Å; A74-K77 WeakPolarHBondContact O-CB 3.36Å; A74-K77 PolarHBondContact O-N 2.57Å; D75-K77 VanDerWaalsContact C-N 3.35Å; K77-F79 VanDerWaalsContact C-N 3.29Å; K77-F79 PolarHBondContact O-N 3.28Å; K77-L80 PolarHBondContact O-N 2.96Å; K77-E81 WeakPolarHBondContact CE-OE1 3.27Å; K77-E81 WeakPolarHBondContact O-CG 3.01Å; K77-E81 PolarHBondContact O-N 3.12Å; K77-E108 VanDerWaalsContact CD-OE1 3.28Å; K77-E108 WeakPolarHBondContact CD-OE1 3.32Å; K77-E108 WeakPolarHBondContact CE-OE1 3.38Å; K77-E108 IonicContact NZ-OE1 3.57Å; K77-E108 PolarHBondContact NZ-OE1 2.92Å; K77-F109 HydrophobicContact CB-CZ 4.25Å; K77-F109 HydrophobicContact CG-CE1 4.21Å; K77-F109 HydrophobicContact CG-CE2 4.22Å; K77-F109 HydrophobicContact CG-CZ 3.46Å; K77-F109 VanDerWaalsContact CG-CZ 3.46Å
78L91Very high84.6Confident98 Ų9859.6 Ų59.651%0.51336%0.357SS..Hα-helixtrans-59.4-40.2178.7-179.964.3000112A74 T82A74-L78 WeakPolarHBondContact O-CB 3.14Å; A74-L78 PolarHBondContact O-N 3.41Å; L78-T82 WeakPolarHBondContact O-CB 3.42Å; L78-T82 PolarHBondContact O-N 2.9Å; L78-T82 VanDerWaalsContact O-N 3.08Å; L78-T82 PolarHBondContact O-OG1 2.99Å
79F91.9Very high82.9Confident8 Ų867.4 Ų67.44%0.03538%0.383CS..Hα-helixtrans-62.4-44.6177.7175.2-115.8000112.2L7 L16 A50 F52 D75 L76 K77 N83L7-F79 HydrophobicContact CD1-CE1 4.14Å; L16-F79 HydrophobicContact CB-CE1 3.93Å; L16-F79 HydrophobicContact CB-CZ 3.71Å; A50-F79 HydrophobicContact CB-CE2 3.71Å; A50-F79 HydrophobicContact CB-CZ 3.96Å; F52-F79 HydrophobicContact CB-CD2 3.47Å; F52-F79 VanDerWaalsContact CB-CD2 3.47Å; F52-F79 HydrophobicContact CB-CE2 3.75Å; F52-F79 HydrophobicContact CB-CG 4.01Å; F52-F79 HydrophobicContact CB-CZ 4.49Å; F52-F79 HydrophobicContact CG-CD2 4.3Å; D75-F79 VanDerWaalsContact O-CB 3.27Å; D75-F79 WeakPolarHBondContact O-CB 3.47Å; D75-F79 PolarHBondContact O-N 3.3Å; L76-F79 HydrophobicContact CD1-CD1 4.41Å; L76-F79 PolarHBondContact O-N 2.98Å; K77-F79 VanDerWaalsContact C-N 3.29Å; K77-F79 PolarHBondContact O-N 3.28Å; F79-N83 VanDerWaalsContact CD2-ND2 3.31Å; F79-N83 WeakPolarHBondContact CD2-ND2 3.45Å; F79-N83 WeakPolarHBondContact CE2-ND2 3.42Å; F79-N83 PolarHBondContact O-N 3.26Å; F79-N83 PolarHBondContact O-ND2 3.48Å
80L89.4Confident81.6Confident0 Ų066.5 Ų66.50%038%0.376CS..Hα-helixtrans-71-40.9179-67.5176.6000111.9L7 L16 L76 K77 T82 N83 L84 L94 L105 F109L7-L80 HydrophobicContact CD1-CD2 4.37Å; L16-L80 HydrophobicContact CD1-CD2 4.44Å; L76-L80 HydrophobicContact CD1-CD1 4.11Å; L76-L80 HydrophobicContact CD1-CG 4.15Å; L76-L80 HydrophobicContact CG-CD1 4.16Å; L76-L80 WeakPolarHBondContact O-CG 3.37Å; L76-L80 PolarHBondContact O-N 3.37Å; K77-L80 PolarHBondContact O-N 2.96Å; L80-T82 VanDerWaalsContact C-N 3.27Å; L80-T82 PolarHBondContact O-N 3.45Å; L80-N83 PolarHBondContact O-N 3.29Å; L80-L84 HydrophobicContact CB-CD1 4.14Å; L80-L84 HydrophobicContact CD2-CD1 3.83Å; L80-L84 HydrophobicContact CG-CD1 4.49Å; L80-L84 VanDerWaalsContact O-CB 3.31Å; L80-L84 WeakPolarHBondContact O-CB 3.42Å; L80-L84 PolarHBondContact O-N 3.18Å; L80-L94 HydrophobicContact CD1-CD2 4.35Å; L80-L94 HydrophobicContact CD2-CD2 4.35Å; L80-L105 HydrophobicContact CD1-CD1 4.14Å; L80-L105 HydrophobicContact CD1-CD2 3.46Å; L80-L105 VanDerWaalsContact CD1-CD2 3.46Å; L80-L105 HydrophobicContact CD1-CG 4.44Å; L80-F109 HydrophobicContact CB-CE2 4.27Å; L80-F109 HydrophobicContact CB-CZ 4.23Å; L80-F109 HydrophobicContact CD1-CE2 4.1Å
81E87.6Confident80.6Confident88 Ų8872.4 Ų72.441%0.41140%0.399SS..Hα-helixtrans-58.7-38.8175.4-74.5176.6175.900112.7K77 L86 F109K77-E81 WeakPolarHBondContact CE-OE1 3.27Å; K77-E81 WeakPolarHBondContact O-CG 3.01Å; K77-E81 PolarHBondContact O-N 3.12Å; E81-L86 HydrophobicContact CG-CD1 4.19Å; E81-F109 HydrophobicContact CG-CE1 3.42Å; E81-F109 VanDerWaalsContact CG-CE1 3.42Å; E81-F109 HydrophobicContact CG-CZ 3.92Å
82T88.9Confident79.9Confident99 Ų9969 Ų6961%0.60738%0.38SS*.Hα-helixtrans-73.9-33.2-177.6-550000112.1L78 L80L78-T82 WeakPolarHBondContact O-CB 3.42Å; L78-T82 PolarHBondContact O-N 2.9Å; L78-T82 VanDerWaalsContact O-N 3.08Å; L78-T82 PolarHBondContact O-OG1 2.99Å; L80-T82 VanDerWaalsContact C-N 3.27Å; L80-T82 PolarHBondContact O-N 3.45Å
83N85.8Confident79.7Confident65 Ų6569.2 Ų69.235%0.34838%0.38SS..Hα-helixtrans-109.8-15.3-167.5-64.9-73.4000114.8L16 A50 F79 L80L16-N83 HydrophobicContact CD2-CB 3.86Å; A50-N83 HydrophobicContact CB-CB 4.07Å; A50-N83 WeakPolarHBondContact CB-OD1 3.47Å; F79-N83 VanDerWaalsContact CD2-ND2 3.31Å; F79-N83 WeakPolarHBondContact CD2-ND2 3.45Å; F79-N83 WeakPolarHBondContact CE2-ND2 3.42Å; F79-N83 PolarHBondContact O-N 3.26Å; F79-N83 PolarHBondContact O-ND2 3.48Å; L80-N83 PolarHBondContact O-N 3.29Å
84L82.1Confident79.5Confident12 Ų1267.2 Ų67.26%0.06337%0.371CS..SBendtrans-101136.5176.6-68.3173.5000111.4H5 L16 L80 L86 A92 L94 I111H5-L84 HydrophobicContact CB-CD2 4.13Å; L16-L84 HydrophobicContact CD2-CD2 3.99Å; L16-L84 HydrophobicContact CD2-CG 4.28Å; L80-L84 HydrophobicContact CB-CD1 4.14Å; L80-L84 HydrophobicContact CD2-CD1 3.83Å; L80-L84 HydrophobicContact CG-CD1 4.49Å; L80-L84 VanDerWaalsContact O-CB 3.31Å; L80-L84 WeakPolarHBondContact O-CB 3.42Å; L80-L84 PolarHBondContact O-N 3.18Å; L84-L86 PolarHBondContact O-N 3.39Å; L84-A92 HydrophobicContact CD2-CB 4.4Å; L84-L94 HydrophobicContact CD1-CD1 4.22Å; L84-L94 HydrophobicContact CD1-CD2 4.29Å; L84-I111 HydrophobicContact CD1-CD1 3.91Å
85S71.8Confident79.4Confident71 Ų7163.9 Ų63.950%0.49734%0.344SS..  trans-76.18917260.80000110S87S85-S87 VanDerWaalsContact C-N 3.32Å
86L65.4Low79.4Confident80 Ų8061.8 Ų61.842%0.41933%0.333SS..  trans-74.2-18.5180-66.3169.9000113.6E81 L84 F109 I111E81-L86 HydrophobicContact CG-CD1 4.19Å; L84-L86 PolarHBondContact O-N 3.39Å; L86-F109 HydrophobicContact CD1-CD1 4.08Å; L86-F109 HydrophobicContact CD1-CE1 4.33Å; L86-F109 HydrophobicContact CD2-CB 4.25Å; L86-F109 HydrophobicContact CD2-CD1 4.05Å; L86-F109 HydrophobicContact CD2-CG 4.49Å; L86-I111 HydrophobicContact CD2-CD1 3.57Å; L86-I111 HydrophobicContact CD2-CG1 3.89Å
87S54.5Low79.3Confident122 Ų12265.1 Ų65.185%0.85336%0.356SS*.SBendtrans-127.5108.7-175.3-162.60000111.5S85S85-S87 VanDerWaalsContact C-N 3.32Å
88G56.7Low79.3Confident51 Ų5165.3 Ų65.353%0.52636%0.361SS..SBendtrans168.3164.2178.400000114.2K90G88-K90 PolarHBondContact O-N 2.91Å
89K54.9Low79.2Confident225 Ų22563.6 Ų63.698%0.97836%0.361SS*.SBendtrans-66.1-12.8180-74.8-176.4178.9178.70114.5
90K61.8Low79.2Confident130 Ų13070.2 Ų70.257%0.56539%0.389SS*.SBendtrans-123.797.6174.1-75.4178.9175.1-177.60108.5M1 G88M1-K90 HydrophobicContact CE-CB 4.34Å; M1-K90 HydrophobicContact CE-CD 4.35Å; M1-K90 HydrophobicContact SD-CB 4.36Å; M1-K90 HydrophobicContact SD-CD 3.42Å; M1-K90 WeakPolarHBondContact SD-CD 3.32Å; G88-K90 PolarHBondContact O-N 2.91Å
91K68.1Low79.2Confident136 Ų13670.2 Ų70.259%0.59139%0.389SS*.PPolyproline II helixtrans-69.2132.2176.2-65.9-174.2175.9-171.10109.3
92A76.9Confident79.3Confident11 Ų1166.1 Ų66.19%0.09137%0.37CS..PPolyproline II helixtrans-67.2142.7171.600000109.8L84 I111L84-A92 HydrophobicContact CD2-CB 4.4Å; A92-I111 VanDerWaalsContact O-CG2 3.3Å; A92-I111 WeakPolarHBondContact O-CG2 3.3Å
93V86.4Confident79.3Confident26 Ų2663.6 Ų63.616%0.15836%0.359CS..EExtended strand (participates in β ladder)trans-94.6133171.8-1780000108L3 L4 H5 S112 Q114L3-V93 WeakPolarHBondContact O-CB 3.35Å; L3-V93 PolarHBondContact O-N 3.47Å; L4-V93 WeakPolarHBondContact CA-O 2.91Å; L4-V93 HydrophobicContact CD1-CB 4.1Å; L4-V93 HydrophobicContact CD1-CG1 3.76Å; H5-V93 PolarHBondContact N-O 3.46Å; V93-S112 WeakPolarHBondContact CA-O 3.19Å; V93-S112 WeakPolarHBondContact CG1-O 3.39Å; V93-Q114 HydrophobicContact CG1-CB 4.21Å; V93-Q114 HydrophobicContact CG1-CG 3.57Å
94L89.6Confident79.5Confident1 Ų161.5 Ų61.51%0.00535%0.351CS..EExtended strand (participates in β ladder)trans-107.6120.2178.7-17568.4000110.3H5 L7 L16 L80 L84 V96 L105 I111 S112 I113 Q114H5-L94 HydrophobicContact CB-CD1 4.29Å; H5-L94 CarbonylContact O-C 3.47Å; H5-L94 WeakPolarHBondContact O-CA 3.45Å; L7-L94 HydrophobicContact CB-CD1 4.21Å; L16-L94 HydrophobicContact CD1-CD1 3.81Å; L80-L94 HydrophobicContact CD1-CD2 4.35Å; L80-L94 HydrophobicContact CD2-CD2 4.35Å; L84-L94 HydrophobicContact CD1-CD1 4.22Å; L84-L94 HydrophobicContact CD1-CD2 4.29Å; L94-V96 HydrophobicContact CD2-CG2 3.94Å; L94-V96 HydrophobicContact CG-CG2 3.9Å; L94-L105 HydrophobicContact CD2-CD1 4.25Å; L94-I111 HydrophobicContact CB-CG2 4.16Å; L94-S112 PolarHBondContact N-O 2.75Å; L94-I113 HydrophobicContact CB-CG1 4.31Å; L94-I113 CarbonylContact O-C 3.37Å; L94-I113 VanDerWaalsContact O-CA 3.27Å; L94-I113 WeakPolarHBondContact O-CA 3.08Å; L94-Q114 PolarHBondContact O-N 3.32Å
95G90.5Very high79.9Confident0 Ų061 Ų610%035%0.348CS..EExtended strand (participates in β ladder)trans-84.8122.7170.400000110.5H5 V6 L7 Q114H5-G95 PolarHBondContact O-N 2.84Å; V6-G95 WeakPolarHBondContact CA-O 3.08Å; L7-G95 PolarHBondContact N-O 2.93Å; G95-Q114 WeakPolarHBondContact CA-O 3.22Å
96V92.1Very high80.7Confident2 Ų262.5 Ų62.51%0.01235%0.348CS..  trans-125.3143.4179.2-176.30000109.5L94 D98 I101 L105 I113 Q114L94-V96 HydrophobicContact CD2-CG2 3.94Å; L94-V96 HydrophobicContact CG-CG2 3.9Å; V96-D98 WeakPolarHBondContact CG1-O 3.13Å; V96-I101 HydrophobicContact CG1-CG2 3.35Å; V96-L105 HydrophobicContact CG2-CD1 4.18Å; V96-I113 HydrophobicContact CB-CG2 4.27Å; V96-I113 HydrophobicContact CG2-CG2 4Å; V96-Q114 PolarHBondContact N-O 2.68Å; V96-Q114 VanDerWaalsContact N-O 3.08Å
97S89.4Confident81.7Confident70 Ų7066.7 Ų66.749%0.4937%0.365SS..SBendtrans-74.6-43.9-178.1-60.30000113.2T123S97-T123 WeakPolarHBondContact OG-CG2 3.11Å
98D89.6Confident83.2Confident77 Ų7764.6 Ų64.641%0.41234%0.342SS..  trans-99.2132.3-179.4-165.4-38.4000110.5V96 K100 I101 G102V96-D98 WeakPolarHBondContact CG1-O 3.13Å; D98-K100 VanDerWaalsContact C-N 3.33Å; D98-K100 PolarHBondContact O-N 2.7Å; D98-K100 WeakPolarHBondContact OD1-CB 3.42Å; D98-K100 PolarHBondContact OD1-N 3.35Å; D98-I101 HydrophobicContact CB-CG2 4.04Å; D98-G102 PolarHBondContact O-N 3.34Å; D98-G102 VanDerWaalsContact O-N 3.07Å
99A89.7Confident84.3Confident62 Ų6263.3 Ų63.351%0.51232%0.322SS..Hα-helixtrans-67.7-30.4178.400000113.1G102 A103A99-G102 PolarHBondContact O-N 2.89Å; A99-A103 PolarHBondContact O-N 3.16Å
100K91.2Very high85.5Confident146 Ų14656.8 Ų56.864%0.63531%0.305SS*.Hα-helixtrans-67.5-50.3-179.3-68.5-178.1179.6179.30111.8D98 G102 A103 A104D98-K100 VanDerWaalsContact C-N 3.33Å; D98-K100 PolarHBondContact O-N 2.7Å; D98-K100 WeakPolarHBondContact OD1-CB 3.42Å; D98-K100 PolarHBondContact OD1-N 3.35Å; K100-G102 VanDerWaalsContact C-N 3.26Å; K100-G102 PolarHBondContact O-N 2.84Å; K100-A103 PolarHBondContact O-N 2.72Å; K100-A104 PolarHBondContact O-N 3.42Å; K100-A104 VanDerWaalsContact O-N 3.11Å
101I90.2Very high86.4Confident1 Ų151.5 Ų51.51%0.00528%0.282CS..Hα-helixtrans-69.1-31.3176.8-153.8173000110.7E9 I67 L76 V96 D98 A104 L105E9-I101 WeakPolarHBondContact OE1-CD1 3.39Å; I67-I101 HydrophobicContact CB-CD1 4.46Å; I67-I101 HydrophobicContact CG1-CD1 4.12Å; I67-I101 HydrophobicContact CG2-CD1 4.43Å; L76-I101 HydrophobicContact CD2-CD1 3.92Å; V96-I101 HydrophobicContact CG1-CG2 3.35Å; D98-I101 HydrophobicContact CB-CG2 4.04Å; I101-A104 PolarHBondContact O-N 3.37Å; I101-L105 HydrophobicContact CG1-CD1 4.47Å; I101-L105 WeakPolarHBondContact O-CB 3.38Å; I101-L105 VanDerWaalsContact O-CG 3.25Å; I101-L105 WeakPolarHBondContact O-CG 3.18Å; I101-L105 PolarHBondContact O-N 3.02Å
102G89.6Confident87.2Confident1 Ų148.1 Ų48.11%0.0128%0.276CS..Hα-helixtrans-57-48.816900000112.5D98 A99 K100 A104 L105 Q106 I113D98-G102 PolarHBondContact O-N 3.34Å; D98-G102 VanDerWaalsContact O-N 3.07Å; A99-G102 PolarHBondContact O-N 2.89Å; K100-G102 VanDerWaalsContact C-N 3.26Å; K100-G102 PolarHBondContact O-N 2.84Å; G102-A104 PolarHBondContact O-N 2.97Å; G102-L105 PolarHBondContact O-N 3.22Å; G102-Q106 WeakPolarHBondContact O-CB 3.37Å; G102-Q106 PolarHBondContact O-N 3.34Å; G102-I113 WeakPolarHBondContact O-CD1 3.38Å
103A89.9Confident87.7Confident46 Ų4648.9 Ų48.938%0.3828%0.278SS..Hα-helixtrans-61.5-45176.800000112.1A99 K100 L105 Q106 E107A99-A103 PolarHBondContact O-N 3.16Å; K100-A103 PolarHBondContact O-N 2.72Å; A103-L105 PolarHBondContact O-N 2.81Å; A103-Q106 WeakPolarHBondContact O-CB 3.43Å; A103-Q106 PolarHBondContact O-N 3.31Å; A103-Q106 VanDerWaalsContact O-N 3.14Å; A103-E107 PolarHBondContact O-N 3.21Å
104A90.1Very high87.7Confident21 Ų2151.1 Ų51.117%0.17429%0.287CS..Hα-helixtrans-62-41.9178.200000112.6G70 V72 K100 I101 G102 Q106 E107 E108G70-A104 WeakPolarHBondContact O-CB 3.47Å; V72-A104 HydrophobicContact CG2-CB 3.82Å; K100-A104 PolarHBondContact O-N 3.42Å; K100-A104 VanDerWaalsContact O-N 3.11Å; I101-A104 PolarHBondContact O-N 3.37Å; G102-A104 PolarHBondContact O-N 2.97Å; A104-Q106 VanDerWaalsContact C-N 3.32Å; A104-Q106 PolarHBondContact O-N 3.39Å; A104-E107 PolarHBondContact O-N 3Å; A104-E108 WeakPolarHBondContact O-CB 3.45Å; A104-E108 PolarHBondContact O-N 3Å; A104-E108 VanDerWaalsContact O-N 3.08Å
105L89.3Confident87.4Confident1 Ų154.5 Ų54.51%0.00531%0.308CS..Hα-helixtrans-68.1-31.9174.9-72.5171000112.5L7 V72 L80 L94 V96 I101 G102 A103 E108 F109 I113L7-L105 HydrophobicContact CD2-CD1 4.28Å; V72-L105 HydrophobicContact CB-CD2 4.43Å; V72-L105 HydrophobicContact CG1-CD2 3.83Å; V72-L105 HydrophobicContact CG2-CD2 3.65Å; V72-L105 HydrophobicContact CG2-CG 3.9Å; L80-L105 HydrophobicContact CD1-CD1 4.14Å; L80-L105 HydrophobicContact CD1-CD2 3.46Å; L80-L105 VanDerWaalsContact CD1-CD2 3.46Å; L80-L105 HydrophobicContact CD1-CG 4.44Å; L94-L105 HydrophobicContact CD2-CD1 4.25Å; V96-L105 HydrophobicContact CG2-CD1 4.18Å; I101-L105 HydrophobicContact CG1-CD1 4.47Å; I101-L105 WeakPolarHBondContact O-CB 3.38Å; I101-L105 VanDerWaalsContact O-CG 3.25Å; I101-L105 WeakPolarHBondContact O-CG 3.18Å; I101-L105 PolarHBondContact O-N 3.02Å; G102-L105 PolarHBondContact O-N 3.22Å; A103-L105 PolarHBondContact O-N 2.81Å; L105-E108 PolarHBondContact O-N 3.41Å; L105-F109 HydrophobicContact CD2-CD2 3.92Å; L105-F109 HydrophobicContact CD2-CE2 3.8Å; L105-F109 PolarHBondContact O-N 2.94Å; L105-I113 HydrophobicContact CB-CD1 3.52Å
106Q88.7Confident87Confident104 Ų10456.4 Ų56.449%0.48633%0.328SS..Hα-helixtrans-66.7-43.3176.6-170.8164.316.400110.9G102 A103 A104 S110 I113G102-Q106 WeakPolarHBondContact O-CB 3.37Å; G102-Q106 PolarHBondContact O-N 3.34Å; A103-Q106 WeakPolarHBondContact O-CB 3.43Å; A103-Q106 PolarHBondContact O-N 3.31Å; A103-Q106 VanDerWaalsContact O-N 3.14Å; A104-Q106 VanDerWaalsContact C-N 3.32Å; A104-Q106 PolarHBondContact O-N 3.39Å; Q106-S110 WeakPolarHBondContact O-CA 3.39Å; Q106-S110 PolarHBondContact O-N 2.85Å; Q106-I113 HydrophobicContact CB-CD1 3.96Å
107E86.8Confident86.6Confident167 Ų16758.8 Ų58.878%0.7835%0.352SS*.Hα-helixtrans-62.1-42.8174.7-71.1179-17700111.5A103 A104A103-E107 PolarHBondContact O-N 3.21Å; A104-E107 PolarHBondContact O-N 3Å
108E84.9Confident86.3Confident78 Ų7855.8 Ų55.836%0.36433%0.332SS..Hα-helixtrans-78.3-38.8-173-167.7157.3-157.600113.9V72 K77 A104 L105V72-E108 VanDerWaalsContact CB-OE2 3.32Å; V72-E108 WeakPolarHBondContact CB-OE2 3.45Å; V72-E108 WeakPolarHBondContact CG1-OE2 3.44Å; K77-E108 VanDerWaalsContact CD-OE1 3.28Å; K77-E108 WeakPolarHBondContact CD-OE1 3.32Å; K77-E108 WeakPolarHBondContact CE-OE1 3.38Å; K77-E108 IonicContact NZ-OE1 3.57Å; K77-E108 PolarHBondContact NZ-OE1 2.92Å; A104-E108 WeakPolarHBondContact O-CB 3.45Å; A104-E108 PolarHBondContact O-N 3Å; A104-E108 VanDerWaalsContact O-N 3.08Å; L105-E108 PolarHBondContact O-N 3.41Å
109F81.7Confident86.2Confident25 Ų2552.2 Ų52.211%0.1131%0.313CS..Hα-helixtrans-109.9-6.3-173.7-67.3-71000115.1K77 L80 E81 L86 L105 I111K77-F109 HydrophobicContact CB-CZ 4.25Å; K77-F109 HydrophobicContact CG-CE1 4.21Å; K77-F109 HydrophobicContact CG-CE2 4.22Å; K77-F109 HydrophobicContact CG-CZ 3.46Å; K77-F109 VanDerWaalsContact CG-CZ 3.46Å; L80-F109 HydrophobicContact CB-CE2 4.27Å; L80-F109 HydrophobicContact CB-CZ 4.23Å; L80-F109 HydrophobicContact CD1-CE2 4.1Å; E81-F109 HydrophobicContact CG-CE1 3.42Å; E81-F109 VanDerWaalsContact CG-CE1 3.42Å; E81-F109 HydrophobicContact CG-CZ 3.92Å; L86-F109 HydrophobicContact CD1-CD1 4.08Å; L86-F109 HydrophobicContact CD1-CE1 4.33Å; L86-F109 HydrophobicContact CD2-CB 4.25Å; L86-F109 HydrophobicContact CD2-CD1 4.05Å; L86-F109 HydrophobicContact CD2-CG 4.49Å; L105-F109 HydrophobicContact CD2-CD2 3.92Å; L105-F109 HydrophobicContact CD2-CE2 3.8Å; L105-F109 PolarHBondContact O-N 2.94Å; F109-I111 HydrophobicContact CB-CB 4.47Å; F109-I111 HydrophobicContact CB-CD1 3.47Å; F109-I111 VanDerWaalsContact CB-CD1 3.47Å; F109-I111 HydrophobicContact CB-CG1 3.58Å; F109-I111 HydrophobicContact CG-CD1 4.14Å; F109-I111 PolarHBondContact O-N 3.11Å; F109-I111 VanDerWaalsContact O-N 3.16Å
110S80Confident86.1Confident88 Ų8851 Ų5162%0.61530%0.303SS*.  trans52.434.2-175.7-61.20000113.5Q106Q106-S110 WeakPolarHBondContact O-CA 3.39Å; Q106-S110 PolarHBondContact O-N 2.85Å
111I80.8Confident85.9Confident18 Ų1847.6 Ų47.69%0.09229%0.289CS..  trans-91.6150.1179.4-60.3171.5000109.8L84 L86 A92 L94 F109 I113L84-I111 HydrophobicContact CD1-CD1 3.91Å; L86-I111 HydrophobicContact CD2-CD1 3.57Å; L86-I111 HydrophobicContact CD2-CG1 3.89Å; A92-I111 VanDerWaalsContact O-CG2 3.3Å; A92-I111 WeakPolarHBondContact O-CG2 3.3Å; L94-I111 HydrophobicContact CB-CG2 4.16Å; F109-I111 HydrophobicContact CB-CB 4.47Å; F109-I111 HydrophobicContact CB-CD1 3.47Å; F109-I111 VanDerWaalsContact CB-CD1 3.47Å; F109-I111 HydrophobicContact CB-CG1 3.58Å; F109-I111 HydrophobicContact CG-CD1 4.14Å; F109-I111 PolarHBondContact O-N 3.11Å; F109-I111 VanDerWaalsContact O-N 3.16Å; I111-I113 PolarHBondContact O-N 3.29Å
112S83.8Confident85.8Confident66 Ų6648 Ų4846%0.46229%0.291SS..EExtended strand (participates in β ladder)trans-73.1112167.2-175.70000109.7V93 L94V93-S112 WeakPolarHBondContact CA-O 3.19Å; V93-S112 WeakPolarHBondContact CG1-O 3.39Å; L94-S112 PolarHBondContact N-O 2.75Å
113I86.9Confident85.9Confident26 Ų2648.3 Ų48.313%0.13329%0.293CS..EExtended strand (participates in β ladder)trans-102.2132.8179.5-68.9177.2000110.2L94 V96 G102 L105 Q106 I111 T115L94-I113 HydrophobicContact CB-CG1 4.31Å; L94-I113 CarbonylContact O-C 3.37Å; L94-I113 VanDerWaalsContact O-CA 3.27Å; L94-I113 WeakPolarHBondContact O-CA 3.08Å; V96-I113 HydrophobicContact CB-CG2 4.27Å; V96-I113 HydrophobicContact CG2-CG2 4Å; G102-I113 WeakPolarHBondContact O-CD1 3.38Å; L105-I113 HydrophobicContact CB-CD1 3.52Å; Q106-I113 HydrophobicContact CB-CD1 3.96Å; I111-I113 PolarHBondContact O-N 3.29Å; I113-T115 HydrophobicContact CG2-CG2 4.04Å
114Q86.4Confident85.8Confident74 Ų7453.4 Ų53.435%0.34630%0.302SS..EExtended strand (participates in β ladder)trans-108.4127.9172.9-75-178.6-600109.5V93 L94 G95 V96 V119V93-Q114 HydrophobicContact CG1-CB 4.21Å; V93-Q114 HydrophobicContact CG1-CG 3.57Å; L94-Q114 PolarHBondContact O-N 3.32Å; G95-Q114 WeakPolarHBondContact CA-O 3.22Å; V96-Q114 PolarHBondContact N-O 2.68Å; V96-Q114 VanDerWaalsContact N-O 3.08Å; Q114-V119 HydrophobicContact CB-CG2 3.96Å
115T84.8Confident85.8Confident72 Ų7252.4 Ų52.444%0.44229%0.294SS..  trans-123.9130.8175.956.80000108.8I113I113-T115 HydrophobicContact CG2-CG2 4.04Å
116G82.1Confident85.9Confident40 Ų4052.3 Ų52.341%0.41229%0.294SS..SBendtrans85.4-171.6179.700000114.6A118 V119G116-A118 PolarHBondContact O-N 3.07Å; G116-V119 WeakPolarHBondContact O-CB 3.35Å; G116-V119 PolarHBondContact O-N 3.47Å
117G84.1Confident86Confident52 Ų5255.5 Ų55.554%0.53630%0.301SS..THydrogen-bonded Turntrans56-126.3-176.600000112.4V119 A120G117-V119 VanDerWaalsContact C-N 3.26Å; G117-V119 PolarHBondContact O-N 3.17Å; G117-A120 WeakPolarHBondContact O-CB 3.31Å; G117-A120 PolarHBondContact O-N 3.02Å; G117-A120 VanDerWaalsContact O-N 3.11Å
118A83Confident86.3Confident7 Ų751.8 Ų51.86%0.05829%0.286CS..Hα-helixtrans-56.9-36.1178.800000113.7V22 E24 M27 G116 A120 E121 I122V22-A118 HydrophobicContact CG1-CB 4.02Å; E24-A118 HydrophobicContact CG-CB 4.29Å; M27-A118 HydrophobicContact CE-CB 4.2Å; M27-A118 WeakPolarHBondContact SD-CA 3.24Å; M27-A118 HydrophobicContact SD-CB 3.59Å; M27-A118 VanDerWaalsContact SD-CB 3.59Å; G116-A118 PolarHBondContact O-N 3.07Å; A118-A120 VanDerWaalsContact C-N 3.26Å; A118-A120 PolarHBondContact O-N 2.9Å; A118-E121 PolarHBondContact O-N 2.92Å; A118-I122 HydrophobicContact CB-CD1 4.47Å; A118-I122 WeakPolarHBondContact O-CB 3.49Å; A118-I122 VanDerWaalsContact O-CD1 3.3Å; A118-I122 WeakPolarHBondContact O-CD1 3.22Å; A118-I122 WeakPolarHBondContact O-CG1 3.46Å; A118-I122 PolarHBondContact O-N 3.28Å
119V87.3Confident86.6Confident1 Ų149 Ų491%0.00627%0.273CS..Hα-helixtrans-62.7-36.3179.41790000111.1L4 V6 Q114 G116 G117 T123L4-V119 HydrophobicContact CD2-CG2 4.41Å; V6-V119 HydrophobicContact CG1-CG1 4.39Å; V6-V119 HydrophobicContact CG2-CG1 4.45Å; Q114-V119 HydrophobicContact CB-CG2 3.96Å; G116-V119 WeakPolarHBondContact O-CB 3.35Å; G116-V119 PolarHBondContact O-N 3.47Å; G117-V119 VanDerWaalsContact C-N 3.26Å; G117-V119 PolarHBondContact O-N 3.17Å; V119-T123 VanDerWaalsContact O-CB 3.27Å; V119-T123 WeakPolarHBondContact O-CB 3.43Å; V119-T123 PolarHBondContact O-N 2.94Å; V119-T123 PolarHBondContact O-OG1 3.24Å
120A87.9Confident86.9Confident37 Ų3748 Ų4831%0.30627%0.269SS..Hα-helixtrans-67.6-43.5179.900000111.9G117 A118 T123 R124G117-A120 WeakPolarHBondContact O-CB 3.31Å; G117-A120 PolarHBondContact O-N 3.02Å; G117-A120 VanDerWaalsContact O-N 3.11Å; A118-A120 VanDerWaalsContact C-N 3.26Å; A118-A120 PolarHBondContact O-N 2.9Å; A120-T123 PolarHBondContact O-N 3.38Å; A120-R124 WeakPolarHBondContact O-CG 3.05Å; A120-R124 PolarHBondContact O-N 3.39Å
121E86Confident87.4Confident75 Ų7547.1 Ų47.135%0.3526%0.255SS..Hα-helixtrans-69.7-41178.5-61.6-49.5142.700112.1A118 T123 R124 G125A118-E121 PolarHBondContact O-N 2.92Å; E121-T123 VanDerWaalsContact C-N 3.31Å; E121-T123 PolarHBondContact O-N 3.25Å; E121-R124 WeakPolarHBondContact O-CB 3.33Å; E121-R124 PolarHBondContact O-N 3.3Å; E121-R124 VanDerWaalsContact O-N 3.17Å; E121-R124 IonicContact OE1-CZ 3.56Å; E121-R124 IonicContact OE1-NH1 2.66Å; E121-R124 PolarHBondContact OE1-NH1 2.98Å; E121-R124 WeakPolarHBondContact OE2-CD 3.36Å; E121-R124 IonicContact OE2-CZ 3.92Å; E121-R124 IonicContact OE2-NH1 3Å; E121-R124 PolarHBondContact OE2-NH1 2.91Å; E121-G125 PolarHBondContact O-N 3.47Å
122I88.2Confident87.8Confident10 Ų1049.2 Ų49.25%0.05127%0.271CS..Hα-helixtrans-59.7-45.3173.7-64.5161.6000110.2L4 V6 V19 V22 V46 A118 R124 G125 V126L4-I122 HydrophobicContact CD2-CD1 4.37Å; V6-I122 HydrophobicContact CB-CG2 4.4Å; V6-I122 HydrophobicContact CG1-CG2 4.46Å; V6-I122 HydrophobicContact CG2-CD1 4.45Å; V6-I122 HydrophobicContact CG2-CG2 3.98Å; V19-I122 HydrophobicContact CG1-CD1 3.98Å; V19-I122 HydrophobicContact CG2-CD1 3.97Å; V19-I122 HydrophobicContact CG2-CG2 4.31Å; V22-I122 HydrophobicContact CG1-CD1 4.45Å; V22-I122 HydrophobicContact CG2-CD1 3.82Å; V22-I122 HydrophobicContact CG2-CG1 4.24Å; V46-I122 HydrophobicContact CG2-CG2 3.85Å; A118-I122 HydrophobicContact CB-CD1 4.47Å; A118-I122 WeakPolarHBondContact O-CB 3.49Å; A118-I122 VanDerWaalsContact O-CD1 3.3Å; A118-I122 WeakPolarHBondContact O-CD1 3.22Å; A118-I122 WeakPolarHBondContact O-CG1 3.46Å; A118-I122 PolarHBondContact O-N 3.28Å; I122-R124 VanDerWaalsContact C-N 3.3Å; I122-R124 PolarHBondContact O-N 2.92Å; I122-G125 PolarHBondContact O-N 3.3Å; I122-V126 HydrophobicContact CG2-CG2 4.38Å; I122-V126 WeakPolarHBondContact O-CG2 3.24Å; I122-V126 PolarHBondContact O-N 3.13Å
123T90.6Very high88Confident6 Ų647 Ų474%0.03725%0.254CS..Hα-helixtrans-61.5-38.4177.6-58.70000111.6F8 S97 V119 A120 E121 V126 R127F8-T123 HydrophobicContact CD2-CG2 4Å; F8-T123 HydrophobicContact CE2-CG2 4.24Å; S97-T123 WeakPolarHBondContact OG-CG2 3.11Å; V119-T123 VanDerWaalsContact O-CB 3.27Å; V119-T123 WeakPolarHBondContact O-CB 3.43Å; V119-T123 PolarHBondContact O-N 2.94Å; V119-T123 PolarHBondContact O-OG1 3.24Å; A120-T123 PolarHBondContact O-N 3.38Å; E121-T123 VanDerWaalsContact C-N 3.31Å; E121-T123 PolarHBondContact O-N 3.25Å; T123-V126 PolarHBondContact O-N 3Å; T123-R127 WeakPolarHBondContact O-CB 3.36Å; T123-R127 PolarHBondContact O-N 2.89Å
124R89Confident88Confident153 Ų15346 Ų4658%0.57725%0.249SC*.Hα-helixtrans-63.8-45.6174.8-76.3176.1-178.9160.14.8111.9A120 E121 I122 R127 L128A120-R124 WeakPolarHBondContact O-CG 3.05Å; A120-R124 PolarHBondContact O-N 3.39Å; E121-R124 WeakPolarHBondContact O-CB 3.33Å; E121-R124 PolarHBondContact O-N 3.3Å; E121-R124 VanDerWaalsContact O-N 3.17Å; E121-R124 IonicContact OE1-CZ 3.56Å; E121-R124 IonicContact OE1-NH1 2.66Å; E121-R124 PolarHBondContact OE1-NH1 2.98Å; E121-R124 WeakPolarHBondContact OE2-CD 3.36Å; E121-R124 IonicContact OE2-CZ 3.92Å; E121-R124 IonicContact OE2-NH1 3Å; E121-R124 PolarHBondContact OE2-NH1 2.91Å; I122-R124 VanDerWaalsContact C-N 3.3Å; I122-R124 PolarHBondContact O-N 2.92Å; R124-R127 WeakPolarHBondContact O-CB 3.33Å; R124-R127 PolarHBondContact O-N 3.22Å; R124-L128 PolarHBondContact O-N 3.15Å
125G90.1Very high87.9Confident0 Ų052.3 Ų52.30%028%0.275CS..Hα-helixtrans-61.2-43.8175.100000112.6V36 E121 I122 R127 L128 H129V36-G125 VanDerWaalsContact CG1-CA 3.43Å; E121-G125 PolarHBondContact O-N 3.47Å; I122-G125 PolarHBondContact O-N 3.3Å; G125-R127 VanDerWaalsContact C-N 3.32Å; G125-R127 PolarHBondContact O-N 3.27Å; G125-L128 PolarHBondContact O-N 3.36Å; G125-H129 PolarHBondContact O-CD2 3.05Å; G125-H129 PolarHBondContact O-N 3.3Å; G125-H129 VanDerWaalsContact O-N 3.08Å
126V91.7Very high87.7Confident0 Ų053 Ų530%030%0.296CS..Hα-helixtrans-59.6-44.4174170.50000110.3F8 F17 F42 V46 I122 T123 L128 H129 F130 L133F8-V126 HydrophobicContact CB-CG1 3.92Å; F8-V126 HydrophobicContact CD1-CG1 3.8Å; F8-V126 HydrophobicContact CD2-CB 4.36Å; F8-V126 HydrophobicContact CD2-CG1 3.72Å; F8-V126 HydrophobicContact CE1-CG1 4.21Å; F8-V126 HydrophobicContact CE2-CG1 4.14Å; F8-V126 HydrophobicContact CG-CG1 3.52Å; F8-V126 HydrophobicContact CZ-CG1 4.37Å; F17-V126 HydrophobicContact CD2-CG1 3.88Å; F17-V126 HydrophobicContact CD2-CG2 4.05Å; F17-V126 HydrophobicContact CE2-CB 4.47Å; F17-V126 HydrophobicContact CE2-CG1 3.33Å; F17-V126 HydrophobicContact CE2-CG2 4.23Å; F17-V126 HydrophobicContact CG-CG2 4.22Å; F17-V126 HydrophobicContact CZ-CG1 3.78Å; F42-V126 HydrophobicContact CE1-CG2 4.01Å; F42-V126 HydrophobicContact CZ-CG2 3.9Å; F42-V126 VanDerWaalsContact CZ-N 3.29Å; V46-V126 HydrophobicContact CG1-CG2 4.29Å; I122-V126 HydrophobicContact CG2-CG2 4.38Å; I122-V126 WeakPolarHBondContact O-CG2 3.24Å; I122-V126 PolarHBondContact O-N 3.13Å; T123-V126 PolarHBondContact O-N 3Å; V126-L128 VanDerWaalsContact C-N 3.34Å; V126-L128 PolarHBondContact O-N 3.06Å; V126-H129 CarbonylContact O-C 3.5Å; V126-H129 PolarHBondContact O-N 3.45Å; V126-F130 HydrophobicContact CG1-CD2 4.07Å; V126-F130 WeakPolarHBondContact O-CA 3.47Å; V126-F130 WeakPolarHBondContact O-CB 3.27Å; V126-F130 PolarHBondContact O-N 3.29Å; V126-L133 HydrophobicContact CB-CD1 4.44Å; V126-L133 HydrophobicContact CG1-CD1 4.29Å; V126-L133 HydrophobicContact CG2-CD1 4.39Å
127R91.2Very high87.8Confident170 Ų17052.4 Ų52.464%0.64228%0.284SS*.Hα-helixtrans-61.8-40.8178.8-173.1178.2-65.9178.10.5112.5F8 T123 R124 G125F8-R127 HydrophobicContact CE2-CB 3.9Å; F8-R127 HydrophobicContact CE2-CG 4.44Å; F8-R127 HydrophobicContact CZ-CB 4Å; F8-R127 HydrophobicContact CZ-CG 4.23Å; T123-R127 WeakPolarHBondContact O-CB 3.36Å; T123-R127 PolarHBondContact O-N 2.89Å; R124-R127 WeakPolarHBondContact O-CB 3.33Å; R124-R127 PolarHBondContact O-N 3.22Å; G125-R127 VanDerWaalsContact C-N 3.32Å; G125-R127 PolarHBondContact O-N 3.27Å
128L91.1Very high88.1Confident89 Ų8953.7 Ų53.747%0.46628%0.281SS..Hα-helixtrans-64.4-44178.5-179.561.6000111.5L37 R124 G125 V126L37-L128 HydrophobicContact CD2-CD2 3.94Å; R124-L128 PolarHBondContact O-N 3.15Å; G125-L128 PolarHBondContact O-N 3.36Å; V126-L128 VanDerWaalsContact C-N 3.34Å; V126-L128 PolarHBondContact O-N 3.06Å
129H91.3Very high88.4Confident19 Ų1956 Ų569%0.08830%0.3CS..Hα-helixtrans-1036.9-171.9-62.7-58000114.4V36 L37 L39 F42 G125 V126 H131 S132 L133V36-H129 PolarHBondContact O-CD2 3.18Å; V36-H129 PolarHBondContact O-NE2 3.11Å; L37-H129 PolarHBondContact O-CE1 3.13Å; L37-H129 PolarHBondContact O-NE2 3.45Å; L39-H129 HydrophobicContact CD1-CB 3.79Å; F42-H129 AromaticContact CD1-CD2 3.93Å; G125-H129 PolarHBondContact O-CD2 3.05Å; G125-H129 PolarHBondContact O-N 3.3Å; G125-H129 VanDerWaalsContact O-N 3.08Å; V126-H129 CarbonylContact O-C 3.5Å; V126-H129 PolarHBondContact O-N 3.45Å; H129-H131 VanDerWaalsContact C-N 3.26Å; H129-H131 PolarHBondContact O-N 2.95Å; H129-H131 VanDerWaalsContact O-N 3.11Å; H129-S132 PolarHBondContact O-N 3.47Å; H129-L133 HydrophobicContact CB-CD1 4.12Å; H129-L133 HydrophobicContact CB-CG 4.19Å; H129-L133 WeakPolarHBondContact O-CG 3.32Å; H129-L133 PolarHBondContact O-N 3.16Å; H129-L133 VanDerWaalsContact O-N 3.12Å
130F89.8Confident88.6Confident6 Ų663.9 Ų63.93%0.02634%0.337CS..Hα-helixtrans-53.4-41.7-167.6-173.3-109.4000113.6F8 H10 A15 F17 F51 V126 S132 L133 V134 L137F8-F130 AromaticContact CD1-CD2 3.43Å; F8-F130 HydrophobicContact CD1-CD2 3.43Å; F8-F130 VanDerWaalsContact CD1-CD2 3.43Å; F8-F130 AromaticContact CD1-CE2 3.39Å; F8-F130 HydrophobicContact CD1-CE2 3.39Å; F8-F130 HydrophobicContact CD1-CG 4.21Å; F8-F130 HydrophobicContact CD1-CZ 4.13Å; F8-F130 HydrophobicContact CE1-CB 4.21Å; F8-F130 HydrophobicContact CE1-CD1 4.19Å; F8-F130 AromaticContact CE1-CD2 3.33Å; F8-F130 HydrophobicContact CE1-CD2 3.33Å; F8-F130 HydrophobicContact CE1-CE1 4.45Å; F8-F130 AromaticContact CE1-CE2 3.65Å; F8-F130 HydrophobicContact CE1-CE2 3.65Å; F8-F130 AromaticContact CE1-CG 3.64Å; F8-F130 HydrophobicContact CE1-CG 3.64Å; F8-F130 HydrophobicContact CE1-CZ 4.2Å; F8-F130 HydrophobicContact CZ-CD2 4.4Å; H10-F130 HydrophobicContact CB-CD1 4.22Å; H10-F130 HydrophobicContact CB-CE1 3.51Å; H10-F130 HydrophobicContact CB-CE2 4.42Å; H10-F130 HydrophobicContact CB-CZ 3.62Å; H10-F130 AromaticContact CD2-CD1 3.65Å; H10-F130 AromaticContact CD2-CE1 3.74Å; H10-F130 AromaticContact CE1-CE1 3.98Å; H10-F130 AromaticContact CG-CD1 3.66Å; H10-F130 AromaticContact CG-CE1 3.22Å; H10-F130 AromaticContact CG-CZ 3.9Å; H10-F130 AromaticContact ND1-CD1 3.93Å; H10-F130 AromaticContact ND1-CE1 3.39Å; H10-F130 WeakPolarHBondContact ND1-CE1 3.47Å; H10-F130 AromaticContact NE2-CD1 3.96Å; A15-F130 HydrophobicContact CB-CE2 3.79Å; A15-F130 HydrophobicContact CB-CZ 4.31Å; F17-F130 HydrophobicContact CE2-CD2 4.41Å; F17-F130 HydrophobicContact CE2-CE2 4.24Å; F17-F130 HydrophobicContact CZ-CD2 4.23Å; F17-F130 HydrophobicContact CZ-CE2 4.19Å; F51-F130 HydrophobicContact CE2-CZ 4.05Å; V126-F130 HydrophobicContact CG1-CD2 4.07Å; V126-F130 WeakPolarHBondContact O-CA 3.47Å; V126-F130 WeakPolarHBondContact O-CB 3.27Å; V126-F130 PolarHBondContact O-N 3.29Å; F130-S132 PolarHBondContact O-N 2.96Å; F130-L133 PolarHBondContact O-N 3.42Å; F130-V134 HydrophobicContact CD2-CG2 4.32Å; F130-V134 HydrophobicContact CE1-CG2 4.25Å; F130-V134 HydrophobicContact CE2-CG2 3.73Å; F130-V134 HydrophobicContact CZ-CG2 3.69Å; F130-V134 PolarHBondContact O-N 2.97Å; F130-L137 HydrophobicContact CD1-CD2 3.58Å; F130-L137 HydrophobicContact CE1-CD2 3.37Å; F130-L137 HydrophobicContact CZ-CD2 4.36Å
131H89.4Confident88.7Confident68 Ų6864.3 Ų64.332%0.31534%0.34SS..Hα-helixtrans-62.1-29.4179.159.672.8000112.9H129 A139H129-H131 VanDerWaalsContact C-N 3.26Å; H129-H131 PolarHBondContact O-N 2.95Å; H129-H131 VanDerWaalsContact O-N 3.11Å; H131-A139 HydrophobicContact CB-CB 4.23Å
132S88.8Confident88.8Confident63 Ų6361.1 Ų61.144%0.44133%0.327SS..Hα-helixtrans-90.9-20.1178.4-60.50000112.8H129 F130H129-S132 PolarHBondContact O-N 3.47Å; F130-S132 PolarHBondContact O-N 2.96Å
133L88.4Confident89Confident18 Ų1864 Ų649%0.09435%0.348CS..Hα-helixtrans-79.2-29.9-178.9-68.9171.7000112.9F17 F42 N43 V126 H129 F130F17-L133 HydrophobicContact CE1-CB 3.97Å; F17-L133 HydrophobicContact CE1-CD1 3.96Å; F17-L133 HydrophobicContact CE1-CG 4.42Å; F17-L133 HydrophobicContact CZ-CB 4.15Å; F17-L133 HydrophobicContact CZ-CD1 4.08Å; F42-L133 HydrophobicContact CD1-CD1 4.47Å; F42-L133 HydrophobicContact CE1-CD1 4.04Å; N43-L133 WeakPolarHBondContact OD1-CD2 3.32Å; V126-L133 HydrophobicContact CB-CD1 4.44Å; V126-L133 HydrophobicContact CG1-CD1 4.29Å; V126-L133 HydrophobicContact CG2-CD1 4.39Å; H129-L133 HydrophobicContact CB-CD1 4.12Å; H129-L133 HydrophobicContact CB-CG 4.19Å; H129-L133 WeakPolarHBondContact O-CG 3.32Å; H129-L133 PolarHBondContact O-N 3.16Å; H129-L133 VanDerWaalsContact O-N 3.12Å; F130-L133 PolarHBondContact O-N 3.42Å
134V87.2Confident89.1Confident7 Ų771.6 Ų71.64%0.04238%0.38CS..SBendtrans-97.3121.5178.4-178.70000110L48 F51 F130 G136 L137L48-V134 HydrophobicContact CD2-CG2 4.47Å; F51-V134 HydrophobicContact CD1-CG1 3.68Å; F51-V134 HydrophobicContact CD2-CG1 4.32Å; F51-V134 HydrophobicContact CD2-CG2 4.21Å; F51-V134 HydrophobicContact CE1-CG1 3.74Å; F51-V134 HydrophobicContact CE2-CG1 4.39Å; F51-V134 HydrophobicContact CE2-CG2 4.37Å; F51-V134 HydrophobicContact CG-CG1 3.99Å; F51-V134 HydrophobicContact CZ-CG1 4.11Å; F130-V134 HydrophobicContact CD2-CG2 4.32Å; F130-V134 HydrophobicContact CE1-CG2 4.25Å; F130-V134 HydrophobicContact CE2-CG2 3.73Å; F130-V134 HydrophobicContact CZ-CG2 3.69Å; F130-V134 PolarHBondContact O-N 2.97Å; V134-G136 PolarHBondContact O-N 3.08Å; V134-L137 HydrophobicContact CB-CB 3.97Å; V134-L137 HydrophobicContact CB-CD2 4.22Å; V134-L137 HydrophobicContact CG1-CB 4.15Å; V134-L137 PolarHBondContact O-N 3.48Å
135K83.7Confident89.2Confident206 Ų20665.8 Ų65.890%0.89637%0.366SS*.THydrogen-bonded Turntrans-61.2125.6178.4-66.4-176.9-179.5179.30110.6L137K135-L137 VanDerWaalsContact C-N 3.33Å
136G81Confident89.4Confident85 Ų8570.7 Ų70.788%0.87639%0.388SS*.THydrogen-bonded Turntrans84.7-0.617800000115V134V134-G136 PolarHBondContact O-N 3.08Å
137L84.9Confident89.5Confident28 Ų2875.6 Ų75.615%0.14741%0.414CS..  trans-87.8129.6169.7-169.561.7000108.9F130 V134 K135 A141 A142F130-L137 HydrophobicContact CD1-CD2 3.58Å; F130-L137 HydrophobicContact CE1-CD2 3.37Å; F130-L137 HydrophobicContact CZ-CD2 4.36Å; V134-L137 HydrophobicContact CB-CB 3.97Å; V134-L137 HydrophobicContact CB-CD2 4.22Å; V134-L137 HydrophobicContact CG1-CB 4.15Å; V134-L137 PolarHBondContact O-N 3.48Å; K135-L137 VanDerWaalsContact C-N 3.33Å; L137-A141 HydrophobicContact CD1-CB 4.29Å; L137-A142 HydrophobicContact CD1-CB 4.21Å; L137-A142 HydrophobicContact CD2-CB 4.25Å; L137-A142 HydrophobicContact CG-CB 4.23Å
138T90Very high89.6Confident79 Ų7969.1 Ų69.149%0.48540%0.4SS..  trans-104.9157.1170.665.30000109.7Q140 A141 A142T138-Q140 PolarHBondContact O-N 3.1Å; T138-A141 PolarHBondContact O-N 3.47Å; T138-A141 VanDerWaalsContact O-N 3.15Å; T138-A141 VanDerWaalsContact OG1-CB 3.3Å; T138-A141 WeakPolarHBondContact OG1-CB 3.24Å; T138-A141 PolarHBondContact OG1-N 3.13Å; T138-A141 VanDerWaalsContact OG1-N 3.15Å; T138-A142 PolarHBondContact O-N 2.96Å
139A89.3Confident89.7Confident55 Ų5565.8 Ų65.846%0.45538%0.383SS..Hα-helixtrans-57.6-37.7176.400000111.9H131 S143H131-A139 HydrophobicContact CB-CB 4.23Å; A139-S143 WeakPolarHBondContact O-CB 3Å; A139-S143 PolarHBondContact O-N 3.11Å
140Q90.5Very high89.8Confident168 Ų16866.2 Ų66.279%0.78539%0.392SS*.Hα-helixtrans-65.8-44.3175.9-67.3-179.1-5.800112.2T138 S143 K144T138-Q140 PolarHBondContact O-N 3.1Å; Q140-S143 PolarHBondContact O-N 3.39Å; Q140-K144 WeakPolarHBondContact O-CB 3.48Å; Q140-K144 PolarHBondContact O-N 2.9Å
141A89.8Confident89.8Confident45 Ų4570.6 Ų70.637%0.37241%0.412SS..Hα-helixtrans-64.9-41.3177.800000111.8L137 T138 K144 A145L137-A141 HydrophobicContact CD1-CB 4.29Å; T138-A141 PolarHBondContact O-N 3.47Å; T138-A141 VanDerWaalsContact O-N 3.15Å; T138-A141 VanDerWaalsContact OG1-CB 3.3Å; T138-A141 WeakPolarHBondContact OG1-CB 3.24Å; T138-A141 PolarHBondContact OG1-N 3.13Å; T138-A141 VanDerWaalsContact OG1-N 3.15Å; A141-K144 PolarHBondContact O-N 2.78Å; A141-A145 WeakPolarHBondContact O-CB 2.94Å; A141-A145 PolarHBondContact O-N 3.39Å
142A89.5Confident89.8Confident8 Ų869.2 Ų69.27%0.06641%0.41CS..Hα-helixtrans-60.6-47.2175.200000111.6L137 T138 K144 A145 Q146L137-A142 HydrophobicContact CD1-CB 4.21Å; L137-A142 HydrophobicContact CD2-CB 4.25Å; L137-A142 HydrophobicContact CG-CB 4.23Å; T138-A142 PolarHBondContact O-N 2.96Å; A142-K144 PolarHBondContact O-N 3.2Å; A142-A145 PolarHBondContact O-N 2.8Å; A142-Q146 WeakPolarHBondContact O-CG 3.39Å; A142-Q146 PolarHBondContact O-N 2.91Å
143S92.3Very high90Very high72 Ų7267.7 Ų67.750%0.50340%0.395SS..Hα-helixtrans-62.1-42.4177.2179.90000112.4A139 Q140 A145 Q146 L147A139-S143 WeakPolarHBondContact O-CB 3Å; A139-S143 PolarHBondContact O-N 3.11Å; Q140-S143 PolarHBondContact O-N 3.39Å; S143-A145 PolarHBondContact O-N 3.19Å; S143-Q146 PolarHBondContact O-N 3.34Å; S143-L147 WeakPolarHBondContact O-CB 3.45Å; S143-L147 PolarHBondContact O-N 3.02Å
144K92.4Very high90Very high164 Ų16470 Ų7071%0.71341%0.413SS*.Hα-helixtrans-63.9-40.2176.7-169.9176-178.6179.20112.2Q140 A141 A142 L147 G148Q140-K144 WeakPolarHBondContact O-CB 3.48Å; Q140-K144 PolarHBondContact O-N 2.9Å; A141-K144 PolarHBondContact O-N 2.78Å; A142-K144 PolarHBondContact O-N 3.2Å; K144-L147 PolarHBondContact O-N 2.99Å; K144-G148 PolarHBondContact O-N 3.11Å
145A91.7Very high90Very high32 Ų3277 Ų7726%0.26444%0.438SS..Hα-helixtrans-63.7-44.3175.200000111.5A11 A141 A142 S143 G148 L149A11-A145 HydrophobicContact CB-CB 4.29Å; A141-A145 WeakPolarHBondContact O-CB 2.94Å; A141-A145 PolarHBondContact O-N 3.39Å; A142-A145 PolarHBondContact O-N 2.8Å; S143-A145 PolarHBondContact O-N 3.19Å; A145-G148 PolarHBondContact O-N 3.07Å; A145-L149 WeakPolarHBondContact O-CB 3.35Å; A145-L149 PolarHBondContact O-N 2.88Å
146Q93.1Very high90Very high103 Ų10369.5 Ų69.548%0.48142%0.415SS..Hα-helixtrans-60.9-44.8175.4-71.5173.8-3.600112.1H10 A11 A142 S143 G150H10-Q146 PolarHBondContact NE2-NE2 3.47Å; A11-Q146 HydrophobicContact CB-CB 4.37Å; A11-Q146 HydrophobicContact CB-CG 3.83Å; A142-Q146 WeakPolarHBondContact O-CG 3.39Å; A142-Q146 PolarHBondContact O-N 2.91Å; S143-Q146 PolarHBondContact O-N 3.34Å; Q146-G150 PolarHBondContact O-N 3.45Å
147L94.3Very high90.1Very high103 Ų10372 Ų7254%0.53940%0.402SS..Hα-helixtrans-61.2-47.6177.6-177.167.3000111.7S143 K144 G150 H151S143-L147 WeakPolarHBondContact O-CB 3.45Å; S143-L147 PolarHBondContact O-N 3.02Å; K144-L147 PolarHBondContact O-N 2.99Å; L147-G150 PolarHBondContact O-N 2.86Å; L147-H151 WeakPolarHBondContact O-CB 3.49Å; L147-H151 VanDerWaalsContact O-CG 3.32Å; L147-H151 PolarHBondContact O-N 3.24Å
148G92.2Very high89.9Confident34 Ų3476.1 Ų76.135%0.35143%0.428SS..Hα-helixtrans-63.7-44.2-179.900000112.7K144 A145 S152K144-G148 PolarHBondContact O-N 3.11Å; A145-G148 PolarHBondContact O-N 3.07Å; G148-S152 WeakPolarHBondContact O-CB 3.44Å; G148-S152 PolarHBondContact O-N 3.02Å; G148-S152 VanDerWaalsContact O-N 3.1Å; G148-S152 PolarHBondContact O-OG 2.93Å
149L94.1Very high88.9Confident19 Ų1980.9 Ų80.910%0.09944%0.442CS..Hα-helixtrans-68.8-43.1178.2-175.860.7000111.3A11 A60 L61 M64 A145 H151 S152 Y153A11-L149 HydrophobicContact CB-CB 4.25Å; A11-L149 HydrophobicContact CB-CD2 3.69Å; A60-L149 HydrophobicContact CB-CD1 3.97Å; L61-L149 HydrophobicContact CB-CD1 4.28Å; M64-L149 HydrophobicContact CB-CD1 4.4Å; M64-L149 HydrophobicContact CB-CD2 4.33Å; M64-L149 HydrophobicContact SD-CD1 4.06Å; M64-L149 HydrophobicContact SD-CD2 3.74Å; M64-L149 HydrophobicContact SD-CG 3.59Å; M64-L149 VanDerWaalsContact SD-CG 3.59Å; A145-L149 WeakPolarHBondContact O-CB 3.35Å; A145-L149 PolarHBondContact O-N 2.88Å; L149-H151 PolarHBondContact O-N 3.43Å; L149-S152 PolarHBondContact O-N 3.21Å; L149-S152 VanDerWaalsContact O-N 3.11Å; L149-Y153 WeakPolarHBondContact O-CB 3.43Å; L149-Y153 PolarHBondContact O-N 3.27Å
150G93.4Very high87.7Confident28 Ų2884.6 Ų84.629%0.28945%0.448SS..Hα-helixtrans-60.5-41.7177.500000112.9Q146 L147 S154Q146-G150 PolarHBondContact O-N 3.45Å; L147-G150 PolarHBondContact O-N 2.86Å; G150-S154 VanDerWaalsContact O-CB 3.28Å; G150-S154 WeakPolarHBondContact O-CB 3.33Å; G150-S154 PolarHBondContact O-N 2.99Å; G150-S154 PolarHBondContact O-OG 3.08Å
151H90.8Very high86.2Confident97 Ų9779.4 Ų79.445%0.44943%0.426SS..Hα-helixtrans-61.6-46171.6-73.3167.9000111.9L147 L149 R155L147-H151 WeakPolarHBondContact O-CB 3.49Å; L147-H151 VanDerWaalsContact O-CG 3.32Å; L147-H151 PolarHBondContact O-N 3.24Å; L149-H151 PolarHBondContact O-N 3.43Å; H151-R155 WeakPolarHBondContact O-CB 3.47Å; H151-R155 WeakPolarHBondContact O-CG 3.48Å; H151-R155 PolarHBondContact O-N 3.39Å
152S89.3Confident84.6Confident39 Ų3982.8 Ų82.827%0.27344%0.441SS..Hα-helixtrans-66.3-45.3-177.5-57.20000111.9G148 L149 R155 A156G148-S152 WeakPolarHBondContact O-CB 3.44Å; G148-S152 PolarHBondContact O-N 3.02Å; G148-S152 VanDerWaalsContact O-N 3.1Å; G148-S152 PolarHBondContact O-OG 2.93Å; L149-S152 PolarHBondContact O-N 3.21Å; L149-S152 VanDerWaalsContact O-N 3.11Å; S152-R155 PolarHBondContact O-N 3.26Å; S152-A156 WeakPolarHBondContact O-CB 3.38Å; S152-A156 PolarHBondContact O-N 2.69Å
153Y91.3Very high82.9Confident32 Ų3288.7 Ų88.713%0.12547%0.472CS..Hα-helixtrans-60.7-48.2175.7179.7-98.3000111.8L61 M64 N65 S68 L149 R155 A156 K157L61-Y153 HydrophobicContact CD1-CD2 4.38Å; M64-Y153 HydrophobicContact CE-CD1 3.6Å; M64-Y153 HydrophobicContact CE-CD2 3.69Å; M64-Y153 HydrophobicContact CE-CE1 4.01Å; M64-Y153 HydrophobicContact CE-CE2 4.08Å; M64-Y153 HydrophobicContact CE-CG 3.42Å; M64-Y153 VanDerWaalsContact CE-CG 3.42Å; M64-Y153 HydrophobicContact CG-CD2 3.86Å; M64-Y153 HydrophobicContact CG-CE2 4.2Å; M64-Y153 HydrophobicContact CG-CG 4.45Å; M64-Y153 HydrophobicContact SD-CD1 4.44Å; M64-Y153 HydrophobicContact SD-CD2 3.67Å; M64-Y153 HydrophobicContact SD-CE2 4.43Å; M64-Y153 HydrophobicContact SD-CG 3.67Å; N65-Y153 VanDerWaalsContact OD1-CD2 3.24Å; N65-Y153 WeakPolarHBondContact OD1-CD2 3.44Å; N65-Y153 VanDerWaalsContact OD1-CE2 3.22Å; N65-Y153 WeakPolarHBondContact OD1-CE2 3.47Å; S68-Y153 PolarHBondContact OG-OH 2.88Å; L149-Y153 WeakPolarHBondContact O-CB 3.43Å; L149-Y153 PolarHBondContact O-N 3.27Å; Y153-R155 VanDerWaalsContact C-N 3.35Å; Y153-R155 PolarHBondContact O-N 3Å; Y153-A156 PolarHBondContact O-N 3.43Å; Y153-K157 HydrophobicContact CE1-CD 3.82Å; Y153-K157 VanDerWaalsContact O-CB 3.32Å; Y153-K157 WeakPolarHBondContact O-CB 3.47Å; Y153-K157 PolarHBondContact O-N 3.42Å; Y153-K157 PolarHBondContact OH-NZ 3.36Å
154S90.1Very high81.6Confident66 Ų6690 Ų9046%0.46247%0.466SS..Hα-helixtrans-63.3-41178.8-57.60000111.8G150 K157 V158G150-S154 VanDerWaalsContact O-CB 3.28Å; G150-S154 WeakPolarHBondContact O-CB 3.33Å; G150-S154 PolarHBondContact O-N 2.99Å; G150-S154 PolarHBondContact O-OG 3.08Å; S154-K157 PolarHBondContact O-N 3.4Å; S154-V158 WeakPolarHBondContact O-CB 3.35Å; S154-V158 VanDerWaalsContact O-CG2 3.27Å; S154-V158 WeakPolarHBondContact O-CG2 3.45Å; S154-V158 PolarHBondContact O-N 2.89Å
155R85.8Confident80.6Confident153 Ų15383.7 Ų83.758%0.57744%0.444SS*.Hα-helixtrans-63.6-44.2176.3-75.3171.4-175.4-175.41.8112.1H151 S152 Y153 K159 F160H151-R155 WeakPolarHBondContact O-CB 3.47Å; H151-R155 WeakPolarHBondContact O-CG 3.48Å; H151-R155 PolarHBondContact O-N 3.39Å; S152-R155 PolarHBondContact O-N 3.26Å; Y153-R155 VanDerWaalsContact C-N 3.35Å; Y153-R155 PolarHBondContact O-N 3Å; R155-K159 PolarHBondContact O-N 3.36Å; R155-F160 HydrophobicContact CB-CB 4.16Å; R155-F160 HydrophobicContact CG-CB 4.19Å; R155-F160 HydrophobicContact CG-CG 4.49Å; R155-F160 PolarHBondContact O-N 2.91Å
156A83.9Confident80.3Confident50 Ų5083.8 Ų83.841%0.41344%0.44SS..Hα-helixtrans-63.5-47.3177.600000111.2L61 S152 Y153 K159L61-A156 HydrophobicContact CD1-CB 4.41Å; L61-A156 HydrophobicContact CD2-CB 4.34Å; S152-A156 WeakPolarHBondContact O-CB 3.38Å; S152-A156 PolarHBondContact O-N 2.69Å; Y153-A156 PolarHBondContact O-N 3.43Å; A156-K159 PolarHBondContact O-N 3.24Å
157K83.9Confident80.1Confident138 Ų13883.4 Ų83.460%0.644%0.441SS*.Hα-helixtrans-68.5-41.3-176.3-165167.2-167.4169.20113.3Y153 S154 K159Y153-K157 HydrophobicContact CE1-CD 3.82Å; Y153-K157 VanDerWaalsContact O-CB 3.32Å; Y153-K157 WeakPolarHBondContact O-CB 3.47Å; Y153-K157 PolarHBondContact O-N 3.42Å; Y153-K157 PolarHBondContact OH-NZ 3.36Å; S154-K157 PolarHBondContact O-N 3.4Å; K157-K159 PolarHBondContact O-N 2.87Å
158V81.1Confident79.9Confident114 Ų11482.7 Ų82.769%0.69144%0.436SS*.THydrogen-bonded Turntrans-78.3-2.3179-179.70000111.5S154 F160S154-V158 WeakPolarHBondContact O-CB 3.35Å; S154-V158 VanDerWaalsContact O-CG2 3.27Å; S154-V158 WeakPolarHBondContact O-CG2 3.45Å; S154-V158 PolarHBondContact O-N 2.89Å; V158-F160 PolarHBondContact O-N 3.08Å
159K68Low80Confident179 Ų17981.1 Ų81.178%0.77842%0.42SS*.THydrogen-bonded Turntrans45.153.7-167.5-65.2-178.6179177.50109.7R155 A156 K157 N161R155-K159 PolarHBondContact O-N 3.36Å; A156-K159 PolarHBondContact O-N 3.24Å; K157-K159 PolarHBondContact O-N 2.87Å; K159-N161 PolarHBondContact O-N 3.43Å
160F63.7Low79.9Confident133 Ų13381.3 Ų81.358%0.58342%0.421SS*.  trans-53.7107.8-179.3-175.7-92.7000108.3R155 V158 V162R155-F160 HydrophobicContact CB-CB 4.16Å; R155-F160 HydrophobicContact CG-CB 4.19Å; R155-F160 HydrophobicContact CG-CG 4.49Å; R155-F160 PolarHBondContact O-N 2.91Å; V158-F160 PolarHBondContact O-N 3.08Å; F160-V162 PolarHBondContact O-N 2.88Å
161N59.7Low80Confident59 Ų5985.3 Ų85.332%0.31643%0.432SS..  trans-74.797.3-171.8-167.2-12.1000107.6K159 N163 R164K159-N161 PolarHBondContact O-N 3.43Å; N161-N163 PolarHBondContact O-N 3.31Å; N161-N163 VanDerWaalsContact O-N 3.08Å; N161-N163 VanDerWaalsContact OD1-CB 3.27Å; N161-N163 WeakPolarHBondContact OD1-CB 3.37Å; N161-N163 PolarHBondContact OD1-N 3.3Å; N161-R164 HydrophobicContact CB-CB 4.46Å; N161-R164 HydrophobicContact CB-CG 4.04Å; N161-R164 WeakPolarHBondContact O-CB 3.46Å; N161-R164 PolarHBondContact O-N 3.49Å
162V55.6Low80.2Confident115 Ų11581.3 Ų81.370%0.69742%0.415SS*.THydrogen-bonded Turntrans-56.4-24.4177.4-176.10000110.9F160 R164F160-V162 PolarHBondContact O-N 2.88Å; V162-R164 VanDerWaalsContact C-N 3.31Å; V162-R164 PolarHBondContact O-N 2.91Å
163N54.4Low80.5Confident132 Ų13279.5 Ų79.571%0.70640%0.402SS*.THydrogen-bonded Turntrans-77.2-12177.4-54.1-34.9000113.6N161 A165N161-N163 PolarHBondContact O-N 3.31Å; N161-N163 VanDerWaalsContact O-N 3.08Å; N161-N163 VanDerWaalsContact OD1-CB 3.27Å; N161-N163 WeakPolarHBondContact OD1-CB 3.37Å; N161-N163 PolarHBondContact OD1-N 3.3Å; N163-A165 PolarHBondContact O-N 3.02Å
164R65.6Low80.7Confident101 Ų10180.2 Ų80.238%0.38142%0.415SS..  trans-80.358.8168.8-71.1-174.3-178.3173.23.8110.1N161 V162 D166 C385 S387N161-R164 HydrophobicContact CB-CB 4.46Å; N161-R164 HydrophobicContact CB-CG 4.04Å; N161-R164 WeakPolarHBondContact O-CB 3.46Å; N161-R164 PolarHBondContact O-N 3.49Å; V162-R164 VanDerWaalsContact C-N 3.31Å; V162-R164 PolarHBondContact O-N 2.91Å; R164-D166 PolarHBondContact O-N 3.2Å; R164-C385 PolarHBondContact NH1-O 2.94Å; R164-C385 PolarHBondContact NH2-O 2.89Å; R164-S387 PolarHBondContact NH2-O 3.2Å
165A71.2Confident80.9Confident30 Ų3080.5 Ų80.525%0.24841%0.411CS..  trans-82.253.3179.200000111.5N163 N167 M168N163-A165 PolarHBondContact O-N 3.02Å; A165-N167 PolarHBondContact O-N 2.89Å; A165-M168 HydrophobicContact CB-CG 4.15Å; A165-M168 HydrophobicContact CB-SD 4.23Å; A165-M168 PolarHBondContact O-N 3.34Å; A165-M168 VanDerWaalsContact O-N 3.13Å
166D84.8Confident81.4Confident34 Ų3473.4 Ų73.418%0.18238%0.384CS..Hα-helixtrans-62.9-29.4178.760.7-11.2000112.2R164 M168 I169 I170 S315 L316R164-D166 PolarHBondContact O-N 3.2Å; D166-M168 VanDerWaalsContact C-N 3.26Å; D166-M168 PolarHBondContact O-N 2.82Å; D166-I169 WeakPolarHBondContact O-CB 3.32Å; D166-I169 PolarHBondContact O-N 3.13Å; D166-I169 VanDerWaalsContact O-N 3.07Å; D166-I170 VanDerWaalsContact O-CG1 3.32Å; D166-I170 WeakPolarHBondContact O-CG1 3.46Å; D166-I170 PolarHBondContact O-N 3.02Å; D166-S315 WeakPolarHBondContact OD2-CA 3.22Å; D166-S315 VanDerWaalsContact OD2-CB 3.27Å; D166-S315 WeakPolarHBondContact OD2-CB 3.43Å; D166-L316 HydrophobicContact CB-CB 4.28Å; D166-L316 PolarHBondContact OD2-N 3.29Å
167N88.8Confident81.9Confident95 Ų9573.2 Ų73.251%0.50838%0.376SS..Hα-helixtrans-56.5-37.8172.4-169.726.1000112.8A165 I169 I170 Q171A165-N167 PolarHBondContact O-N 2.89Å; N167-I169 VanDerWaalsContact C-N 3.31Å; N167-I169 PolarHBondContact O-N 3.42Å; N167-I170 PolarHBondContact O-N 2.85Å; N167-Q171 WeakPolarHBondContact O-CG 3.38Å; N167-Q171 PolarHBondContact O-N 3.5Å; N167-Q171 PolarHBondContact OD1-NE2 3.1Å
168M90.8Very high82.4Confident89 Ų8970.7 Ų70.744%0.43837%0.366SS..Hα-helixtrans-63.7-39.7177.5-62.6-168.8101.300111.3A165 D166 Q171 S172 Y285A165-M168 HydrophobicContact CB-CG 4.15Å; A165-M168 HydrophobicContact CB-SD 4.23Å; A165-M168 PolarHBondContact O-N 3.34Å; A165-M168 VanDerWaalsContact O-N 3.13Å; D166-M168 VanDerWaalsContact C-N 3.26Å; D166-M168 PolarHBondContact O-N 2.82Å; M168-Q171 PolarHBondContact O-N 2.96Å; M168-S172 VanDerWaalsContact O-CB 3.27Å; M168-S172 WeakPolarHBondContact O-CB 3.37Å; M168-S172 PolarHBondContact O-N 3.11Å; M168-S172 PolarHBondContact O-OG 2.75Å; M168-Y285 WeakPolarHBondContact CE-OH 3.27Å; M168-Y285 PolarHBondContact SD-OH 3.16Å; M168-Y285 VanDerWaalsContact SD-OH 3.42Å
169I92.9Very high83.1Confident1 Ų165.8 Ų65.81%0.00534%0.336CS..Hα-helixtrans-63.4-44.2176.2-65.5172.4000110.3D166 N167 S172 I173 L286 K289 M290 V293 A307D166-I169 WeakPolarHBondContact O-CB 3.32Å; D166-I169 PolarHBondContact O-N 3.13Å; D166-I169 VanDerWaalsContact O-N 3.07Å; N167-I169 VanDerWaalsContact C-N 3.31Å; N167-I169 PolarHBondContact O-N 3.42Å; I169-S172 PolarHBondContact O-N 2.88Å; I169-I173 WeakPolarHBondContact O-CG2 3.48Å; I169-I173 PolarHBondContact O-N 3.15Å; I169-L286 HydrophobicContact CB-CD1 4.46Å; I169-L286 HydrophobicContact CG2-CD1 3.95Å; I169-K289 HydrophobicContact CG1-CB 4.22Å; I169-M290 HydrophobicContact CD1-SD 4.09Å; I169-M290 HydrophobicContact CG2-SD 4.34Å; I169-V293 HydrophobicContact CD1-CB 3.66Å; I169-V293 HydrophobicContact CD1-CG1 3.91Å; I169-V293 HydrophobicContact CD1-CG2 3.86Å; I169-A307 HydrophobicContact CG2-CB 3.71Å
170I93.8Very high84.3Confident22 Ų2259.3 Ų59.311%0.11331%0.31CS..Hα-helixtrans-60.7-47.3179.8-63.2171.6000111D166 N167 I173 A174 I310 G314D166-I170 VanDerWaalsContact O-CG1 3.32Å; D166-I170 WeakPolarHBondContact O-CG1 3.46Å; D166-I170 PolarHBondContact O-N 3.02Å; N167-I170 PolarHBondContact O-N 2.85Å; I170-I173 WeakPolarHBondContact O-CG2 3.39Å; I170-A174 WeakPolarHBondContact O-CB 3.31Å; I170-A174 PolarHBondContact O-N 3.49Å; I170-I310 HydrophobicContact CD1-CG2 4.43Å; I170-I310 HydrophobicContact CG1-CG2 4.06Å; I170-G314 WeakPolarHBondContact CD1-O 3.26Å
171Q94.1Very high85.8Confident113 Ų11359 Ų5953%0.52831%0.309SS..Hα-helixtrans-69.1-41.6178.8-60.4-51.1-36.400111.7N167 M168 I173 A174 L175N167-Q171 WeakPolarHBondContact O-CG 3.38Å; N167-Q171 PolarHBondContact O-N 3.5Å; N167-Q171 PolarHBondContact OD1-NE2 3.1Å; M168-Q171 PolarHBondContact O-N 2.96Å; Q171-I173 PolarHBondContact O-N 3.33Å; Q171-A174 PolarHBondContact O-N 3.17Å; Q171-L175 WeakPolarHBondContact O-CB 3.38Å; Q171-L175 PolarHBondContact O-N 3.3Å
172S94.8Very high87.5Confident13 Ų1358.4 Ų58.49%0.09131%0.305CS..Hα-helixtrans-62.2-42.9179.3-690000112.7M168 I169 L175 L176 Y285M168-S172 VanDerWaalsContact O-CB 3.27Å; M168-S172 WeakPolarHBondContact O-CB 3.37Å; M168-S172 PolarHBondContact O-N 3.11Å; M168-S172 PolarHBondContact O-OG 2.75Å; I169-S172 PolarHBondContact O-N 2.88Å; S172-L175 PolarHBondContact O-N 2.94Å; S172-L176 WeakPolarHBondContact O-CB 3.32Å; S172-L176 PolarHBondContact O-N 2.98Å; S172-Y285 WeakPolarHBondContact OG-CE1 3.3Å
173I95.7Very high89.3Confident1 Ų153.7 Ų53.71%0.00528%0.276CS..Hα-helixtrans-70.7-37.1177.9-170.860.7000112.3I169 I170 Q171 L175 L176 D177 L286 V304 A307 R308I169-I173 WeakPolarHBondContact O-CG2 3.48Å; I169-I173 PolarHBondContact O-N 3.15Å; I170-I173 WeakPolarHBondContact O-CG2 3.39Å; Q171-I173 PolarHBondContact O-N 3.33Å; I173-L175 VanDerWaalsContact C-N 3.32Å; I173-L175 PolarHBondContact O-N 3.26Å; I173-L176 PolarHBondContact O-N 2.71Å; I173-D177 PolarHBondContact O-N 2.86Å; I173-L286 HydrophobicContact CD1-CD2 4.08Å; I173-V304 HydrophobicContact CD1-CG1 3.94Å; I173-A307 HydrophobicContact CB-CB 4.04Å; I173-A307 HydrophobicContact CD1-CB 4.41Å; I173-A307 HydrophobicContact CG1-CB 4.16Å; I173-A307 HydrophobicContact CG2-CB 4.41Å; I173-R308 HydrophobicContact CG1-CB 4.35Å
174A95.7Very high91.2Very high47 Ų4751.2 Ų51.239%0.38826%0.263SS..Hα-helixtrans-63.4-41.3175.400000111.3I170 Q171 Q178I170-A174 WeakPolarHBondContact O-CB 3.31Å; I170-A174 PolarHBondContact O-N 3.49Å; Q171-A174 PolarHBondContact O-N 3.17Å; A174-Q178 WeakPolarHBondContact O-CB 3.38Å; A174-Q178 PolarHBondContact O-N 3.08Å; A174-Q178 VanDerWaalsContact O-N 3.08Å
175L95.8Very high92.6Very high71 Ų7150.6 Ų50.637%0.37227%0.271SS..Hα-helixtrans-65.8-41.5174.5-17861.4000111.6Q171 S172 I173 Q178 L179 Y278 L282Q171-L175 WeakPolarHBondContact O-CB 3.38Å; Q171-L175 PolarHBondContact O-N 3.3Å; S172-L175 PolarHBondContact O-N 2.94Å; I173-L175 VanDerWaalsContact C-N 3.32Å; I173-L175 PolarHBondContact O-N 3.26Å; L175-Q178 PolarHBondContact O-N 3.41Å; L175-L179 HydrophobicContact CD1-CD1 4.48Å; L175-L179 HydrophobicContact CD1-CG 4.25Å; L175-L179 HydrophobicContact CG-CD1 4.12Å; L175-L179 HydrophobicContact CG-CG 4.33Å; L175-L179 WeakPolarHBondContact O-CB 3.47Å; L175-L179 VanDerWaalsContact O-CG 3.3Å; L175-L179 WeakPolarHBondContact O-CG 3.28Å; L175-L179 PolarHBondContact O-N 3.24Å; L175-Y278 HydrophobicContact CD2-CE1 4.23Å; L175-L282 HydrophobicContact CB-CD2 4.04Å; L175-L282 HydrophobicContact CD2-CD2 3.78Å; L175-L282 HydrophobicContact CG-CD2 3.78Å
176L95.4Very high93.7Very high4 Ų452.6 Ų52.62%0.02127%0.274CS..Hα-helixtrans-61.8-47.7177.1-168157.9000111.5S172 I173 Q178 L179 D180 L282 Q283 L286S172-L176 WeakPolarHBondContact O-CB 3.32Å; S172-L176 PolarHBondContact O-N 2.98Å; I173-L176 PolarHBondContact O-N 2.71Å; L176-Q178 PolarHBondContact O-N 2.96Å; L176-L179 PolarHBondContact O-N 3.33Å; L176-D180 PolarHBondContact O-N 2.74Å; L176-L282 HydrophobicContact CB-CD2 4.12Å; L176-Q283 HydrophobicContact CD1-CB 4.16Å; L176-L286 HydrophobicContact CD1-CD2 4.36Å
177D93.9Very high94.1Very high46 Ų4651 Ų5125%0.24627%0.265CS..Hα-helixtrans-63.9-28.1177-76.9-16.4000112.1I173 R308I173-D177 PolarHBondContact O-N 2.86Å; D177-R308 IonicContact OD1-CZ 3.17Å; D177-R308 IonicContact OD1-NE 2.7Å; D177-R308 IonicContact OD1-NH2 3.3Å; D177-R308 PolarHBondContact OD1-NH2 3.41Å; D177-R308 IonicContact OD2-NE 3.34Å; D177-R308 PolarHBondContact OD2-NE 3.07Å; D177-R308 IonicContact OD2-NH2 2.69Å
178Q95.6Very high94.3Very high85 Ų8550.7 Ų50.740%0.39726%0.262SS..Hα-helixtrans-77-46.7174.8-175.157.544.300111.4A174 L175 L176 D180 K181 D182A174-Q178 WeakPolarHBondContact O-CB 3.38Å; A174-Q178 PolarHBondContact O-N 3.08Å; A174-Q178 VanDerWaalsContact O-N 3.08Å; L175-Q178 PolarHBondContact O-N 3.41Å; L176-Q178 PolarHBondContact O-N 2.96Å; Q178-D180 VanDerWaalsContact C-N 3.27Å; Q178-D180 PolarHBondContact O-N 2.96Å; Q178-K181 PolarHBondContact O-N 2.98Å; Q178-D182 WeakPolarHBondContact CG-OD2 3.4Å; Q178-D182 PolarHBondContact NE2-OD1 3.19Å; Q178-D182 PolarHBondContact NE2-OD2 2.88Å; Q178-D182 PolarHBondContact O-N 2.71Å
179L95Very high94.4Very high11 Ų1153.7 Ų53.76%0.05827%0.268CS..Hα-helixtrans-57.4-40175.7-74.7174.9000111.6L175 L176 K181 D182 I183 L275 Y278 L282L175-L179 HydrophobicContact CD1-CD1 4.48Å; L175-L179 HydrophobicContact CD1-CG 4.25Å; L175-L179 HydrophobicContact CG-CD1 4.12Å; L175-L179 HydrophobicContact CG-CG 4.33Å; L175-L179 WeakPolarHBondContact O-CB 3.47Å; L175-L179 VanDerWaalsContact O-CG 3.3Å; L175-L179 WeakPolarHBondContact O-CG 3.28Å; L175-L179 PolarHBondContact O-N 3.24Å; L176-L179 PolarHBondContact O-N 3.33Å; L179-K181 VanDerWaalsContact C-N 3.28Å; L179-K181 PolarHBondContact O-N 3.34Å; L179-D182 PolarHBondContact O-N 2.9Å; L179-I183 HydrophobicContact CB-CD1 4.36Å; L179-I183 VanDerWaalsContact O-CB 3.28Å; L179-I183 WeakPolarHBondContact O-CB 3.39Å; L179-I183 WeakPolarHBondContact O-CD1 3.04Å; L179-I183 WeakPolarHBondContact O-CG1 3.28Å; L179-I183 PolarHBondContact O-N 3.05Å; L179-L275 HydrophobicContact CD2-CD2 3.98Å; L179-Y278 HydrophobicContact CD1-CD1 3.86Å; L179-Y278 HydrophobicContact CD1-CE1 4.07Å; L179-L282 HydrophobicContact CD1-CD2 3.94Å
180D93Very high94.4Very high44 Ų4453.6 Ų53.624%0.23527%0.268CS..Hα-helixtrans-57.3-39.7175.7-85.3-24.6000112.8L176 Q178 N184 R279L176-D180 PolarHBondContact O-N 2.74Å; Q178-D180 VanDerWaalsContact C-N 3.27Å; Q178-D180 PolarHBondContact O-N 2.96Å; D180-N184 PolarHBondContact O-N 2.97Å; D180-N184 PolarHBondContact O-ND2 2.82Å; D180-R279 IonicContact OD1-CZ 3.54Å; D180-R279 VanDerWaalsContact OD1-CZ 3.24Å; D180-R279 IonicContact OD1-NE 3.63Å; D180-R279 PolarHBondContact OD1-NE 3.4Å; D180-R279 IonicContact OD1-NH2 3.98Å; D180-R279 PolarHBondContact OD1-NH2 3.02Å; D180-R279 IonicContact OD2-NH2 3.52Å
181K95.1Very high94.4Very high127 Ų12753.9 Ų53.955%0.55227%0.268SS*.Hα-helixtrans-75.4-41.6178.4-66171.6-169.5160.60111.5Q178 L179 N184 T185Q178-K181 PolarHBondContact O-N 2.98Å; L179-K181 VanDerWaalsContact C-N 3.28Å; L179-K181 PolarHBondContact O-N 3.34Å; K181-N184 PolarHBondContact O-N 3.2Å; K181-T185 WeakPolarHBondContact O-CB 3.42Å; K181-T185 PolarHBondContact O-N 3.25Å; K181-T185 PolarHBondContact O-OG1 2.9Å
182D94.9Very high94.3Very high45 Ų4553.5 Ų53.524%0.24127%0.266CS..Hα-helixtrans-68.5-45-177.6-68.5-18.2000110.8Q178 L179 N184 T185 F186Q178-D182 WeakPolarHBondContact CG-OD2 3.4Å; Q178-D182 PolarHBondContact NE2-OD1 3.19Å; Q178-D182 PolarHBondContact NE2-OD2 2.88Å; Q178-D182 PolarHBondContact O-N 2.71Å; L179-D182 PolarHBondContact O-N 2.9Å; D182-N184 VanDerWaalsContact C-N 3.32Å; D182-N184 PolarHBondContact O-N 3.3Å; D182-T185 PolarHBondContact O-N 2.94Å; D182-F186 HydrophobicContact CB-CD2 4.22Å; D182-F186 HydrophobicContact CB-CE2 3.83Å; D182-F186 HydrophobicContact CB-CZ 4.34Å; D182-F186 VanDerWaalsContact O-CB 3.31Å; D182-F186 WeakPolarHBondContact O-CB 3.48Å; D182-F186 WeakPolarHBondContact O-CD2 3.49Å; D182-F186 WeakPolarHBondContact O-CG 3.27Å; D182-F186 PolarHBondContact O-N 3.3Å
183I94.5Very high94.1Very high16 Ų1657.5 Ų57.58%0.08228%0.279CS..Hα-helixtrans-56.6-47.6174.2-69.8163.1000110L179 T185 F186 S187 L275 A276 R279L179-I183 HydrophobicContact CB-CD1 4.36Å; L179-I183 VanDerWaalsContact O-CB 3.28Å; L179-I183 WeakPolarHBondContact O-CB 3.39Å; L179-I183 WeakPolarHBondContact O-CD1 3.04Å; L179-I183 WeakPolarHBondContact O-CG1 3.28Å; L179-I183 PolarHBondContact O-N 3.05Å; I183-T185 PolarHBondContact O-N 3.36Å; I183-F186 PolarHBondContact O-N 3.23Å; I183-S187 VanDerWaalsContact O-CB 3.25Å; I183-S187 WeakPolarHBondContact O-CB 3.41Å; I183-S187 PolarHBondContact O-N 3.31Å; I183-S187 PolarHBondContact O-OG 2.94Å; I183-L275 HydrophobicContact CG1-CB 4.14Å; I183-A276 HydrophobicContact CD1-CB 4.44Å; I183-R279 HydrophobicContact CD1-CB 4Å; I183-R279 HydrophobicContact CD1-CG 4.33Å
184N93.4Very high94Very high81 Ų8157.5 Ų57.543%0.43328%0.279SS..Hα-helixtrans-63-44.2178.4-80-45.6000112.6D180 K181 D182 M188 N208D180-N184 PolarHBondContact O-N 2.97Å; D180-N184 PolarHBondContact O-ND2 2.82Å; K181-N184 PolarHBondContact O-N 3.2Å; D182-N184 VanDerWaalsContact C-N 3.32Å; D182-N184 PolarHBondContact O-N 3.3Å; N184-M188 WeakPolarHBondContact O-CB 3.36Å; N184-M188 VanDerWaalsContact O-CG 3.26Å; N184-M188 WeakPolarHBondContact O-CG 3.27Å; N184-M188 PolarHBondContact O-N 2.81Å; N184-N208 PolarHBondContact OD1-ND2 2.84Å
185T94.9Very high93.7Very high88 Ų8855.8 Ų55.854%0.5427%0.266SS..Hα-helixtrans-65.4-43.7179.8-55.40000111.2K181 D182 I183 M188 R189K181-T185 WeakPolarHBondContact O-CB 3.42Å; K181-T185 PolarHBondContact O-N 3.25Å; K181-T185 PolarHBondContact O-OG1 2.9Å; D182-T185 PolarHBondContact O-N 2.94Å; I183-T185 PolarHBondContact O-N 3.36Å; T185-M188 PolarHBondContact O-N 3.4Å; T185-R189 PolarHBondContact O-N 2.79Å
186F94.8Very high93.4Very high71 Ų7160.6 Ų60.631%0.31128%0.28SS..Hα-helixtrans-69.8-40.2178.3-61.1-30.7000112.1D182 I183 M188 R189 V190 F268 V272 L275D182-F186 HydrophobicContact CB-CD2 4.22Å; D182-F186 HydrophobicContact CB-CE2 3.83Å; D182-F186 HydrophobicContact CB-CZ 4.34Å; D182-F186 VanDerWaalsContact O-CB 3.31Å; D182-F186 WeakPolarHBondContact O-CB 3.48Å; D182-F186 WeakPolarHBondContact O-CD2 3.49Å; D182-F186 WeakPolarHBondContact O-CG 3.27Å; D182-F186 PolarHBondContact O-N 3.3Å; I183-F186 PolarHBondContact O-N 3.23Å; F186-M188 VanDerWaalsContact C-N 3.34Å; F186-M188 PolarHBondContact O-N 2.91Å; F186-R189 CarbonylContact O-C 3.54Å; F186-R189 WeakPolarHBondContact O-CA 3.39Å; F186-R189 WeakPolarHBondContact O-CB 3.5Å; F186-R189 PolarHBondContact O-N 3.3Å; F186-R189 VanDerWaalsContact O-N 3.09Å; F186-V190 WeakPolarHBondContact O-CG2 3.5Å; F186-V190 PolarHBondContact O-N 3.23Å; F186-F268 HydrophobicContact CB-CE2 4.42Å; F186-F268 HydrophobicContact CB-CZ 3.8Å; F186-F268 HydrophobicContact CD1-CE2 4.32Å; F186-F268 AromaticContact CD1-CZ 3.93Å; F186-F268 HydrophobicContact CD1-CZ 3.93Å; F186-F268 HydrophobicContact CG-CE2 4.37Å; F186-F268 HydrophobicContact CG-CZ 4.05Å; F186-V272 HydrophobicContact CB-CG2 3.51Å; F186-V272 HydrophobicContact CG-CG2 4.47Å; F186-L275 HydrophobicContact CD2-CD1 4.01Å; F186-L275 HydrophobicContact CE2-CD1 4.05Å
187S93.7Very high93.2Very high0 Ų060.4 Ų60.40%028%0.279CS..Hα-helixtrans-61.4-41.1173.2-70.10000112.1I183 R189 V190 R191 V272I183-S187 VanDerWaalsContact O-CB 3.25Å; I183-S187 WeakPolarHBondContact O-CB 3.41Å; I183-S187 PolarHBondContact O-N 3.31Å; I183-S187 PolarHBondContact O-OG 2.94Å; S187-R189 VanDerWaalsContact C-N 3.27Å; S187-R189 PolarHBondContact O-N 3.46Å; S187-V190 PolarHBondContact O-N 3.36Å; S187-R191 WeakPolarHBondContact O-CG 3.33Å; S187-R191 PolarHBondContact O-N 2.92Å; S187-V272 WeakPolarHBondContact OG-CG1 3.39Å
188M92Very high93.1Very high90 Ų9058.2 Ų58.244%0.44327%0.267SS..Hα-helixtrans-61.4-38.4173.1-72.9-60.5-62.700111.4N184 T185 F186 R191 E192N184-M188 WeakPolarHBondContact O-CB 3.36Å; N184-M188 VanDerWaalsContact O-CG 3.26Å; N184-M188 WeakPolarHBondContact O-CG 3.27Å; N184-M188 PolarHBondContact O-N 2.81Å; T185-M188 PolarHBondContact O-N 3.4Å; F186-M188 VanDerWaalsContact C-N 3.34Å; F186-M188 PolarHBondContact O-N 2.91Å; M188-R191 WeakPolarHBondContact O-CB 3.45Å; M188-R191 PolarHBondContact O-N 2.72Å; M188-E192 WeakPolarHBondContact O-CG 3.49Å; M188-E192 PolarHBondContact O-N 2.8Å
189R93.9Very high92.8Very high151 Ų15156.5 Ų56.557%0.5726%0.264SS*.Hα-helixtrans-67.8-39.8176.4-166.959156.3-176.2-2.4113T185 F186 S187 R191 E192 W193 F268T185-R189 PolarHBondContact O-N 2.79Å; F186-R189 CarbonylContact O-C 3.54Å; F186-R189 WeakPolarHBondContact O-CA 3.39Å; F186-R189 WeakPolarHBondContact O-CB 3.5Å; F186-R189 PolarHBondContact O-N 3.3Å; F186-R189 VanDerWaalsContact O-N 3.09Å; S187-R189 VanDerWaalsContact C-N 3.27Å; S187-R189 PolarHBondContact O-N 3.46Å; R189-R191 VanDerWaalsContact C-N 3.32Å; R189-E192 IonicContact NH1-OE2 2.8Å; R189-E192 PolarHBondContact NH1-OE2 2.94Å; R189-E192 PolarHBondContact O-N 3.34Å; R189-W193 WeakPolarHBondContact O-CB 3.39Å; R189-W193 PolarHBondContact O-N 2.99Å; R189-F268 HydrophobicContact CB-CE1 3.93Å; R189-F268 HydrophobicContact CB-CZ 4.33Å; R189-F268 HydrophobicContact CG-CE1 4Å; R189-F268 HydrophobicContact CG-CZ 4.41Å
190V93Very high92.6Very high0 Ų058.1 Ų58.10%027%0.271CS..Hα-helixtrans-61.9-41.8172.31750000110.4F186 S187 W193 Y194 Y211 A215 F268 V272F186-V190 WeakPolarHBondContact O-CG2 3.5Å; F186-V190 PolarHBondContact O-N 3.23Å; S187-V190 PolarHBondContact O-N 3.36Å; V190-W193 PolarHBondContact O-N 2.82Å; V190-Y194 VanDerWaalsContact O-CB 3.29Å; V190-Y194 WeakPolarHBondContact O-CB 3.28Å; V190-Y194 PolarHBondContact O-N 3.23Å; V190-Y211 HydrophobicContact CG1-CD1 4.37Å; V190-Y211 HydrophobicContact CG1-CE1 4.25Å; V190-A215 HydrophobicContact CG1-CB 4.43Å; V190-F268 HydrophobicContact CG2-CD1 3.37Å; V190-F268 HydrophobicContact CG2-CE1 3.53Å; V190-F268 HydrophobicContact CG2-CG 4.33Å; V190-V272 HydrophobicContact CG2-CG2 4.13Å
191R92.5Very high92.5Very high28 Ų2856 Ų5611%0.10626%0.26CS..Hα-helixtrans-60.4-49.3176.6-78.9177.4171.1-167-1.3112.8S187 M188 R189 W193 G195 I202 V205 T206 D207 N208 Y211S187-R191 WeakPolarHBondContact O-CG 3.33Å; S187-R191 PolarHBondContact O-N 2.92Å; M188-R191 WeakPolarHBondContact O-CB 3.45Å; M188-R191 PolarHBondContact O-N 2.72Å; R189-R191 VanDerWaalsContact C-N 3.32Å; R191-W193 VanDerWaalsContact C-N 3.34Å; R191-W193 PolarHBondContact O-N 2.81Å; R191-G195 VanDerWaalsContact O-CA 3.28Å; R191-G195 WeakPolarHBondContact O-CA 3.36Å; R191-G195 PolarHBondContact O-N 3.38Å; R191-I202 HydrophobicContact CB-CD1 4.49Å; R191-V205 PolarHBondContact NH2-O 2.99Å; R191-T206 PolarHBondContact NH2-O 2.85Å; R191-D207 PolarHBondContact NH2-O 2.79Å; R191-N208 PolarHBondContact NE-OD1 2.83Å; R191-N208 PolarHBondContact NH1-OD1 3.16Å; R191-N208 VanDerWaalsContact NH2-N 3.2Å; R191-N208 PolarHBondContact NH2-OD1 2.82Å; R191-N208 VanDerWaalsContact NH2-OD1 3.15Å; R191-Y211 HydrophobicContact CB-CD1 4.46Å; R191-Y211 HydrophobicContact CB-CE1 4.11Å; R191-Y211 HydrophobicContact CG-CD1 3.43Å; R191-Y211 VanDerWaalsContact CG-CD1 3.43Å; R191-Y211 HydrophobicContact CG-CD2 4.04Å; R191-Y211 HydrophobicContact CG-CE1 3.51Å; R191-Y211 HydrophobicContact CG-CE2 4.08Å; R191-Y211 HydrophobicContact CG-CG 3.72Å
192E91.9Very high92.2Very high105 Ų10553.1 Ų53.149%0.49125%0.25SC..Hα-helixtrans-61.2-44.6176.9-71.6175.417500111.5M188 R189 Y196M188-E192 WeakPolarHBondContact O-CG 3.49Å; M188-E192 PolarHBondContact O-N 2.8Å; R189-E192 IonicContact NH1-OE2 2.8Å; R189-E192 PolarHBondContact NH1-OE2 2.94Å; R189-E192 PolarHBondContact O-N 3.34Å; E192-Y196 WeakPolarHBondContact O-CD2 3.14Å
193W91.7Very high91.8Very high97 Ų9759.6 Ų59.637%0.36728%0.276SS..Hα-helixtrans-70.4-48-175-160.9-2.6000112.4R189 V190 R191 G195 N264 I265 F268R189-W193 WeakPolarHBondContact O-CB 3.39Å; R189-W193 PolarHBondContact O-N 2.99Å; V190-W193 PolarHBondContact O-N 2.82Å; R191-W193 VanDerWaalsContact C-N 3.34Å; R191-W193 PolarHBondContact O-N 2.81Å; W193-G195 VanDerWaalsContact C-N 3.34Å; W193-N264 HydrophobicContact CH2-CB 3.84Å; W193-N264 HydrophobicContact CZ2-CB 4.17Å; W193-I265 HydrophobicContact CB-CG1 4.41Å; W193-I265 HydrophobicContact CD2-CD1 4.16Å; W193-I265 HydrophobicContact CD2-CG1 3.47Å; W193-I265 VanDerWaalsContact CD2-CG1 3.47Å; W193-I265 HydrophobicContact CE3-CG1 3.94Å; W193-I265 HydrophobicContact CG-CD1 3.87Å; W193-I265 HydrophobicContact CG-CG1 3.67Å; W193-I265 HydrophobicContact CZ2-CG1 4.13Å; W193-I265 HydrophobicContact CZ3-CG1 4.44Å; W193-F268 HydrophobicContact CE3-CD1 4.29Å; W193-F268 HydrophobicContact CZ3-CB 4.41Å; W193-F268 HydrophobicContact CZ3-CD1 4.4Å
194Y92.6Very high91.6Very high0 Ų060.8 Ų60.80%028%0.282CS..Hα-helixtrans-74.3-26.1177.3-167.2-108.8000112.6V190 Y196 H197 F198 L201 Y211 A215 I218 G219 L262 I265V190-Y194 VanDerWaalsContact O-CB 3.29Å; V190-Y194 WeakPolarHBondContact O-CB 3.28Å; V190-Y194 PolarHBondContact O-N 3.23Å; Y194-Y196 PolarHBondContact O-N 2.89Å; Y194-H197 AromaticContact CE2-CD2 3.94Å; Y194-H197 WeakPolarHBondContact O-CA 3.49Å; Y194-H197 WeakPolarHBondContact O-CB 3.4Å; Y194-H197 PolarHBondContact O-N 2.94Å; Y194-F198 HydrophobicContact CD1-CB 4.36Å; Y194-F198 HydrophobicContact CE1-CB 3.82Å; Y194-F198 HydrophobicContact CE1-CD1 4.2Å; Y194-F198 PolarHBondContact O-N 3.3Å; Y194-L201 HydrophobicContact CD1-CD2 4.04Å; Y194-L201 HydrophobicContact CE1-CD2 3.72Å; Y194-Y211 HydrophobicContact CD1-CE1 4.33Å; Y194-A215 HydrophobicContact CD1-CB 4.03Å; Y194-A215 HydrophobicContact CD2-CB 4.46Å; Y194-A215 HydrophobicContact CE1-CB 4.26Å; Y194-A215 HydrophobicContact CG-CB 4.13Å; Y194-I218 VanDerWaalsContact OH-CG2 3.24Å; Y194-I218 WeakPolarHBondContact OH-CG2 3.32Å; Y194-G219 WeakPolarHBondContact CE2-O 3.31Å; Y194-G219 PolarHBondContact OH-O 3.06Å; Y194-L262 HydrophobicContact CE2-CD1 4.22Å; Y194-I265 HydrophobicContact CD2-CG2 3.96Å; Y194-I265 HydrophobicContact CG-CG2 4.46Å
195G90.5Very high91.3Very high11 Ų1157.2 Ų57.211%0.11326%0.263CS..Hα-helixtrans-62.6-22177.800000114.2R191 W193 H197 P199R191-G195 VanDerWaalsContact O-CA 3.28Å; R191-G195 WeakPolarHBondContact O-CA 3.36Å; R191-G195 PolarHBondContact O-N 3.38Å; W193-G195 VanDerWaalsContact C-N 3.34Å; G195-H197 VanDerWaalsContact C-N 3.28Å; G195-H197 PolarHBondContact O-N 3.5Å; G195-P199 WeakPolarHBondContact O-CA 3.47Å; G195-P199 VanDerWaalsContact O-CB 3.26Å; G195-P199 WeakPolarHBondContact O-CB 3.14Å; G195-P199 WeakPolarHBondContact O-CD 3.35Å
196Y89.8Confident90.9Very high172 Ų17258.7 Ų58.768%0.67527%0.272SS*.THydrogen-bonded Turntrans-65.6-32.5169.6-78-80.5000112.5E192 Y194 M255E192-Y196 WeakPolarHBondContact O-CD2 3.14Å; Y194-Y196 PolarHBondContact O-N 2.89Å; Y196-M255 PolarHBondContact O-N 3.18Å
197H90.1Very high90.6Very high0 Ų058.3 Ų58.30%027%0.273CS..THydrogen-bonded Turntrans-87.8-43.9179.5-177.156.2000112.2Y194 G195 R221 G254 M255 I257Y194-H197 AromaticContact CE2-CD2 3.94Å; Y194-H197 WeakPolarHBondContact O-CA 3.49Å; Y194-H197 WeakPolarHBondContact O-CB 3.4Å; Y194-H197 PolarHBondContact O-N 2.94Å; G195-H197 VanDerWaalsContact C-N 3.28Å; G195-H197 PolarHBondContact O-N 3.5Å; H197-R221 WeakPolarHBondContact NE2-CG 3.33Å; H197-R221 PolarHBondContact NE2-N 2.82Å; H197-R221 PolarHBondContact O-NH1 3.35Å; H197-G254 WeakPolarHBondContact O-CA 3.2Å; H197-M255 WeakPolarHBondContact CA-O 3.39Å; H197-M255 PolarHBondContact ND1-O 3.08Å; H197-I257 HydrophobicContact CB-CB 4.35Å; H197-I257 HydrophobicContact CB-CG2 4.36Å
198F91.5Very high90.3Very high0 Ų059.5 Ų59.50%028%0.279CS..  trans-13477.8-179.6-167.7-168.9000111.9Y194 E200 L201 I218 I245 A248Y194-F198 HydrophobicContact CD1-CB 4.36Å; Y194-F198 HydrophobicContact CE1-CB 3.82Å; Y194-F198 HydrophobicContact CE1-CD1 4.2Å; Y194-F198 PolarHBondContact O-N 3.3Å; F198-E200 VanDerWaalsContact C-N 3.33Å; F198-E200 HydrophobicContact CD2-CB 4.34Å; F198-E200 WeakPolarHBondContact CD2-OE2 3.36Å; F198-E200 HydrophobicContact CE2-CB 3.96Å; F198-E200 PolarHBondContact O-N 2.93Å; F198-L201 HydrophobicContact CD1-CB 3.75Å; F198-L201 HydrophobicContact CD1-CD2 4.05Å; F198-L201 HydrophobicContact CD1-CG 4.33Å; F198-L201 HydrophobicContact CD2-CB 4.42Å; F198-L201 HydrophobicContact CE1-CB 3.98Å; F198-L201 HydrophobicContact CE1-CD1 4.17Å; F198-L201 HydrophobicContact CE1-CD2 4.46Å; F198-L201 HydrophobicContact CE1-CG 4.43Å; F198-L201 HydrophobicContact CG-CB 3.98Å; F198-L201 HydrophobicContact CZ-CB 4.41Å; F198-L201 PolarHBondContact O-N 3.43Å; F198-I218 HydrophobicContact CE1-CD1 4.32Å; F198-I245 HydrophobicContact CE1-CG2 4.02Å; F198-I245 HydrophobicContact CZ-CG2 4.29Å; F198-A248 HydrophobicContact CE2-CB 4.1Å; F198-A248 HydrophobicContact CZ-CB 4.11Å
199P90.9Very high90.1Very high50 Ų5056.6 Ų56.633%0.32527%0.268SS..THydrogen-bonded Turntrans-68.5-28-173.122.8-30.8000114.1G195 L201G195-P199 WeakPolarHBondContact O-CA 3.47Å; G195-P199 VanDerWaalsContact O-CB 3.26Å; G195-P199 WeakPolarHBondContact O-CB 3.14Å; G195-P199 WeakPolarHBondContact O-CD 3.35Å; P199-L201 VanDerWaalsContact C-N 3.28Å; P199-L201 PolarHBondContact O-N 3.37Å
200E90.4Very high89.8Confident44 Ų4452.6 Ų52.621%0.20626%0.257CS..THydrogen-bonded Turntrans-68.8-27.6-178.3-60.780.3-174.200112.3F198 I202 K203 I204 A248 S252 M253F198-E200 VanDerWaalsContact C-N 3.33Å; F198-E200 HydrophobicContact CD2-CB 4.34Å; F198-E200 WeakPolarHBondContact CD2-OE2 3.36Å; F198-E200 HydrophobicContact CE2-CB 3.96Å; F198-E200 PolarHBondContact O-N 2.93Å; E200-I202 PolarHBondContact O-N 2.96Å; E200-K203 WeakPolarHBondContact O-CB 3.29Å; E200-K203 PolarHBondContact O-N 3.01Å; E200-I204 PolarHBondContact O-N 3.42Å; E200-A248 HydrophobicContact CB-CB 4.11Å; E200-S252 WeakPolarHBondContact OE2-CB 3.14Å; E200-S252 PolarHBondContact OE2-OG 3.01Å; E200-M253 PolarHBondContact OE1-N 2.91Å
201L89.4Confident89.7Confident0 Ų052.6 Ų52.60%026%0.257CS..Hα-helixtrans-59.5-34.3179.9-172.863.2000112.6Y194 F198 P199 K203 I204 V205 Y211 L214 I218 I245Y194-L201 HydrophobicContact CD1-CD2 4.04Å; Y194-L201 HydrophobicContact CE1-CD2 3.72Å; F198-L201 HydrophobicContact CD1-CB 3.75Å; F198-L201 HydrophobicContact CD1-CD2 4.05Å; F198-L201 HydrophobicContact CD1-CG 4.33Å; F198-L201 HydrophobicContact CD2-CB 4.42Å; F198-L201 HydrophobicContact CE1-CB 3.98Å; F198-L201 HydrophobicContact CE1-CD1 4.17Å; F198-L201 HydrophobicContact CE1-CD2 4.46Å; F198-L201 HydrophobicContact CE1-CG 4.43Å; F198-L201 HydrophobicContact CG-CB 3.98Å; F198-L201 HydrophobicContact CZ-CB 4.41Å; F198-L201 PolarHBondContact O-N 3.43Å; P199-L201 VanDerWaalsContact C-N 3.28Å; P199-L201 PolarHBondContact O-N 3.37Å; L201-K203 PolarHBondContact O-N 2.79Å; L201-I204 PolarHBondContact O-N 3.11Å; L201-V205 HydrophobicContact CD1-CG2 3.86Å; L201-V205 PolarHBondContact O-N 2.98Å; L201-Y211 HydrophobicContact CB-CE2 3.97Å; L201-Y211 HydrophobicContact CD2-CD2 4.16Å; L201-Y211 HydrophobicContact CD2-CE2 3.71Å; L201-Y211 HydrophobicContact CG-CD2 3.98Å; L201-Y211 HydrophobicContact CG-CE2 3.6Å; L201-L214 HydrophobicContact CD1-CD1 4.49Å; L201-I218 HydrophobicContact CD1-CD1 4.32Å; L201-I218 HydrophobicContact CD2-CD1 4.16Å; L201-I245 HydrophobicContact CD1-CD1 4.08Å; L201-I245 HydrophobicContact CD1-CG1 3.98Å; L201-I245 HydrophobicContact CD1-CG2 4.19Å
202I89.3Confident89.6Confident67 Ų6751.3 Ų51.334%0.34425%0.252SS..Hα-helixtrans-63.6-33178.4-61.5174000111.2R191 E200 Y211R191-I202 HydrophobicContact CB-CD1 4.49Å; E200-I202 PolarHBondContact O-N 2.96Å; I202-Y211 HydrophobicContact CB-CE2 4.41Å; I202-Y211 HydrophobicContact CG1-CE2 3.65Å
203K87.8Confident89.4Confident181 Ų18151.4 Ų51.479%0.78725%0.248SC*.Hα-helixtrans-77.8-34.5179.6-65.5-179.8-178.4173.10112E200 L201E200-K203 WeakPolarHBondContact O-CB 3.29Å; E200-K203 PolarHBondContact O-N 3.01Å; L201-K203 PolarHBondContact O-N 2.79Å
204I88.5Confident89.3Confident40 Ų4046.8 Ų46.821%0.20523%0.231CC..Hα-helixtrans-77.7-40.8-178.2-57.9167.5000110.6E200 L201 K241 I245 A248E200-I204 PolarHBondContact O-N 3.42Å; L201-I204 PolarHBondContact O-N 3.11Å; I204-K241 HydrophobicContact CG2-CB 4.41Å; I204-K241 HydrophobicContact CG2-CG 4.49Å; I204-I245 HydrophobicContact CB-CG1 4.46Å; I204-I245 HydrophobicContact CD1-CG1 4.15Å; I204-I245 HydrophobicContact CG2-CD1 4.43Å; I204-I245 HydrophobicContact CG2-CG1 3.87Å; I204-A248 HydrophobicContact CD1-CB 3.68Å
205V88.3Confident89.1Confident7 Ų747 Ų474%0.04223%0.232CC..  trans-111101.9-173-175.40000110.6R191 L201 M210 Y211 L214 I245R191-V205 PolarHBondContact NH2-O 2.99Å; L201-V205 HydrophobicContact CD1-CG2 3.86Å; L201-V205 PolarHBondContact O-N 2.98Å; V205-M210 HydrophobicContact CG1-CB 3.99Å; V205-Y211 HydrophobicContact CB-CD2 4.4Å; V205-L214 HydrophobicContact CB-CD1 4.31Å; V205-L214 HydrophobicContact CG1-CD1 4.01Å; V205-L214 HydrophobicContact CG2-CD1 3.52Å; V205-I245 HydrophobicContact CG2-CD1 4.07Å
206T86.7Confident88.9Confident118 Ų11850.1 Ų50.172%0.72424%0.244SC*.  trans-78.7-25-178.755.20000113.7R191R191-T206 PolarHBondContact NH2-O 2.85Å
207D88.6Confident88.7Confident63 Ų6346.1 Ų46.134%0.33723%0.233SC..  trans-84.5135.7-179.1-179.141.6000113.3R191 S209 M210 Y211R191-D207 PolarHBondContact NH2-O 2.79Å; D207-S209 PolarHBondContact OD2-N 2.95Å; D207-M210 HydrophobicContact CB-CB 4.13Å; D207-M210 HydrophobicContact CB-CE 3.28Å; D207-M210 HydrophobicContact CB-CG 4.25Å; D207-M210 HydrophobicContact CB-SD 4.4Å; D207-M210 WeakPolarHBondContact OD2-CE 3.4Å; D207-M210 WeakPolarHBondContact OD2-CG 3.26Å; D207-M210 PolarHBondContact OD2-N 2.95Å; D207-M210 VanDerWaalsContact OD2-N 3.09Å; D207-Y211 VanDerWaalsContact O-CB 3.3Å; D207-Y211 WeakPolarHBondContact O-CB 3.46Å; D207-Y211 PolarHBondContact O-N 3.16Å
208N87.9Confident88.6Confident25 Ų2546.5 Ų46.513%0.13424%0.236CC..Hα-helixtrans-70.6-41.5-173.7-82-9.9000111.7N184 R191 C212N184-N208 PolarHBondContact OD1-ND2 2.84Å; R191-N208 PolarHBondContact NE-OD1 2.83Å; R191-N208 PolarHBondContact NH1-OD1 3.16Å; R191-N208 VanDerWaalsContact NH2-N 3.2Å; R191-N208 PolarHBondContact NH2-OD1 2.82Å; R191-N208 VanDerWaalsContact NH2-OD1 3.15Å; N208-C212 PolarHBondContact O-N 2.79Å; N208-C212 PolarHBondContact O-SG 2.9Å; N208-C212 VanDerWaalsContact O-SG 3.42Å
209S85.9Confident88.4Confident30 Ų3047.3 Ų47.321%0.2124%0.244CC..Hα-helixtrans-72.1-45.2-178-169.50000110.9D207 Y211 C212 R213D207-S209 PolarHBondContact OD2-N 2.95Å; S209-Y211 VanDerWaalsContact C-N 3.33Å; S209-Y211 PolarHBondContact O-N 3.48Å; S209-C212 PolarHBondContact O-N 3.46Å; S209-R213 PolarHBondContact O-N 2.97Å
210M88.3Confident88.2Confident67 Ų6746.6 Ų46.633%0.3324%0.237SC..Hα-helixtrans-58.3-43.8173.1-71.7-173.4-99.500112V205 D207 C212 R213 L214V205-M210 HydrophobicContact CG1-CB 3.99Å; D207-M210 HydrophobicContact CB-CB 4.13Å; D207-M210 HydrophobicContact CB-CE 3.28Å; D207-M210 HydrophobicContact CB-CG 4.25Å; D207-M210 HydrophobicContact CB-SD 4.4Å; D207-M210 WeakPolarHBondContact OD2-CE 3.4Å; D207-M210 WeakPolarHBondContact OD2-CG 3.26Å; D207-M210 PolarHBondContact OD2-N 2.95Å; D207-M210 VanDerWaalsContact OD2-N 3.09Å; M210-C212 VanDerWaalsContact C-N 3.34Å; M210-C212 PolarHBondContact O-N 2.88Å; M210-R213 PolarHBondContact O-N 3.04Å; M210-R213 VanDerWaalsContact O-N 3.16Å; M210-L214 WeakPolarHBondContact O-CG 3.48Å; M210-L214 PolarHBondContact O-N 2.93Å
211Y91Very high87.9Confident0 Ų045.9 Ų45.90%023%0.233CC..Hα-helixtrans-57.5-44.3178.5-174.2-80.9000112.6V190 R191 Y194 L201 I202 V205 D207 S209 L214 A215V190-Y211 HydrophobicContact CG1-CD1 4.37Å; V190-Y211 HydrophobicContact CG1-CE1 4.25Å; R191-Y211 HydrophobicContact CB-CD1 4.46Å; R191-Y211 HydrophobicContact CB-CE1 4.11Å; R191-Y211 HydrophobicContact CG-CD1 3.43Å; R191-Y211 VanDerWaalsContact CG-CD1 3.43Å; R191-Y211 HydrophobicContact CG-CD2 4.04Å; R191-Y211 HydrophobicContact CG-CE1 3.51Å; R191-Y211 HydrophobicContact CG-CE2 4.08Å; R191-Y211 HydrophobicContact CG-CG 3.72Å; Y194-Y211 HydrophobicContact CD1-CE1 4.33Å; L201-Y211 HydrophobicContact CB-CE2 3.97Å; L201-Y211 HydrophobicContact CD2-CD2 4.16Å; L201-Y211 HydrophobicContact CD2-CE2 3.71Å; L201-Y211 HydrophobicContact CG-CD2 3.98Å; L201-Y211 HydrophobicContact CG-CE2 3.6Å; I202-Y211 HydrophobicContact CB-CE2 4.41Å; I202-Y211 HydrophobicContact CG1-CE2 3.65Å; V205-Y211 HydrophobicContact CB-CD2 4.4Å; D207-Y211 VanDerWaalsContact O-CB 3.3Å; D207-Y211 WeakPolarHBondContact O-CB 3.46Å; D207-Y211 PolarHBondContact O-N 3.16Å; S209-Y211 VanDerWaalsContact C-N 3.33Å; S209-Y211 PolarHBondContact O-N 3.48Å; Y211-L214 PolarHBondContact O-N 2.95Å; Y211-A215 WeakPolarHBondContact O-CB 3.21Å; Y211-A215 PolarHBondContact O-N 3.34Å
212C89.8Confident87.6Confident1 Ų152.3 Ų52.31%0.00726%0.261CS..Hα-helixtrans-63.9-40.8177.6-67.60000112N208 S209 M210 L214 A215 Q216 S269 V272 V273N208-C212 PolarHBondContact O-N 2.79Å; N208-C212 PolarHBondContact O-SG 2.9Å; N208-C212 VanDerWaalsContact O-SG 3.42Å; S209-C212 PolarHBondContact O-N 3.46Å; M210-C212 VanDerWaalsContact C-N 3.34Å; M210-C212 PolarHBondContact O-N 2.88Å; C212-L214 VanDerWaalsContact C-N 3.34Å; C212-L214 PolarHBondContact O-N 3.26Å; C212-A215 PolarHBondContact O-N 3.07Å; C212-Q216 PolarHBondContact O-N 3.31Å; C212-Q216 VanDerWaalsContact O-N 3.11Å; C212-S269 VanDerWaalsContact C-OG 3.25Å; C212-S269 VanDerWaalsContact CA-OG 3.3Å; C212-S269 WeakPolarHBondContact CA-OG 3.34Å; C212-S269 WeakPolarHBondContact CB-OG 3.48Å; C212-S269 PolarHBondContact O-OG 3.33Å; C212-V272 HydrophobicContact CB-CG1 4.43Å; C212-V273 HydrophobicContact CB-CG2 4.05Å
213R88.8Confident87.3Confident107 Ų10755.9 Ų55.940%0.40428%0.276SS..Hα-helixtrans-63.3-40.2175.5-67.6179.2-175.8-179.8-0.5112S209 M210 Q216 L217 V235 V273S209-R213 PolarHBondContact O-N 2.97Å; M210-R213 PolarHBondContact O-N 3.04Å; M210-R213 VanDerWaalsContact O-N 3.16Å; R213-Q216 WeakPolarHBondContact O-CB 3.28Å; R213-Q216 PolarHBondContact O-N 3.4Å; R213-L217 WeakPolarHBondContact O-CG 3.39Å; R213-L217 PolarHBondContact O-N 3.42Å; R213-V235 HydrophobicContact CB-CG1 3.9Å; R213-V273 HydrophobicContact CG-CG1 4.27Å; R213-V273 HydrophobicContact CG-CG2 3.82Å
214L88.4Confident87.1Confident0 Ų048.2 Ų48.20%024%0.244CC..Hα-helixtrans-69.6-40.3177.2-66.6168.6000112.3L201 V205 M210 Y211 C212 Q216 L217 I218 L232 V235 V236 I245L201-L214 HydrophobicContact CD1-CD1 4.49Å; V205-L214 HydrophobicContact CB-CD1 4.31Å; V205-L214 HydrophobicContact CG1-CD1 4.01Å; V205-L214 HydrophobicContact CG2-CD1 3.52Å; M210-L214 WeakPolarHBondContact O-CG 3.48Å; M210-L214 PolarHBondContact O-N 2.93Å; Y211-L214 PolarHBondContact O-N 2.95Å; C212-L214 VanDerWaalsContact C-N 3.34Å; C212-L214 PolarHBondContact O-N 3.26Å; L214-Q216 PolarHBondContact O-N 3Å; L214-L217 PolarHBondContact O-N 2.77Å; L214-I218 HydrophobicContact CB-CD1 4.14Å; L214-I218 VanDerWaalsContact O-CB 3.29Å; L214-I218 WeakPolarHBondContact O-CB 3.47Å; L214-I218 WeakPolarHBondContact O-CG1 3.37Å; L214-I218 PolarHBondContact O-N 3.49Å; L214-L232 HydrophobicContact CD2-CD2 3.57Å; L214-V235 HydrophobicContact CD2-CB 4.09Å; L214-V235 HydrophobicContact CD2-CG1 3.81Å; L214-V235 HydrophobicContact CG-CG1 3.99Å; L214-V236 HydrophobicContact CD1-CG2 3.82Å; L214-V236 HydrophobicContact CD2-CG2 3.75Å; L214-V236 HydrophobicContact CG-CG2 4.34Å; L214-I245 HydrophobicContact CD1-CD1 4.18Å
215A88.2Confident86.8Confident4 Ų448.5 Ų48.53%0.03325%0.249CC..Hα-helixtrans-61.1-32.5175.100000112V190 Y194 Y211 C212 G219V190-A215 HydrophobicContact CG1-CB 4.43Å; Y194-A215 HydrophobicContact CD1-CB 4.03Å; Y194-A215 HydrophobicContact CD2-CB 4.46Å; Y194-A215 HydrophobicContact CE1-CB 4.26Å; Y194-A215 HydrophobicContact CG-CB 4.13Å; Y211-A215 WeakPolarHBondContact O-CB 3.21Å; Y211-A215 PolarHBondContact O-N 3.34Å; C212-A215 PolarHBondContact O-N 3.07Å; A215-G219 PolarHBondContact O-N 2.83Å
216Q86.3Confident86.3Confident76 Ų7654.3 Ų54.336%0.35528%0.276SS..Hα-helixtrans-69.9-45.7172.7177.3-174.73.600112C212 R213 L214 N270C212-Q216 PolarHBondContact O-N 3.31Å; C212-Q216 VanDerWaalsContact O-N 3.11Å; R213-Q216 WeakPolarHBondContact O-CB 3.28Å; R213-Q216 PolarHBondContact O-N 3.4Å; L214-Q216 PolarHBondContact O-N 3Å; Q216-N270 WeakPolarHBondContact CG-OD1 3.49Å; Q216-N270 PolarHBondContact NE2-OD1 3.35Å; Q216-N270 PolarHBondContact OE1-OD1 3.39Å
217L86.3Confident85.9Confident88 Ų8856.9 Ų56.946%0.46128%0.279SS..Hα-helixtrans-72.7-39.4-177.2-74.6171.6000113.6R213 L214 V235R213-L217 WeakPolarHBondContact O-CG 3.39Å; R213-L217 PolarHBondContact O-N 3.42Å; L214-L217 PolarHBondContact O-N 2.77Å; L217-V235 HydrophobicContact CD1-CB 4.29Å; L217-V235 HydrophobicContact CD1-CG2 3.38Å
218I87.9Confident85.3Confident9 Ų955.6 Ų55.65%0.04628%0.275CS..Hα-helixtrans-74-40.8-177.1-65.1168.1000110.5Y194 F198 L201 L214 N220 L224 L232 I245Y194-I218 VanDerWaalsContact OH-CG2 3.24Å; Y194-I218 WeakPolarHBondContact OH-CG2 3.32Å; F198-I218 HydrophobicContact CE1-CD1 4.32Å; L201-I218 HydrophobicContact CD1-CD1 4.32Å; L201-I218 HydrophobicContact CD2-CD1 4.16Å; L214-I218 HydrophobicContact CB-CD1 4.14Å; L214-I218 VanDerWaalsContact O-CB 3.29Å; L214-I218 WeakPolarHBondContact O-CB 3.47Å; L214-I218 WeakPolarHBondContact O-CG1 3.37Å; L214-I218 PolarHBondContact O-N 3.49Å; I218-N220 PolarHBondContact O-N 3.28Å; I218-L224 HydrophobicContact CB-CD1 4.15Å; I218-L224 HydrophobicContact CG1-CD1 3.86Å; I218-L224 HydrophobicContact CG2-CD1 3.82Å; I218-L232 HydrophobicContact CD1-CD2 4.18Å; I218-L232 HydrophobicContact CG1-CD2 3.9Å; I218-I245 HydrophobicContact CD1-CG2 3.98Å
219G86.8Confident85Confident17 Ų1755.7 Ų55.718%0.17528%0.276CS..  trans54.9-113-173.300000111.1Y194 A215Y194-G219 WeakPolarHBondContact CE2-O 3.31Å; Y194-G219 PolarHBondContact OH-O 3.06Å; A215-G219 PolarHBondContact O-N 2.83Å
220N87.2Confident84.8Confident35 Ų3562.1 Ų62.119%0.18730%0.303CS..SBendtrans-84124.8177.1-173-1.8000111I218 K222 E223 L262I218-N220 PolarHBondContact O-N 3.28Å; N220-K222 PolarHBondContact O-N 2.84Å; N220-K222 PolarHBondContact OD1-N 2.97Å; N220-E223 HydrophobicContact CB-CG 4.32Å; N220-E223 PolarHBondContact ND2-OE1 3.32Å; N220-E223 PolarHBondContact O-N 3.2Å; N220-L262 HydrophobicContact CB-CD2 3.9Å
221R84.2Confident84.5Confident29 Ų2961 Ų6111%0.10930%0.301CS..G310 helixtrans-55.7-27.7-178.173.4-171.7174.3169.2-5114.5H197 E223 L224 S252 G254 D256H197-R221 WeakPolarHBondContact NE2-CG 3.33Å; H197-R221 PolarHBondContact NE2-N 2.82Å; H197-R221 PolarHBondContact O-NH1 3.35Å; R221-E223 VanDerWaalsContact C-N 3.3Å; R221-L224 WeakPolarHBondContact O-CB 3.18Å; R221-S252 PolarHBondContact NH1-OG 3.36Å; R221-G254 PolarHBondContact NH1-O 3.15Å; R221-G254 PolarHBondContact NH2-O 2.94Å; R221-D256 IonicContact CZ-OD1 2.7Å; R221-D256 IonicContact NE-OD1 2.91Å; R221-D256 IonicContact NH2-OD1 3.2Å; R221-D256 PolarHBondContact NH2-OD1 2.91Å
222K84Confident84.1Confident135 Ų13561.1 Ų61.159%0.58730%0.302SS*.G310 helixtrans-75.6-20.7-177.4-66.2-174.9-177.9175.80113.1N220 L224 D256N220-K222 PolarHBondContact O-N 2.84Å; N220-K222 PolarHBondContact OD1-N 2.97Å; K222-L224 VanDerWaalsContact C-N 3.29Å; K222-D256 WeakPolarHBondContact CE-OD1 3.21Å; K222-D256 IonicContact NZ-OD1 2.82Å; K222-D256 PolarHBondContact NZ-OD1 3.28Å; K222-D256 IonicContact NZ-OD2 3.6Å; K222-D256 PolarHBondContact NZ-OD2 3.02Å
223E83.5Confident83.9Confident141 Ų14164.8 Ų64.866%0.65932%0.319SS*.G310 helixtrans-90.30.6-178.9-69.2161.4-146.200111.6N220 R221 S225N220-E223 HydrophobicContact CB-CG 4.32Å; N220-E223 PolarHBondContact ND2-OE1 3.32Å; N220-E223 PolarHBondContact O-N 3.2Å; R221-E223 VanDerWaalsContact C-N 3.3Å; E223-S225 PolarHBondContact O-N 2.93Å
224L82Confident83.7Confident21 Ų2167.3 Ų67.311%0.1134%0.335CS..  trans-75.4113.7179.4-155.188.9000111.2I218 R221 K222 L232 L246 S249I218-L224 HydrophobicContact CB-CD1 4.15Å; I218-L224 HydrophobicContact CG1-CD1 3.86Å; I218-L224 HydrophobicContact CG2-CD1 3.82Å; R221-L224 WeakPolarHBondContact O-CB 3.18Å; K222-L224 VanDerWaalsContact C-N 3.29Å; L224-L232 HydrophobicContact CD1-CD1 4.24Å; L224-L232 HydrophobicContact CD2-CD1 4.3Å; L224-L246 HydrophobicContact CD2-CB 4.26Å; L224-L246 HydrophobicContact CD2-CD1 4.11Å; L224-L246 HydrophobicContact CD2-CG 4.34Å; L224-S249 WeakPolarHBondContact CD2-OG 3.39Å
225S81.9Confident83.5Confident46 Ų4668.7 Ų68.732%0.32234%0.343SS..  trans-113.1172.9176.572.20000111.9E223 E227 S228 L246E223-S225 PolarHBondContact O-N 2.93Å; S225-E227 PolarHBondContact O-N 3.35Å; S225-E227 PolarHBondContact OG-N 3.44Å; S225-S228 PolarHBondContact O-N 2.86Å; S225-S228 VanDerWaalsContact O-N 3.17Å; S225-L246 WeakPolarHBondContact O-CD1 3.35Å
226E78.8Confident83.1Confident128 Ų12869 Ų6960%0.59835%0.345SS*.G310 helixtrans-65.6-18.6175.6-71.4173.3-167.400112.6S228 L229 L246 R250E226-S228 VanDerWaalsContact C-N 3.32Å; E226-L229 WeakPolarHBondContact O-CB 3.41Å; E226-L229 PolarHBondContact O-N 2.94Å; E226-L246 HydrophobicContact CG-CD1 4.47Å; E226-L246 HydrophobicContact CG-CD2 4.3Å; E226-R250 IonicContact OE1-CZ 3.74Å; E226-R250 IonicContact OE1-NH1 3.68Å; E226-R250 IonicContact OE1-NH2 2.79Å; E226-R250 PolarHBondContact OE1-NH2 2.81Å
227E78.1Confident82.9Confident172 Ų17273.6 Ų73.680%0.80437%0.369SS*.G310 helixtrans-70.3-30.3174.2-59.4176.4168.300111.7S225 L229S225-E227 PolarHBondContact O-N 3.35Å; S225-E227 PolarHBondContact OG-N 3.44Å; E227-L229 PolarHBondContact O-N 3.35Å
228S76.2Confident82.9Confident36 Ų3672.1 Ų72.125%0.25236%0.361SS..G310 helixtrans-73.2-9.8176.2-53.60000112.7S225 E226 E230 S231 L232S225-S228 PolarHBondContact O-N 2.86Å; S225-S228 VanDerWaalsContact O-N 3.17Å; E226-S228 VanDerWaalsContact C-N 3.32Å; S228-E230 VanDerWaalsContact C-N 3.35Å; S228-E230 PolarHBondContact O-N 3.41Å; S228-S231 PolarHBondContact O-N 3.19Å; S228-S231 PolarHBondContact O-OG 3.48Å; S228-L232 WeakPolarHBondContact O-CG 3.12Å; S228-L232 PolarHBondContact O-N 3.5Å
229L80.8Confident82.8Confident28 Ų2874.4 Ų74.415%0.14738%0.378CS..Hα-helixtrans-65.3-37.4-174.2-155148.7000112.2E226 E227 L232 E233 Q243 L246E226-L229 WeakPolarHBondContact O-CB 3.41Å; E226-L229 PolarHBondContact O-N 2.94Å; E227-L229 PolarHBondContact O-N 3.35Å; L229-L232 PolarHBondContact O-N 3.17Å; L229-E233 WeakPolarHBondContact O-CB 3.42Å; L229-E233 PolarHBondContact O-N 3.2Å; L229-Q243 VanDerWaalsContact CD1-OE1 3.32Å; L229-L246 HydrophobicContact CD1-CD1 4.33Å
230E81.6Confident82.8Confident165 Ų16577 Ų7777%0.77140%0.398SS*.Hα-helixtrans-61.3-46.1175.3-65.5-176.1174.200111.5S228 L232 E233 E234S228-E230 VanDerWaalsContact C-N 3.35Å; S228-E230 PolarHBondContact O-N 3.41Å; E230-L232 PolarHBondContact O-N 3.3Å; E230-E233 PolarHBondContact O-N 2.8Å; E230-E234 PolarHBondContact O-N 3.14Å
231S82.6Confident82.8Confident43 Ų4379.4 Ų79.430%0.30141%0.407SS..Hα-helixtrans-68.9-32.3178.467.20000113.5S228 V235S228-S231 PolarHBondContact O-N 3.19Å; S228-S231 PolarHBondContact O-OG 3.48Å; S231-V235 PolarHBondContact O-N 3.44Å
232L82.7Confident82.9Confident2 Ų278 Ų781%0.0140%0.401CS..Hα-helixtrans-68.6-40.6172.6-71.2172.7000111.2L214 I218 L224 S228 L229 E230 E234 V235 V236 A242 I245L214-L232 HydrophobicContact CD2-CD2 3.57Å; I218-L232 HydrophobicContact CD1-CD2 4.18Å; I218-L232 HydrophobicContact CG1-CD2 3.9Å; L224-L232 HydrophobicContact CD1-CD1 4.24Å; L224-L232 HydrophobicContact CD2-CD1 4.3Å; S228-L232 WeakPolarHBondContact O-CG 3.12Å; S228-L232 PolarHBondContact O-N 3.5Å; L229-L232 PolarHBondContact O-N 3.17Å; E230-L232 PolarHBondContact O-N 3.3Å; L232-E234 VanDerWaalsContact C-N 3.33Å; L232-E234 PolarHBondContact O-N 2.89Å; L232-V235 PolarHBondContact O-N 2.89Å; L232-V236 WeakPolarHBondContact O-CB 3.4Å; L232-V236 VanDerWaalsContact O-CG2 3.29Å; L232-V236 WeakPolarHBondContact O-CG2 3.26Å; L232-V236 PolarHBondContact O-N 3.4Å; L232-A242 HydrophobicContact CB-CB 4.02Å; L232-I245 HydrophobicContact CD1-CG2 4.4Å
233E85.7Confident83.1Confident78 Ų7875.2 Ų75.236%0.36439%0.39SS..Hα-helixtrans-63.9-39.1177-173.3166.2168.400111.6L229 E230 V235 M237 S239 A242L229-E233 WeakPolarHBondContact O-CB 3.42Å; L229-E233 PolarHBondContact O-N 3.2Å; E230-E233 PolarHBondContact O-N 2.8Å; E233-V235 VanDerWaalsContact C-N 3.32Å; E233-V235 PolarHBondContact O-N 3.44Å; E233-M237 VanDerWaalsContact O-CA 3.27Å; E233-M237 WeakPolarHBondContact O-CA 3.39Å; E233-M237 PolarHBondContact O-N 3.18Å; E233-S239 WeakPolarHBondContact OE1-CB 3.32Å; E233-S239 WeakPolarHBondContact OE2-CB 3.32Å; E233-S239 PolarHBondContact OE2-OG 3.01Å; E233-A242 HydrophobicContact CB-CB 4.26Å
234E85.1Confident83.3Confident161 Ų16170.3 Ų70.375%0.75237%0.374SS*.Hα-helixtrans-59.4-41.4175.6-170.1179.9-176.600112.3E230 L232E230-E234 PolarHBondContact O-N 3.14Å; L232-E234 VanDerWaalsContact C-N 3.33Å; L232-E234 PolarHBondContact O-N 2.89Å
235V82.9Confident83.6Confident28 Ų2869.3 Ų69.317%0.1737%0.369CS..Hα-helixtrans-79.6-39.8-178.3174.40000113R213 L214 L217 S231 L232 E233R213-V235 HydrophobicContact CB-CG1 3.9Å; L214-V235 HydrophobicContact CD2-CB 4.09Å; L214-V235 HydrophobicContact CD2-CG1 3.81Å; L214-V235 HydrophobicContact CG-CG1 3.99Å; L217-V235 HydrophobicContact CD1-CB 4.29Å; L217-V235 HydrophobicContact CD1-CG2 3.38Å; S231-V235 PolarHBondContact O-N 3.44Å; L232-V235 PolarHBondContact O-N 2.89Å; E233-V235 VanDerWaalsContact C-N 3.32Å; E233-V235 PolarHBondContact O-N 3.44Å
236V81.2Confident83.9Confident12 Ų1267.1 Ų67.17%0.07335%0.354CS..Hα-helixtrans-84.8-18.5-176.4-170.60000111.9L214 L232 D238 K241 I245L214-V236 HydrophobicContact CD1-CG2 3.82Å; L214-V236 HydrophobicContact CD2-CG2 3.75Å; L214-V236 HydrophobicContact CG-CG2 4.34Å; L232-V236 WeakPolarHBondContact O-CB 3.4Å; L232-V236 VanDerWaalsContact O-CG2 3.29Å; L232-V236 WeakPolarHBondContact O-CG2 3.26Å; L232-V236 PolarHBondContact O-N 3.4Å; V236-D238 HydrophobicContact CG1-CB 4.2Å; V236-D238 PolarHBondContact O-N 3.4Å; V236-D238 VanDerWaalsContact O-N 3.14Å; V236-K241 HydrophobicContact CG1-CB 3.52Å; V236-K241 HydrophobicContact CG1-CD 3.65Å; V236-K241 HydrophobicContact CG1-CG 4.26Å; V236-I245 HydrophobicContact CG2-CD1 4.05Å
237M82.3Confident84.4Confident172 Ų17264.7 Ų64.785%0.84735%0.345SS*.SBendtrans55.122.9-175.7-52.8-178.970.400113.2E233E233-M237 VanDerWaalsContact O-CA 3.27Å; E233-M237 WeakPolarHBondContact O-CA 3.39Å; E233-M237 PolarHBondContact O-N 3.18Å
238D86.4Confident84.9Confident57 Ų5757.1 Ų57.131%0.30531%0.311SS..  trans-151106.1-174.7-176.1-10.3000109.6V236 A240 K241 A242V236-D238 HydrophobicContact CG1-CB 4.2Å; V236-D238 PolarHBondContact O-N 3.4Å; V236-D238 VanDerWaalsContact O-N 3.14Å; D238-A240 PolarHBondContact O-N 3.39Å; D238-A240 WeakPolarHBondContact OD1-CB 3.36Å; D238-A240 PolarHBondContact OD1-N 3.44Å; D238-A240 VanDerWaalsContact OD1-N 3.08Å; D238-K241 HydrophobicContact CB-CB 4.23Å; D238-K241 HydrophobicContact CB-CD 4.11Å; D238-K241 HydrophobicContact CB-CG 4.29Å; D238-K241 PolarHBondContact O-N 2.92Å; D238-K241 WeakPolarHBondContact OD2-CD 3.44Å; D238-K241 VanDerWaalsContact OD2-CE 3.23Å; D238-K241 WeakPolarHBondContact OD2-CE 3.42Å; D238-K241 WeakPolarHBondContact OD2-CG 3.07Å; D238-K241 IonicContact OD2-NZ 3.75Å; D238-A242 PolarHBondContact O-N 3.04Å
239S84.7Confident85.5Confident57 Ų5756 Ų5640%0.39930%0.304SS..Hα-helixtrans-59.7-34.4-178.8-160.80000112.3E233 K241 A242 Q243E233-S239 WeakPolarHBondContact OE1-CB 3.32Å; E233-S239 WeakPolarHBondContact OE2-CB 3.32Å; E233-S239 PolarHBondContact OE2-OG 3.01Å; S239-K241 PolarHBondContact O-N 2.69Å; S239-A242 PolarHBondContact O-N 3.15Å; S239-Q243 PolarHBondContact O-N 3Å
240A87.8Confident85.8Confident71 Ų7162.2 Ų62.259%0.58733%0.325SS*.Hα-helixtrans-68.1-36179.500000111.9D238 A244D238-A240 PolarHBondContact O-N 3.39Å; D238-A240 WeakPolarHBondContact OD1-CB 3.36Å; D238-A240 PolarHBondContact OD1-N 3.44Å; D238-A240 VanDerWaalsContact OD1-N 3.08Å; A240-A244 WeakPolarHBondContact O-CB 3.39Å; A240-A244 PolarHBondContact O-N 3.46Å
241K85.9Confident86.1Confident86 Ų8658.1 Ų58.137%0.37432%0.315SS..Hα-helixtrans-74.5-37.4174.9-72.7177.5-170159.60112.2I204 V236 D238 S239 Q243 A244 I245I204-K241 HydrophobicContact CG2-CB 4.41Å; I204-K241 HydrophobicContact CG2-CG 4.49Å; V236-K241 HydrophobicContact CG1-CB 3.52Å; V236-K241 HydrophobicContact CG1-CD 3.65Å; V236-K241 HydrophobicContact CG1-CG 4.26Å; D238-K241 HydrophobicContact CB-CB 4.23Å; D238-K241 HydrophobicContact CB-CD 4.11Å; D238-K241 HydrophobicContact CB-CG 4.29Å; D238-K241 PolarHBondContact O-N 2.92Å; D238-K241 WeakPolarHBondContact OD2-CD 3.44Å; D238-K241 VanDerWaalsContact OD2-CE 3.23Å; D238-K241 WeakPolarHBondContact OD2-CE 3.42Å; D238-K241 WeakPolarHBondContact OD2-CG 3.07Å; D238-K241 IonicContact OD2-NZ 3.75Å; S239-K241 PolarHBondContact O-N 2.69Å; K241-Q243 VanDerWaalsContact C-N 3.34Å; K241-A244 PolarHBondContact O-N 3.4Å; K241-I245 VanDerWaalsContact O-CG1 3.23Å; K241-I245 WeakPolarHBondContact O-CG1 3.46Å; K241-I245 PolarHBondContact O-N 3.27Å
242A87.2Confident86.4Confident0 Ų056.9 Ų56.90%031%0.306CS..Hα-helixtrans-59.7-46.617500000110.9L232 E233 D238 S239 A244 I245 L246L232-A242 HydrophobicContact CB-CB 4.02Å; E233-A242 HydrophobicContact CB-CB 4.26Å; D238-A242 PolarHBondContact O-N 3.04Å; S239-A242 PolarHBondContact O-N 3.15Å; A242-A244 PolarHBondContact O-N 3.34Å; A242-I245 PolarHBondContact O-N 2.87Å; A242-L246 PolarHBondContact O-N 3.18Å; A242-L246 VanDerWaalsContact O-N 3.14Å
243Q87Confident86.6Confident75 Ų7565 Ų6535%0.3535%0.346SS..Hα-helixtrans-61.3-44.7173.8-170.366.442.600111.8L229 S239 K241 I245 L246 D247L229-Q243 VanDerWaalsContact CD1-OE1 3.32Å; S239-Q243 PolarHBondContact O-N 3Å; K241-Q243 VanDerWaalsContact C-N 3.34Å; Q243-I245 VanDerWaalsContact C-N 3.27Å; Q243-I245 PolarHBondContact O-N 2.85Å; Q243-L246 PolarHBondContact O-N 2.7Å; Q243-L246 VanDerWaalsContact O-N 3.11Å; Q243-D247 PolarHBondContact NE2-OD1 3.08Å; Q243-D247 PolarHBondContact O-N 3.24Å
244A88.1Confident86.6Confident39 Ų3962 Ų6232%0.32234%0.335SS..Hα-helixtrans-61.8-33177.800000113.1A240 K241 A242 A248A240-A244 WeakPolarHBondContact O-CB 3.39Å; A240-A244 PolarHBondContact O-N 3.46Å; K241-A244 PolarHBondContact O-N 3.4Å; A242-A244 PolarHBondContact O-N 3.34Å; A244-A248 WeakPolarHBondContact O-CB 3.48Å; A244-A248 PolarHBondContact O-N 2.97Å
245I89.3Confident86.8Confident0 Ų060.3 Ų60.30%033%0.329CS..Hα-helixtrans-67.3-42.6174.2-69.1164.2000110.5F198 L201 I204 V205 L214 I218 L232 V236 K241 A242 Q243 A248 S249F198-I245 HydrophobicContact CE1-CG2 4.02Å; F198-I245 HydrophobicContact CZ-CG2 4.29Å; L201-I245 HydrophobicContact CD1-CD1 4.08Å; L201-I245 HydrophobicContact CD1-CG1 3.98Å; L201-I245 HydrophobicContact CD1-CG2 4.19Å; I204-I245 HydrophobicContact CB-CG1 4.46Å; I204-I245 HydrophobicContact CD1-CG1 4.15Å; I204-I245 HydrophobicContact CG2-CD1 4.43Å; I204-I245 HydrophobicContact CG2-CG1 3.87Å; V205-I245 HydrophobicContact CG2-CD1 4.07Å; L214-I245 HydrophobicContact CD1-CD1 4.18Å; I218-I245 HydrophobicContact CD1-CG2 3.98Å; L232-I245 HydrophobicContact CD1-CG2 4.4Å; V236-I245 HydrophobicContact CG2-CD1 4.05Å; K241-I245 VanDerWaalsContact O-CG1 3.23Å; K241-I245 WeakPolarHBondContact O-CG1 3.46Å; K241-I245 PolarHBondContact O-N 3.27Å; A242-I245 PolarHBondContact O-N 2.87Å; Q243-I245 VanDerWaalsContact C-N 3.27Å; Q243-I245 PolarHBondContact O-N 2.85Å; I245-A248 PolarHBondContact O-N 2.93Å; I245-S249 PolarHBondContact O-N 3.48Å
246L88.4Confident87Confident0 Ų063.1 Ų63.10%034%0.344CS..Hα-helixtrans-67.6-42.1178.6-173.5120.6000112.1L224 S225 E226 L229 A242 Q243 A248 S249 R250L224-L246 HydrophobicContact CD2-CB 4.26Å; L224-L246 HydrophobicContact CD2-CD1 4.11Å; L224-L246 HydrophobicContact CD2-CG 4.34Å; S225-L246 WeakPolarHBondContact O-CD1 3.35Å; E226-L246 HydrophobicContact CG-CD1 4.47Å; E226-L246 HydrophobicContact CG-CD2 4.3Å; L229-L246 HydrophobicContact CD1-CD1 4.33Å; A242-L246 PolarHBondContact O-N 3.18Å; A242-L246 VanDerWaalsContact O-N 3.14Å; Q243-L246 PolarHBondContact O-N 2.7Å; Q243-L246 VanDerWaalsContact O-N 3.11Å; L246-A248 VanDerWaalsContact C-N 3.33Å; L246-S249 PolarHBondContact O-N 3.48Å; L246-S249 PolarHBondContact O-OG 2.95Å; L246-R250 PolarHBondContact O-N 2.85Å
247D89.1Confident87.3Confident77 Ų7764.4 Ų64.441%0.41235%0.35SS..Hα-helixtrans-65.8-40.9174.8-65.4-21.4000110.6Q243 S249 R250 S251Q243-D247 PolarHBondContact NE2-OD1 3.08Å; Q243-D247 PolarHBondContact O-N 3.24Å; D247-S249 VanDerWaalsContact C-N 3.34Å; D247-S249 PolarHBondContact O-N 3Å; D247-R250 PolarHBondContact O-N 3.11Å; D247-S251 PolarHBondContact O-N 3.35Å; D247-S251 VanDerWaalsContact O-N 3.09Å; D247-S251 PolarHBondContact O-OG 3.4Å
248A89Confident87.7Confident12 Ų1258.7 Ų58.710%0.09933%0.326CS..Hα-helixtrans-66.7-31.8176.900000113.1F198 E200 I204 A244 I245 L246 S251 S252F198-A248 HydrophobicContact CE2-CB 4.1Å; F198-A248 HydrophobicContact CZ-CB 4.11Å; E200-A248 HydrophobicContact CB-CB 4.11Å; I204-A248 HydrophobicContact CD1-CB 3.68Å; A244-A248 WeakPolarHBondContact O-CB 3.48Å; A244-A248 PolarHBondContact O-N 2.97Å; I245-A248 PolarHBondContact O-N 2.93Å; L246-A248 VanDerWaalsContact C-N 3.33Å; A248-S251 CarbonylContact O-C 3.54Å; A248-S251 PolarHBondContact O-N 3.49Å; A248-S252 WeakPolarHBondContact O-CA 3.33Å; A248-S252 VanDerWaalsContact O-CB 3.24Å; A248-S252 WeakPolarHBondContact O-CB 3.16Å; A248-S252 PolarHBondContact O-N 3.48Å
249S88.5Confident87.8Confident14 Ų1460.5 Ų60.510%0.09834%0.341CS..Hα-helixtrans-67.9-40.3176.376.80000111.1L224 I245 L246 D247 S251 S252L224-S249 WeakPolarHBondContact CD2-OG 3.39Å; I245-S249 PolarHBondContact O-N 3.48Å; L246-S249 PolarHBondContact O-N 3.48Å; L246-S249 PolarHBondContact O-OG 2.95Å; D247-S249 VanDerWaalsContact C-N 3.34Å; D247-S249 PolarHBondContact O-N 3Å; S249-S251 VanDerWaalsContact C-N 3.34Å; S249-S251 PolarHBondContact O-N 3.08Å; S249-S252 PolarHBondContact O-N 2.81Å
250R87.4Confident88.2Confident157 Ų15763.3 Ų63.359%0.59235%0.35SS*.Hα-helixtrans-64.9-36175.1-68.4175.6177.1177.4-0.5112.3E226 L246 D247E226-R250 IonicContact OE1-CZ 3.74Å; E226-R250 IonicContact OE1-NH1 3.68Å; E226-R250 IonicContact OE1-NH2 2.79Å; E226-R250 PolarHBondContact OE1-NH2 2.81Å; L246-R250 PolarHBondContact O-N 2.85Å; D247-R250 PolarHBondContact O-N 3.11Å
251S87.9Confident88.3Confident79 Ų7963.2 Ų63.255%0.55234%0.34SS*.THydrogen-bonded Turntrans-96.16.5178.768.60000114.7D247 A248 S249D247-S251 PolarHBondContact O-N 3.35Å; D247-S251 VanDerWaalsContact O-N 3.09Å; D247-S251 PolarHBondContact O-OG 3.4Å; A248-S251 CarbonylContact O-C 3.54Å; A248-S251 PolarHBondContact O-N 3.49Å; S249-S251 VanDerWaalsContact C-N 3.34Å; S249-S251 PolarHBondContact O-N 3.08Å
252S88.6Confident88.5Confident18 Ų1860.5 Ų60.513%0.12633%0.33CS..  trans-69.7133.1-170.2-177.90000112E200 R221 A248 S249 G254E200-S252 WeakPolarHBondContact OE2-CB 3.14Å; E200-S252 PolarHBondContact OE2-OG 3.01Å; R221-S252 PolarHBondContact NH1-OG 3.36Å; A248-S252 WeakPolarHBondContact O-CA 3.33Å; A248-S252 VanDerWaalsContact O-CB 3.24Å; A248-S252 WeakPolarHBondContact O-CB 3.16Å; A248-S252 PolarHBondContact O-N 3.48Å; S249-S252 PolarHBondContact O-N 2.81Å; S252-G254 PolarHBondContact OG-N 3.46Å
253M85.5Confident88.7Confident173 Ų17364.3 Ų64.385%0.85235%0.349SS*.  trans-95.39.1175.3-65.4-71.218000113E200E200-M253 PolarHBondContact OE1-N 2.91Å
254G87.1Confident88.9Confident13 Ų1363.9 Ų63.913%0.13435%0.349CS..PPolyproline II helixtrans-61.5169.1179.100000114H197 R221 S252H197-G254 WeakPolarHBondContact O-CA 3.2Å; R221-G254 PolarHBondContact NH1-O 3.15Å; R221-G254 PolarHBondContact NH2-O 2.94Å; S252-G254 PolarHBondContact OG-N 3.46Å
255M87.7Confident89.1Confident126 Ų12662.1 Ų62.162%0.62134%0.335SS*.PPolyproline II helixtrans-85.3147.7-179.7-168.8175.570.600111.3Y196 H197Y196-M255 PolarHBondContact O-N 3.18Å; H197-M255 WeakPolarHBondContact CA-O 3.39Å; H197-M255 PolarHBondContact ND1-O 3.08Å
256D87.4Confident89.1Confident88 Ų8865.9 Ų65.947%0.47135%0.352SS..PPolyproline II helixtrans-71.6130.9169.9-70.8-21.6000110.2R221 K222R221-D256 IonicContact CZ-OD1 2.7Å; R221-D256 IonicContact NE-OD1 2.91Å; R221-D256 IonicContact NH2-OD1 3.2Å; R221-D256 PolarHBondContact NH2-OD1 2.91Å; K222-D256 WeakPolarHBondContact CE-OD1 3.21Å; K222-D256 IonicContact NZ-OD1 2.82Å; K222-D256 PolarHBondContact NZ-OD1 3.28Å; K222-D256 IonicContact NZ-OD2 3.6Å; K222-D256 PolarHBondContact NZ-OD2 3.02Å
257I88.1Confident89.4Confident39 Ų3974.2 Ų74.220%0.238%0.383CS..PPolyproline II helixtrans-102.9147.1-176.1-165.6163.6000110.9H197 D261 L262 I265H197-I257 HydrophobicContact CB-CB 4.35Å; H197-I257 HydrophobicContact CB-CG2 4.36Å; I257-D261 HydrophobicContact CD1-CB 3.92Å; I257-D261 HydrophobicContact CG1-CB 3.75Å; I257-L262 HydrophobicContact CG2-CB 4.2Å; I257-L262 HydrophobicContact CG2-CD1 3.94Å; I257-I265 HydrophobicContact CD1-CD1 3.4Å
258S91.6Very high89.5Confident51 Ų5173 Ų7336%0.35738%0.375SS..PPolyproline II helixtrans-66142.6173.1177.80000110.7I260 D261 L262S258-I260 PolarHBondContact O-N 3.43Å; S258-D261 PolarHBondContact O-N 3Å; S258-D261 VanDerWaalsContact O-N 3.07Å; S258-L262 PolarHBondContact O-N 3.38Å
259P88.3Confident89.7Confident96 Ų9672.5 Ų72.562%0.62337%0.37SS*.Hα-helixtrans-55.6-33.6175.3-26.334.6000113.5L262 I263P259-L262 PolarHBondContact O-N 3.11Å; P259-I263 WeakPolarHBondContact O-CD1 3.27Å; P259-I263 VanDerWaalsContact O-CG1 3.24Å; P259-I263 WeakPolarHBondContact O-CG1 3.45Å; P259-I263 PolarHBondContact O-N 3.06Å
260I91.4Very high89.9Confident115 Ų11574.3 Ų74.359%0.5938%0.379SS*.Hα-helixtrans-65.8-42.4178.4-63.4166.1000110.7S258 I263 N264S258-I260 PolarHBondContact O-N 3.43Å; I260-I263 PolarHBondContact O-N 3.34Å; I260-N264 PolarHBondContact O-N 3.44Å; I260-N264 PolarHBondContact O-ND2 3.48Å; I260-N264 VanDerWaalsContact O-ND2 3.14Å
261D90.6Very high90.2Very high70 Ų7075.1 Ų75.137%0.37438%0.382SS..Hα-helixtrans-70.9-37.1179-66.1-38.4000111I257 S258 N264 I265I257-D261 HydrophobicContact CD1-CB 3.92Å; I257-D261 HydrophobicContact CG1-CB 3.75Å; S258-D261 PolarHBondContact O-N 3Å; S258-D261 VanDerWaalsContact O-N 3.07Å; D261-N264 PolarHBondContact O-N 3.27Å; D261-I265 WeakPolarHBondContact O-CG1 3.49Å; D261-I265 PolarHBondContact O-N 3.23Å
262L89.8Confident90.5Very high29 Ų2971.4 Ų71.415%0.15236%0.356CS..Hα-helixtrans-60.7-45.6174.4-168.472.9000111.7Y194 N220 I257 S258 P259 N264 I265 E266Y194-L262 HydrophobicContact CE2-CD1 4.22Å; N220-L262 HydrophobicContact CB-CD2 3.9Å; I257-L262 HydrophobicContact CG2-CB 4.2Å; I257-L262 HydrophobicContact CG2-CD1 3.94Å; S258-L262 PolarHBondContact O-N 3.38Å; P259-L262 PolarHBondContact O-N 3.11Å; L262-N264 VanDerWaalsContact C-N 3.26Å; L262-N264 PolarHBondContact O-N 3.03Å; L262-I265 PolarHBondContact O-N 3.3Å; L262-E266 WeakPolarHBondContact O-CB 3.47Å; L262-E266 PolarHBondContact O-N 3.24Å
263I91.4Very high90.7Very high79 Ų7972 Ų7241%0.40536%0.358SS..Hα-helixtrans-59-39.2175.5-69.6163.2000111.1P259 I260 R267P259-I263 WeakPolarHBondContact O-CD1 3.27Å; P259-I263 VanDerWaalsContact O-CG1 3.24Å; P259-I263 WeakPolarHBondContact O-CG1 3.45Å; P259-I263 PolarHBondContact O-N 3.06Å; I260-I263 PolarHBondContact O-N 3.34Å; I263-R267 WeakPolarHBondContact O-CB 3.41Å; I263-R267 VanDerWaalsContact O-CG 3.28Å; I263-R267 WeakPolarHBondContact O-CG 3.42Å; I263-R267 PolarHBondContact O-N 3.03Å
264N91.7Very high91.1Very high67 Ų6766.3 Ų66.336%0.35834%0.336SS..Hα-helixtrans-68.9-40.3178.2-72.7-38.8000112.2W193 I260 D261 L262 F268W193-N264 HydrophobicContact CH2-CB 3.84Å; W193-N264 HydrophobicContact CZ2-CB 4.17Å; I260-N264 PolarHBondContact O-N 3.44Å; I260-N264 PolarHBondContact O-ND2 3.48Å; I260-N264 VanDerWaalsContact O-ND2 3.14Å; D261-N264 PolarHBondContact O-N 3.27Å; L262-N264 VanDerWaalsContact C-N 3.26Å; L262-N264 PolarHBondContact O-N 3.03Å; N264-F268 WeakPolarHBondContact O-CB 3.28Å; N264-F268 PolarHBondContact O-N 3.1Å
265I91.5Very high91.4Very high2 Ų267.6 Ų67.61%0.0134%0.34CS..Hα-helixtrans-63.4-44.8174.4-67.6168.1000110.4W193 Y194 I257 D261 L262 F268 S269W193-I265 HydrophobicContact CB-CG1 4.41Å; W193-I265 HydrophobicContact CD2-CD1 4.16Å; W193-I265 HydrophobicContact CD2-CG1 3.47Å; W193-I265 VanDerWaalsContact CD2-CG1 3.47Å; W193-I265 HydrophobicContact CE3-CG1 3.94Å; W193-I265 HydrophobicContact CG-CD1 3.87Å; W193-I265 HydrophobicContact CG-CG1 3.67Å; W193-I265 HydrophobicContact CZ2-CG1 4.13Å; W193-I265 HydrophobicContact CZ3-CG1 4.44Å; Y194-I265 HydrophobicContact CD2-CG2 3.96Å; Y194-I265 HydrophobicContact CG-CG2 4.46Å; I257-I265 HydrophobicContact CD1-CD1 3.4Å; D261-I265 WeakPolarHBondContact O-CG1 3.49Å; D261-I265 PolarHBondContact O-N 3.23Å; L262-I265 PolarHBondContact O-N 3.3Å; I265-F268 PolarHBondContact O-N 2.82Å; I265-S269 WeakPolarHBondContact O-CB 3.23Å; I265-S269 PolarHBondContact O-N 3.06Å
266E90.8Very high91.7Very high78 Ų7862.1 Ų62.136%0.36432%0.315SS..Hα-helixtrans-60.9-49.3178.2-166.3-159.1149.300110.9L262 F268 S269 N270L262-E266 WeakPolarHBondContact O-CB 3.47Å; L262-E266 PolarHBondContact O-N 3.24Å; E266-F268 VanDerWaalsContact C-N 3.29Å; E266-F268 PolarHBondContact O-N 2.94Å; E266-S269 WeakPolarHBondContact O-CB 3.17Å; E266-S269 PolarHBondContact O-N 2.7Å; E266-S269 VanDerWaalsContact O-N 3.17Å; E266-N270 WeakPolarHBondContact O-CB 3.34Å; E266-N270 PolarHBondContact O-N 3.01Å; E266-N270 PolarHBondContact O-ND2 3.14Å; E266-N270 PolarHBondContact O-OD1 3.19Å
267R92.8Very high91.9Very high175 Ų17559.9 Ų59.966%0.6631%0.308SS*.Hα-helixtrans-57.1-42.5175.4-76.8177.2-179.8-155.70.5112.4I263 R271I263-R267 WeakPolarHBondContact O-CB 3.41Å; I263-R267 VanDerWaalsContact O-CG 3.28Å; I263-R267 WeakPolarHBondContact O-CG 3.42Å; I263-R267 PolarHBondContact O-N 3.03Å; R267-R271 PolarHBondContact O-N 3.24Å; R267-R271 VanDerWaalsContact O-N 3.12Å
268F92.9Very high92.3Very high53 Ų5362.8 Ų62.823%0.23232%0.318CS..Hα-helixtrans-67.3-43.5178.6-173.2-126.5000111F186 R189 V190 W193 N264 I265 E266 N270 R271 V272F186-F268 HydrophobicContact CB-CE2 4.42Å; F186-F268 HydrophobicContact CB-CZ 3.8Å; F186-F268 HydrophobicContact CD1-CE2 4.32Å; F186-F268 AromaticContact CD1-CZ 3.93Å; F186-F268 HydrophobicContact CD1-CZ 3.93Å; F186-F268 HydrophobicContact CG-CE2 4.37Å; F186-F268 HydrophobicContact CG-CZ 4.05Å; R189-F268 HydrophobicContact CB-CE1 3.93Å; R189-F268 HydrophobicContact CB-CZ 4.33Å; R189-F268 HydrophobicContact CG-CE1 4Å; R189-F268 HydrophobicContact CG-CZ 4.41Å; V190-F268 HydrophobicContact CG2-CD1 3.37Å; V190-F268 HydrophobicContact CG2-CE1 3.53Å; V190-F268 HydrophobicContact CG2-CG 4.33Å; W193-F268 HydrophobicContact CE3-CD1 4.29Å; W193-F268 HydrophobicContact CZ3-CB 4.41Å; W193-F268 HydrophobicContact CZ3-CD1 4.4Å; N264-F268 WeakPolarHBondContact O-CB 3.28Å; N264-F268 PolarHBondContact O-N 3.1Å; I265-F268 PolarHBondContact O-N 2.82Å; E266-F268 VanDerWaalsContact C-N 3.29Å; E266-F268 PolarHBondContact O-N 2.94Å; F268-N270 PolarHBondContact O-N 2.93Å; F268-R271 WeakPolarHBondContact O-CB 3.47Å; F268-R271 PolarHBondContact O-N 2.98Å; F268-V272 WeakPolarHBondContact O-CG2 3.36Å; F268-V272 PolarHBondContact O-N 3.25Å
269S92.6Very high92.4Very high0 Ų063.7 Ų63.70%031%0.313CS..Hα-helixtrans-59.9-45.6175.1-1580000112C212 I265 E266 R271 V272 V273C212-S269 VanDerWaalsContact C-OG 3.25Å; C212-S269 VanDerWaalsContact CA-OG 3.3Å; C212-S269 WeakPolarHBondContact CA-OG 3.34Å; C212-S269 WeakPolarHBondContact CB-OG 3.48Å; C212-S269 PolarHBondContact O-OG 3.33Å; I265-S269 WeakPolarHBondContact O-CB 3.23Å; I265-S269 PolarHBondContact O-N 3.06Å; E266-S269 WeakPolarHBondContact O-CB 3.17Å; E266-S269 PolarHBondContact O-N 2.7Å; E266-S269 VanDerWaalsContact O-N 3.17Å; S269-R271 PolarHBondContact O-N 3.14Å; S269-V272 WeakPolarHBondContact O-CB 3.07Å; S269-V272 PolarHBondContact O-N 3.06Å; S269-V273 WeakPolarHBondContact O-CG2 3.49Å; S269-V273 PolarHBondContact O-N 3.07Å
270N92.7Very high92.7Very high52 Ų5263.4 Ų63.428%0.27831%0.306SS..Hα-helixtrans-57-39.5176.1-67.9-10.2000111.4Q216 E266 F268 V273 S274Q216-N270 WeakPolarHBondContact CG-OD1 3.49Å; Q216-N270 PolarHBondContact NE2-OD1 3.35Å; Q216-N270 PolarHBondContact OE1-OD1 3.39Å; E266-N270 WeakPolarHBondContact O-CB 3.34Å; E266-N270 PolarHBondContact O-N 3.01Å; E266-N270 PolarHBondContact O-ND2 3.14Å; E266-N270 PolarHBondContact O-OD1 3.19Å; F268-N270 PolarHBondContact O-N 2.93Å; N270-V273 PolarHBondContact O-N 3.04Å; N270-S274 WeakPolarHBondContact O-CB 2.95Å; N270-S274 PolarHBondContact O-N 3.16Å
271R93.5Very high92.9Very high174 Ų17463.5 Ų63.566%0.65730%0.304SS*.Hα-helixtrans-68.1-37.7176.4-156.368.1173.7-175.21.5112.3R267 F268 S269 S274 L275R267-R271 PolarHBondContact O-N 3.24Å; R267-R271 VanDerWaalsContact O-N 3.12Å; F268-R271 WeakPolarHBondContact O-CB 3.47Å; F268-R271 PolarHBondContact O-N 2.98Å; S269-R271 PolarHBondContact O-N 3.14Å; R271-S274 PolarHBondContact O-N 3.01Å; R271-S274 PolarHBondContact O-OG 2.96Å; R271-S274 VanDerWaalsContact O-OG 3.11Å; R271-L275 WeakPolarHBondContact O-CB 3.33Å; R271-L275 VanDerWaalsContact O-CG 3.23Å; R271-L275 WeakPolarHBondContact O-CG 3.5Å; R271-L275 PolarHBondContact O-N 3Å
272V94.3Very high93.1Very high2 Ų260.6 Ų60.61%0.01229%0.288CS..Hα-helixtrans-67.1-42.3175.8178.30000111F186 S187 V190 C212 F268 S269 L275 A276F186-V272 HydrophobicContact CB-CG2 3.51Å; F186-V272 HydrophobicContact CG-CG2 4.47Å; S187-V272 WeakPolarHBondContact OG-CG1 3.39Å; V190-V272 HydrophobicContact CG2-CG2 4.13Å; C212-V272 HydrophobicContact CB-CG1 4.43Å; F268-V272 WeakPolarHBondContact O-CG2 3.36Å; F268-V272 PolarHBondContact O-N 3.25Å; S269-V272 WeakPolarHBondContact O-CB 3.07Å; S269-V272 PolarHBondContact O-N 3.06Å; V272-L275 PolarHBondContact O-N 3.41Å; V272-A276 PolarHBondContact O-N 2.98Å
273V92.6Very high93.3Very high29 Ų2963 Ų6318%0.17630%0.298CS..Hα-helixtrans-63.2-43.1175.4176.60000110.9C212 R213 S269 N270 L275 A276 A277C212-V273 HydrophobicContact CB-CG2 4.05Å; R213-V273 HydrophobicContact CG-CG1 4.27Å; R213-V273 HydrophobicContact CG-CG2 3.82Å; S269-V273 WeakPolarHBondContact O-CG2 3.49Å; S269-V273 PolarHBondContact O-N 3.07Å; N270-V273 PolarHBondContact O-N 3.04Å; V273-L275 VanDerWaalsContact C-N 3.33Å; V273-L275 PolarHBondContact O-N 3.3Å; V273-A276 PolarHBondContact O-N 3.39Å; V273-A277 PolarHBondContact O-N 3.07Å
274S94.4Very high93.5Very high55 Ų5565.8 Ų65.839%0.38531%0.31SS..Hα-helixtrans-64.4-37.9176.788.40000112.1N270 R271 A276 A277 Y278N270-S274 WeakPolarHBondContact O-CB 2.95Å; N270-S274 PolarHBondContact O-N 3.16Å; R271-S274 PolarHBondContact O-N 3.01Å; R271-S274 PolarHBondContact O-OG 2.96Å; R271-S274 VanDerWaalsContact O-OG 3.11Å; S274-A276 VanDerWaalsContact C-N 3.35Å; S274-A277 PolarHBondContact O-N 3.14Å; S274-Y278 WeakPolarHBondContact O-CB 3.45Å; S274-Y278 PolarHBondContact O-N 3.23Å
275L94.2Very high93.6Very high39 Ų3966.5 Ų66.520%0.20431%0.308CS..Hα-helixtrans-66.1-37.4174.7-73.5171.1000111.8L179 I183 F186 R271 V272 V273 Y278 R279L179-L275 HydrophobicContact CD2-CD2 3.98Å; I183-L275 HydrophobicContact CG1-CB 4.14Å; F186-L275 HydrophobicContact CD2-CD1 4.01Å; F186-L275 HydrophobicContact CE2-CD1 4.05Å; R271-L275 WeakPolarHBondContact O-CB 3.33Å; R271-L275 VanDerWaalsContact O-CG 3.23Å; R271-L275 WeakPolarHBondContact O-CG 3.5Å; R271-L275 PolarHBondContact O-N 3Å; V272-L275 PolarHBondContact O-N 3.41Å; V273-L275 VanDerWaalsContact C-N 3.33Å; V273-L275 PolarHBondContact O-N 3.3Å; L275-Y278 PolarHBondContact O-N 3.04Å; L275-R279 WeakPolarHBondContact O-CB 3.47Å; L275-R279 PolarHBondContact O-N 2.9Å
276A92.4Very high93.8Very high12 Ų1266.5 Ų66.510%0.09931%0.308CS..Hα-helixtrans-66.7-37.2174.900000112.4I183 V272 V273 S274 R279 L280I183-A276 HydrophobicContact CD1-CB 4.44Å; V272-A276 PolarHBondContact O-N 2.98Å; V273-A276 PolarHBondContact O-N 3.39Å; S274-A276 VanDerWaalsContact C-N 3.35Å; A276-R279 WeakPolarHBondContact O-CB 3.39Å; A276-L280 PolarHBondContact O-N 3.49Å
277A92.8Very high93.9Very high41 Ų4170.5 Ų70.534%0.33932%0.32SS..Hα-helixtrans-65.5-49.2172.400000111.4V273 S274 R279 L280 E281V273-A277 PolarHBondContact O-N 3.07Å; S274-A277 PolarHBondContact O-N 3.14Å; A277-R279 PolarHBondContact O-N 2.78Å; A277-L280 WeakPolarHBondContact O-CB 3.44Å; A277-L280 PolarHBondContact O-N 3.34Å; A277-E281 PolarHBondContact O-N 3.31Å; A277-E281 VanDerWaalsContact O-N 3.16Å
278Y95Very high93.9Very high100 Ų10065.1 Ų65.139%0.39231%0.309SS..Hα-helixtrans-59-33.3177.6-179.2-117.7000112.9L175 L179 S274 L275 L280 E281 L282L175-Y278 HydrophobicContact CD2-CE1 4.23Å; L179-Y278 HydrophobicContact CD1-CD1 3.86Å; L179-Y278 HydrophobicContact CD1-CE1 4.07Å; S274-Y278 WeakPolarHBondContact O-CB 3.45Å; S274-Y278 PolarHBondContact O-N 3.23Å; L275-Y278 PolarHBondContact O-N 3.04Å; Y278-L280 VanDerWaalsContact C-N 3.33Å; Y278-L280 PolarHBondContact O-N 3.11Å; Y278-E281 PolarHBondContact O-N 3.2Å; Y278-L282 WeakPolarHBondContact O-CB 3.44Å; Y278-L282 PolarHBondContact O-N 3.12Å
279R94.8Very high93.9Very high69 Ų6965 Ų6526%0.2631%0.308SS..Hα-helixtrans-59.6-41.5172.7178-158.6178.4-92.8-3.7112.3D180 I183 L275 A276 A277 L282 Q283D180-R279 IonicContact OD1-CZ 3.54Å; D180-R279 VanDerWaalsContact OD1-CZ 3.24Å; D180-R279 IonicContact OD1-NE 3.63Å; D180-R279 PolarHBondContact OD1-NE 3.4Å; D180-R279 IonicContact OD1-NH2 3.98Å; D180-R279 PolarHBondContact OD1-NH2 3.02Å; D180-R279 IonicContact OD2-NH2 3.52Å; I183-R279 HydrophobicContact CD1-CB 4Å; I183-R279 HydrophobicContact CD1-CG 4.33Å; L275-R279 WeakPolarHBondContact O-CB 3.47Å; L275-R279 PolarHBondContact O-N 2.9Å; A276-R279 WeakPolarHBondContact O-CB 3.39Å; A277-R279 PolarHBondContact O-N 2.78Å; R279-L282 PolarHBondContact O-N 2.92Å; R279-Q283 PolarHBondContact O-N 3.37Å
280L93.9Very high93.8Very high91 Ų9165 Ų6548%0.47631%0.308SS..Hα-helixtrans-67.3-45.3177.6-66.5172.1000110.8A276 A277 Y278 L282 Q283 E284A276-L280 PolarHBondContact O-N 3.49Å; A277-L280 WeakPolarHBondContact O-CB 3.44Å; A277-L280 PolarHBondContact O-N 3.34Å; Y278-L280 VanDerWaalsContact C-N 3.33Å; Y278-L280 PolarHBondContact O-N 3.11Å; L280-L282 VanDerWaalsContact C-N 3.3Å; L280-L282 PolarHBondContact O-N 3.27Å; L280-Q283 WeakPolarHBondContact O-CB 3.41Å; L280-Q283 PolarHBondContact O-N 3.17Å; L280-Q283 VanDerWaalsContact O-N 3.09Å; L280-E284 PolarHBondContact O-N 2.91Å
281E95.6Very high93.8Very high116 Ų11666.1 Ų66.154%0.54232%0.32SS..Hα-helixtrans-57.7-43.5174.9-65.5172.4-169.700111.6A277 Y278 Q283 E284 Y285A277-E281 PolarHBondContact O-N 3.31Å; A277-E281 VanDerWaalsContact O-N 3.16Å; Y278-E281 PolarHBondContact O-N 3.2Å; E281-Q283 VanDerWaalsContact C-N 3.3Å; E281-Q283 PolarHBondContact O-N 2.78Å; E281-E284 PolarHBondContact O-N 3.48Å; E281-Y285 WeakPolarHBondContact O-CB 3.49Å; E281-Y285 PolarHBondContact O-N 2.96Å
282L95.1Very high93.5Very high10 Ų1063 Ų635%0.05231%0.313CS..Hα-helixtrans-65.3-34.4177.6-173.663.9000112.1L175 L176 L179 Y278 R279 L280 Y285 L286L175-L282 HydrophobicContact CB-CD2 4.04Å; L175-L282 HydrophobicContact CD2-CD2 3.78Å; L175-L282 HydrophobicContact CG-CD2 3.78Å; L176-L282 HydrophobicContact CB-CD2 4.12Å; L179-L282 HydrophobicContact CD1-CD2 3.94Å; Y278-L282 WeakPolarHBondContact O-CB 3.44Å; Y278-L282 PolarHBondContact O-N 3.12Å; R279-L282 PolarHBondContact O-N 2.92Å; L280-L282 VanDerWaalsContact C-N 3.3Å; L280-L282 PolarHBondContact O-N 3.27Å; L282-Y285 HydrophobicContact CD1-CD1 4.25Å; L282-L286 WeakPolarHBondContact O-CB 3.44Å; L282-L286 PolarHBondContact O-N 3.5Å
283Q94.6Very high93.3Very high78 Ų7863.6 Ų63.636%0.36432%0.317SS..Hα-helixtrans-67.3-41.4175.5-175.1176.7-21.500111.5L176 R279 L280 E281 L286 R287L176-Q283 HydrophobicContact CD1-CB 4.16Å; R279-Q283 PolarHBondContact O-N 3.37Å; L280-Q283 WeakPolarHBondContact O-CB 3.41Å; L280-Q283 PolarHBondContact O-N 3.17Å; L280-Q283 VanDerWaalsContact O-N 3.09Å; E281-Q283 VanDerWaalsContact C-N 3.3Å; E281-Q283 PolarHBondContact O-N 2.78Å; Q283-L286 PolarHBondContact O-N 2.95Å; Q283-R287 PolarHBondContact O-N 3.32Å
284E95.3Very high93.3Very high139 Ų13962.2 Ų62.265%0.6531%0.308SS*.Hα-helixtrans-66.5-41.6174.3-69.7-177.217500112.1L280 E281 L286 R287 S288L280-E284 PolarHBondContact O-N 2.91Å; E281-E284 PolarHBondContact O-N 3.48Å; E284-L286 VanDerWaalsContact C-N 3.34Å; E284-L286 PolarHBondContact O-N 3.12Å; E284-R287 WeakPolarHBondContact O-CB 3.5Å; E284-R287 PolarHBondContact O-N 2.82Å; E284-S288 PolarHBondContact O-N 3.08Å
285Y94.5Very high93.2Very high81 Ų8160 Ų6032%0.31829%0.293SS..Hα-helixtrans-58.3-46.4172.8176.2-101.5000111.5M168 S172 E281 L282 R287 S288 K289M168-Y285 WeakPolarHBondContact CE-OH 3.27Å; M168-Y285 PolarHBondContact SD-OH 3.16Å; M168-Y285 VanDerWaalsContact SD-OH 3.42Å; S172-Y285 WeakPolarHBondContact OG-CE1 3.3Å; E281-Y285 WeakPolarHBondContact O-CB 3.49Å; E281-Y285 PolarHBondContact O-N 2.96Å; L282-Y285 HydrophobicContact CD1-CD1 4.25Å; Y285-R287 VanDerWaalsContact C-N 3.32Å; Y285-R287 PolarHBondContact O-N 3.2Å; Y285-S288 PolarHBondContact O-N 3Å; Y285-K289 HydrophobicContact CD1-CG 4.37Å; Y285-K289 HydrophobicContact CD2-CG 4.33Å; Y285-K289 HydrophobicContact CE1-CG 3.92Å; Y285-K289 HydrophobicContact CE2-CD 4.3Å; Y285-K289 VanDerWaalsContact CE2-CE 3.43Å; Y285-K289 HydrophobicContact CE2-CG 3.88Å; Y285-K289 WeakPolarHBondContact O-CB 3.47Å; Y285-K289 WeakPolarHBondContact O-CG 3.48Å; Y285-K289 PolarHBondContact O-N 2.97Å; Y285-K289 VanDerWaalsContact OH-CE 3.27Å; Y285-K289 WeakPolarHBondContact OH-CE 3.39Å
286L94.3Very high93.2Very high2 Ų258.2 Ų58.21%0.0128%0.283CS..Hα-helixtrans-60.3-42.1176.1-177.765.4000111.2I169 I173 L176 L282 Q283 E284 K289 M290 A307I169-L286 HydrophobicContact CB-CD1 4.46Å; I169-L286 HydrophobicContact CG2-CD1 3.95Å; I173-L286 HydrophobicContact CD1-CD2 4.08Å; L176-L286 HydrophobicContact CD1-CD2 4.36Å; L282-L286 WeakPolarHBondContact O-CB 3.44Å; L282-L286 PolarHBondContact O-N 3.5Å; Q283-L286 PolarHBondContact O-N 2.95Å; E284-L286 VanDerWaalsContact C-N 3.34Å; E284-L286 PolarHBondContact O-N 3.12Å; L286-K289 PolarHBondContact O-N 3.35Å; L286-M290 VanDerWaalsContact O-CB 3.22Å; L286-M290 WeakPolarHBondContact O-CB 3.14Å; L286-M290 PolarHBondContact O-N 3.07Å; L286-A307 HydrophobicContact CD1-CB 3.93Å; L286-A307 HydrophobicContact CD2-CB 4.04Å; L286-A307 HydrophobicContact CG-CB 4.37Å
287R93.9Very high93.2Very high163 Ų16357.6 Ų57.662%0.61528%0.279SS*.Hα-helixtrans-60.2-49176.5179.5175.9-174.4-150.6-2.8112Q283 E284 Y285 K289 M290 S291 E303Q283-R287 PolarHBondContact O-N 3.32Å; E284-R287 WeakPolarHBondContact O-CB 3.5Å; E284-R287 PolarHBondContact O-N 2.82Å; Y285-R287 VanDerWaalsContact C-N 3.32Å; Y285-R287 PolarHBondContact O-N 3.2Å; R287-K289 PolarHBondContact O-N 3.05Å; R287-M290 PolarHBondContact O-N 2.86Å; R287-S291 PolarHBondContact O-N 3.3Å; R287-E303 HydrophobicContact CB-CG 4.4Å; R287-E303 HydrophobicContact CG-CG 4.14Å; R287-E303 WeakPolarHBondContact CG-OE1 3.34Å; R287-E303 IonicContact NE-OE1 2.72Å; R287-E303 PolarHBondContact NE-OE1 2.93Å
288S92.8Very high93.3Very high61 Ų6156.2 Ų56.243%0.42727%0.267SS..Hα-helixtrans-60.4-45.1177.6-179.40000111.8E284 Y285 S291 Q292E284-S288 PolarHBondContact O-N 3.08Å; Y285-S288 PolarHBondContact O-N 3Å; S288-S291 PolarHBondContact O-N 2.87Å; S288-Q292 WeakPolarHBondContact O-CG 3.27Å; S288-Q292 PolarHBondContact O-N 3.15Å
289K91.9Very high93.2Very high51 Ų5152.4 Ų52.422%0.22226%0.256CS..Hα-helixtrans-68.5-40.4178.8-69.8-65.3176.4-176.20112.8I169 Y285 L286 R287 S291 Q292 V293I169-K289 HydrophobicContact CG1-CB 4.22Å; Y285-K289 HydrophobicContact CD1-CG 4.37Å; Y285-K289 HydrophobicContact CD2-CG 4.33Å; Y285-K289 HydrophobicContact CE1-CG 3.92Å; Y285-K289 HydrophobicContact CE2-CD 4.3Å; Y285-K289 VanDerWaalsContact CE2-CE 3.43Å; Y285-K289 HydrophobicContact CE2-CG 3.88Å; Y285-K289 WeakPolarHBondContact O-CB 3.47Å; Y285-K289 WeakPolarHBondContact O-CG 3.48Å; Y285-K289 PolarHBondContact O-N 2.97Å; Y285-K289 VanDerWaalsContact OH-CE 3.27Å; Y285-K289 WeakPolarHBondContact OH-CE 3.39Å; L286-K289 PolarHBondContact O-N 3.35Å; R287-K289 PolarHBondContact O-N 3.05Å; K289-S291 VanDerWaalsContact C-N 3.32Å; K289-S291 PolarHBondContact O-N 3.49Å; K289-Q292 PolarHBondContact O-N 3.32Å; K289-Q292 VanDerWaalsContact O-N 3.15Å; K289-V293 WeakPolarHBondContact O-CG2 3.35Å; K289-V293 PolarHBondContact O-N 2.94Å
290M91.9Very high93.2Very high0 Ų049.1 Ų49.10%024%0.244CC..Hα-helixtrans-64-39.4176.7-165.973.2174.600111.3I169 L286 R287 Q292 V293 A294 L297 A298 E303 I310I169-M290 HydrophobicContact CD1-SD 4.09Å; I169-M290 HydrophobicContact CG2-SD 4.34Å; L286-M290 VanDerWaalsContact O-CB 3.22Å; L286-M290 WeakPolarHBondContact O-CB 3.14Å; L286-M290 PolarHBondContact O-N 3.07Å; R287-M290 PolarHBondContact O-N 2.86Å; M290-Q292 PolarHBondContact O-N 3.49Å; M290-V293 PolarHBondContact O-N 2.91Å; M290-A294 HydrophobicContact CE-CB 3.87Å; M290-A294 CarbonylContact O-C 3.47Å; M290-A294 WeakPolarHBondContact O-CA 3.47Å; M290-A294 PolarHBondContact O-N 3.38Å; M290-A294 HydrophobicContact SD-CB 4.15Å; M290-L297 HydrophobicContact CE-CB 4.2Å; M290-L297 HydrophobicContact CE-CD2 3.88Å; M290-L297 HydrophobicContact CE-CG 4.15Å; M290-A298 HydrophobicContact CG-CB 3.83Å; M290-E303 HydrophobicContact CB-CB 4.23Å; M290-E303 HydrophobicContact CB-CG 4.33Å; M290-E303 HydrophobicContact CG-CB 4.23Å; M290-E303 HydrophobicContact CG-CG 4.43Å; M290-I310 HydrophobicContact CE-CD1 3.77Å; M290-I310 HydrophobicContact SD-CD1 3.96Å
291S91.1Very high93.1Very high75 Ų7545.4 Ų45.452%0.52422%0.224SC..Hα-helixtrans-63-27.5174.8-175.40000113.4R287 S288 K289R287-S291 PolarHBondContact O-N 3.3Å; S288-S291 PolarHBondContact O-N 2.87Å; K289-S291 VanDerWaalsContact C-N 3.32Å; K289-S291 PolarHBondContact O-N 3.49Å
292Q88.5Confident93Very high110 Ų11040.9 Ų40.951%0.51421%0.209SC..Hα-helixtrans-83.3-38177.8-68.3171.127.200112.3S288 K289 M290S288-Q292 WeakPolarHBondContact O-CG 3.27Å; S288-Q292 PolarHBondContact O-N 3.15Å; K289-Q292 PolarHBondContact O-N 3.32Å; K289-Q292 VanDerWaalsContact O-N 3.15Å; M290-Q292 PolarHBondContact O-N 3.49Å
293V89.1Confident92.8Very high13 Ų1343.5 Ų43.58%0.07922%0.221CC..Hα-helixtrans-94-42.9-172.2178.50000112.6I169 K289 M290 L316I169-V293 HydrophobicContact CD1-CB 3.66Å; I169-V293 HydrophobicContact CD1-CG1 3.91Å; I169-V293 HydrophobicContact CD1-CG2 3.86Å; K289-V293 WeakPolarHBondContact O-CG2 3.35Å; K289-V293 PolarHBondContact O-N 2.94Å; M290-V293 PolarHBondContact O-N 2.91Å; V293-L316 HydrophobicContact CG1-CD2 4Å
294A92.4Very high92.8Very high0 Ų041.8 Ų41.80%022%0.216CC..  trans-143.666.2-174.100000112.4M290 N296 L297 A298 I310 L316 D384M290-A294 HydrophobicContact CE-CB 3.87Å; M290-A294 CarbonylContact O-C 3.47Å; M290-A294 WeakPolarHBondContact O-CA 3.47Å; M290-A294 PolarHBondContact O-N 3.38Å; M290-A294 HydrophobicContact SD-CB 4.15Å; A294-N296 PolarHBondContact O-N 3.42Å; A294-L297 HydrophobicContact CB-CB 4.25Å; A294-A298 WeakPolarHBondContact O-CB 3.46Å; A294-A298 PolarHBondContact O-N 3.29Å; A294-A298 VanDerWaalsContact O-N 3.08Å; A294-I310 HydrophobicContact CB-CD1 4.37Å; A294-L316 HydrophobicContact CB-CD2 4.35Å; A294-D384 WeakPolarHBondContact CA-OD2 3.31Å; A294-D384 HydrophobicContact CB-CB 4.14Å
295P92.7Very high92.7Very high10 Ų1035.9 Ų35.97%0.06519%0.189CC..Hα-helixtrans-66.8-32.5-178.326.4-34000113.3A298 A299 P390P295-A298 PolarHBondContact O-N 3.15Å; P295-A299 WeakPolarHBondContact O-CB 3.06Å; P295-A299 PolarHBondContact O-N 3.43Å; P295-P390 HydrophobicContact CG-CB 3.68Å; P295-P390 HydrophobicContact CG-CG 4.5Å
296N94Very high92.7Very high0 Ų032 Ų320%017%0.174CC..Hα-helixtrans-71.8-42.3-179.6-64.8-63.4000111.5A294 A298 A299 L300 A380 D384 T391 S392 F394 G395A294-N296 PolarHBondContact O-N 3.42Å; N296-A298 VanDerWaalsContact C-N 3.33Å; N296-A299 PolarHBondContact O-N 2.99Å; N296-L300 WeakPolarHBondContact O-CB 3.49Å; N296-L300 PolarHBondContact O-N 3.47Å; N296-L300 VanDerWaalsContact O-N 3.08Å; N296-A380 HydrophobicContact CB-CB 4.06Å; N296-D384 VanDerWaalsContact CB-OD1 3.27Å; N296-D384 WeakPolarHBondContact CB-OD1 3.44Å; N296-D384 WeakPolarHBondContact CB-OD2 3.12Å; N296-D384 PolarHBondContact N-OD1 2.82Å; N296-D384 PolarHBondContact N-OD2 3.06Å; N296-D384 PolarHBondContact ND2-OD1 2.95Å; N296-T391 PolarHBondContact ND2-O 3.11Å; N296-T391 PolarHBondContact OD1-O 2.82Å; N296-S392 PolarHBondContact OD1-O 2.9Å; N296-F394 WeakPolarHBondContact OD1-CB 3.23Å; N296-F394 PolarHBondContact OD1-N 3.47Å; N296-G395 PolarHBondContact OD1-N 2.84Å
297L93.2Very high92.7Very high0 Ų031.9 Ų31.90%017%0.173CC..Hα-helixtrans-63.9-40.6174.9-171.164000111.3M290 A294 L300 I301 I310 L319 C377 D384M290-L297 HydrophobicContact CE-CB 4.2Å; M290-L297 HydrophobicContact CE-CD2 3.88Å; M290-L297 HydrophobicContact CE-CG 4.15Å; A294-L297 HydrophobicContact CB-CB 4.25Å; L297-L300 PolarHBondContact O-N 3.41Å; L297-I301 HydrophobicContact CD1-CD1 3.72Å; L297-I301 HydrophobicContact CD1-CG1 4.02Å; L297-I301 HydrophobicContact CG-CD1 4.11Å; L297-I301 HydrophobicContact CG-CG1 4.27Å; L297-I301 WeakPolarHBondContact O-CG1 3.43Å; L297-I301 PolarHBondContact O-N 3.48Å; L297-I301 VanDerWaalsContact O-N 3.11Å; L297-I310 HydrophobicContact CD2-CD1 4.21Å; L297-I310 HydrophobicContact CD2-CG1 4.23Å; L297-L319 HydrophobicContact CD2-CD2 4.03Å; L297-C377 HydrophobicContact CD1-CB 4.16Å; L297-D384 PolarHBondContact N-OD2 3.45Å
298A94.3Very high92.8Very high12 Ų1226.8 Ų26.810%0.09915%0.154CC..Hα-helixtrans-60.7-49.3175.100000112.5M290 A294 P295 N296 L300 G302 E303M290-A298 HydrophobicContact CG-CB 3.83Å; A294-A298 WeakPolarHBondContact O-CB 3.46Å; A294-A298 PolarHBondContact O-N 3.29Å; A294-A298 VanDerWaalsContact O-N 3.08Å; P295-A298 PolarHBondContact O-N 3.15Å; N296-A298 VanDerWaalsContact C-N 3.33Å; A298-L300 VanDerWaalsContact C-N 3.27Å; A298-L300 PolarHBondContact O-N 2.82Å; A298-G302 WeakPolarHBondContact O-CA 3.38Å; A298-G302 PolarHBondContact O-N 3.29Å; A298-E303 HydrophobicContact CB-CG 4.16Å
299A93.8Very high92.9Very high19 Ų1923.9 Ų23.916%0.15713%0.134CC..Hα-helixtrans-60.6-37.2178.200000112.5P295 N296 R399P295-A299 WeakPolarHBondContact O-CB 3.06Å; P295-A299 PolarHBondContact O-N 3.43Å; N296-A299 PolarHBondContact O-N 2.99Å; A299-R399 PolarHBondContact O-NH1 3.31Å
300L93.6Very high93Very high0 Ų021.4 Ų21.40%012%0.123CC..Hα-helixtrans-73-50.8-177.2-175.864.5000113.6N296 L297 A298 F357 L373 K376 C377 A380 L398 R399 V402N296-L300 WeakPolarHBondContact O-CB 3.49Å; N296-L300 PolarHBondContact O-N 3.47Å; N296-L300 VanDerWaalsContact O-N 3.08Å; L297-L300 PolarHBondContact O-N 3.41Å; A298-L300 VanDerWaalsContact C-N 3.27Å; A298-L300 PolarHBondContact O-N 2.82Å; L300-F357 WeakPolarHBondContact O-CE2 3.35Å; L300-L373 HydrophobicContact CD1-CD1 4.32Å; L300-L373 HydrophobicContact CD2-CD1 4.31Å; L300-L373 HydrophobicContact CG-CD1 4.16Å; L300-K376 HydrophobicContact CD2-CB 3.85Å; L300-C377 HydrophobicContact CD2-CB 4.39Å; L300-A380 HydrophobicContact CD2-CB 4.34Å; L300-L398 HydrophobicContact CD1-CB 4.05Å; L300-R399 HydrophobicContact CD1-CB 4.19Å; L300-V402 HydrophobicContact CD1-CG2 4.1Å
301I92.3Very high93.2Very high13 Ų1323.1 Ų23.17%0.06714%0.135CC..Hα-helixtrans-120.8-3.9-171.552167.3000114.9L297 V305 L309 L373 C377L297-I301 HydrophobicContact CD1-CD1 3.72Å; L297-I301 HydrophobicContact CD1-CG1 4.02Å; L297-I301 HydrophobicContact CG-CD1 4.11Å; L297-I301 HydrophobicContact CG-CG1 4.27Å; L297-I301 WeakPolarHBondContact O-CG1 3.43Å; L297-I301 PolarHBondContact O-N 3.48Å; L297-I301 VanDerWaalsContact O-N 3.11Å; I301-V305 HydrophobicContact CD1-CB 4.44Å; I301-V305 HydrophobicContact CD1-CG1 4.17Å; I301-L309 HydrophobicContact CD1-CD1 3.42Å; I301-L309 VanDerWaalsContact CD1-CD1 3.42Å; I301-L309 HydrophobicContact CD1-CG 4.46Å; I301-L373 HydrophobicContact CG2-CD1 3.79Å; I301-L373 HydrophobicContact CG2-CD2 4.17Å; I301-L373 HydrophobicContact CG2-CG 4.18Å; I301-C377 VanDerWaalsContact CG2-SG 3.52Å
302G92.7Very high93.3Very high22 Ų2223.8 Ų23.823%0.22713%0.129CC..  trans90.9157.1-17300000113.1A298 G306A298-G302 WeakPolarHBondContact O-CA 3.38Å; A298-G302 PolarHBondContact O-N 3.29Å; G302-G306 PolarHBondContact O-N 3.41Å
303E92.8Very high93.6Very high64 Ų6418.8 Ų18.830%0.29911%0.107SC..Hα-helixtrans-68.5-42.5-170.3-53.891.1160.500112.2R287 M290 A298 A307R287-E303 HydrophobicContact CB-CG 4.4Å; R287-E303 HydrophobicContact CG-CG 4.14Å; R287-E303 WeakPolarHBondContact CG-OE1 3.34Å; R287-E303 IonicContact NE-OE1 2.72Å; R287-E303 PolarHBondContact NE-OE1 2.93Å; M290-E303 HydrophobicContact CB-CB 4.23Å; M290-E303 HydrophobicContact CB-CG 4.33Å; M290-E303 HydrophobicContact CG-CB 4.23Å; M290-E303 HydrophobicContact CG-CG 4.43Å; A298-E303 HydrophobicContact CB-CG 4.16Å; E303-A307 WeakPolarHBondContact O-CB 3.37Å; E303-A307 PolarHBondContact O-N 3.1Å
304V93.3Very high93.7Very high42 Ų4220.2 Ų20.226%0.25512%0.124SC..Hα-helixtrans-67.9-46.7-176.6-1790000111.7I173 A307 R308I173-V304 HydrophobicContact CD1-CG1 3.94Å; V304-A307 PolarHBondContact O-N 3.22Å; V304-R308 WeakPolarHBondContact O-CB 3.39Å; V304-R308 PolarHBondContact O-N 3.06Å
305V93.4Very high93.7Very high15 Ų1521.1 Ų21.19%0.09113%0.131CC..Hα-helixtrans-68.5-40.6179.3-174.80000110.1I301 R308 L309 H354I301-V305 HydrophobicContact CD1-CB 4.44Å; I301-V305 HydrophobicContact CD1-CG1 4.17Å; V305-R308 PolarHBondContact O-N 2.84Å; V305-L309 WeakPolarHBondContact O-CG 3.44Å; V305-L309 PolarHBondContact O-N 3.13Å; V305-H354 HydrophobicContact CG2-CB 4.27Å
306G94.4Very high93.6Very high0 Ų021 Ų210%013%0.13CC..Hα-helixtrans-60.7-46.3174.300000112.8G302 R308 L309 I310G302-G306 PolarHBondContact O-N 3.41Å; G306-R308 VanDerWaalsContact C-N 3.31Å; G306-R308 PolarHBondContact O-N 3.46Å; G306-L309 WeakPolarHBondContact O-CB 3.35Å; G306-L309 PolarHBondContact O-N 3.27Å; G306-I310 WeakPolarHBondContact O-CG1 3.46Å; G306-I310 PolarHBondContact O-N 3.25Å
307A95.3Very high93.5Very high0 Ų023.3 Ų23.30%014%0.144CC..Hα-helixtrans-61-40175.900000112I169 I173 L286 E303 V304 L309 I310 S311I169-A307 HydrophobicContact CG2-CB 3.71Å; I173-A307 HydrophobicContact CB-CB 4.04Å; I173-A307 HydrophobicContact CD1-CB 4.41Å; I173-A307 HydrophobicContact CG1-CB 4.16Å; I173-A307 HydrophobicContact CG2-CB 4.41Å; L286-A307 HydrophobicContact CD1-CB 3.93Å; L286-A307 HydrophobicContact CD2-CB 4.04Å; L286-A307 HydrophobicContact CG-CB 4.37Å; E303-A307 WeakPolarHBondContact O-CB 3.37Å; E303-A307 PolarHBondContact O-N 3.1Å; V304-A307 PolarHBondContact O-N 3.22Å; A307-L309 PolarHBondContact O-N 3.33Å; A307-I310 PolarHBondContact O-N 3.03Å; A307-S311 WeakPolarHBondContact O-CB 3.3Å; A307-S311 PolarHBondContact O-N 3.3Å
308R95.5Very high93.5Very high55 Ų5526.3 Ų26.321%0.20816%0.16CC..Hα-helixtrans-65.7-36.1177-158.7177.8-74.9130.3-2.3112.4I173 D177 V304 V305 G306 H312 L351I173-R308 HydrophobicContact CG1-CB 4.35Å; D177-R308 IonicContact OD1-CZ 3.17Å; D177-R308 IonicContact OD1-NE 2.7Å; D177-R308 IonicContact OD1-NH2 3.3Å; D177-R308 PolarHBondContact OD1-NH2 3.41Å; D177-R308 IonicContact OD2-NE 3.34Å; D177-R308 PolarHBondContact OD2-NE 3.07Å; D177-R308 IonicContact OD2-NH2 2.69Å; V304-R308 WeakPolarHBondContact O-CB 3.39Å; V304-R308 PolarHBondContact O-N 3.06Å; V305-R308 PolarHBondContact O-N 2.84Å; G306-R308 VanDerWaalsContact C-N 3.31Å; G306-R308 PolarHBondContact O-N 3.46Å; R308-H312 WeakPolarHBondContact O-CB 3.41Å; R308-H312 PolarHBondContact O-N 2.99Å; R308-L351 HydrophobicContact CG-CD1 4.04Å; R308-L351 HydrophobicContact CG-CD2 4.18Å
309L94.8Very high93.5Very high0 Ų025.8 Ų25.80%016%0.155CC..Hα-helixtrans-64.4-43.2172.2-68.4177.5000112.1I301 V305 G306 A307 A313 L319 L330 L351 I352I301-L309 HydrophobicContact CD1-CD1 3.42Å; I301-L309 VanDerWaalsContact CD1-CD1 3.42Å; I301-L309 HydrophobicContact CD1-CG 4.46Å; V305-L309 WeakPolarHBondContact O-CG 3.44Å; V305-L309 PolarHBondContact O-N 3.13Å; G306-L309 WeakPolarHBondContact O-CB 3.35Å; G306-L309 PolarHBondContact O-N 3.27Å; A307-L309 PolarHBondContact O-N 3.33Å; L309-A313 WeakPolarHBondContact O-CB 3.3Å; L309-A313 PolarHBondContact O-N 3.27Å; L309-L319 HydrophobicContact CB-CD1 4.39Å; L309-L319 HydrophobicContact CB-CD2 4.09Å; L309-L330 HydrophobicContact CD2-CB 4.43Å; L309-L330 HydrophobicContact CD2-CD2 3.81Å; L309-L351 HydrophobicContact CD2-CB 3.93Å; L309-L351 HydrophobicContact CD2-CD1 4.25Å; L309-I352 HydrophobicContact CD1-CD1 4.32Å; L309-I352 HydrophobicContact CD1-CG1 4.06Å; L309-I352 HydrophobicContact CD2-CD1 4.5Å; L309-I352 HydrophobicContact CD2-CG1 3.97Å
310I94.9Very high93.5Very high0 Ų025 Ų250%015%0.149CC..Hα-helixtrans-63.4-45.8177.4-66.3169.5000110.3I170 M290 A294 L297 G306 A307 A313 G314 L316 L319I170-I310 HydrophobicContact CD1-CG2 4.43Å; I170-I310 HydrophobicContact CG1-CG2 4.06Å; M290-I310 HydrophobicContact CE-CD1 3.77Å; M290-I310 HydrophobicContact SD-CD1 3.96Å; A294-I310 HydrophobicContact CB-CD1 4.37Å; L297-I310 HydrophobicContact CD2-CD1 4.21Å; L297-I310 HydrophobicContact CD2-CG1 4.23Å; G306-I310 WeakPolarHBondContact O-CG1 3.46Å; G306-I310 PolarHBondContact O-N 3.25Å; A307-I310 PolarHBondContact O-N 3.03Å; I310-A313 PolarHBondContact O-N 3.47Å; I310-G314 PolarHBondContact O-N 3.21Å; I310-L316 HydrophobicContact CD1-CD1 4.03Å; I310-L316 HydrophobicContact CG1-CD1 4.1Å; I310-L319 HydrophobicContact CG1-CD2 3.78Å
311S95.2Very high93.5Very high36 Ų3631.6 Ų31.625%0.25218%0.178SC..Hα-helixtrans-59.8-46.8177.8179.40000112.4A307 A313 G314A307-S311 WeakPolarHBondContact O-CB 3.3Å; A307-S311 PolarHBondContact O-N 3.3Å; S311-A313 VanDerWaalsContact C-N 3.29Å; S311-A313 PolarHBondContact O-N 3.41Å; S311-G314 PolarHBondContact O-N 2.88Å
312H94.2Very high93.7Very high88 Ų8834.5 Ų34.541%0.40719%0.188SC..Hα-helixtrans-67.8-27.9178.5-160.7-69000113.3R308 G314 L330 E333 L351R308-H312 WeakPolarHBondContact O-CB 3.41Å; R308-H312 PolarHBondContact O-N 2.99Å; H312-G314 VanDerWaalsContact C-N 3.34Å; H312-L330 HydrophobicContact CB-CD2 4.09Å; H312-L330 HydrophobicContact CB-CG 4.2Å; H312-E333 IonicContact CE1-OE1 2.63Å; H312-E333 PolarHBondContact CE1-OE1 3.4Å; H312-E333 IonicContact CE1-OE2 3.74Å; H312-E333 IonicContact ND1-OE1 3.62Å; H312-E333 IonicContact NE2-OE1 3.24Å; H312-E333 IonicContact NE2-OE2 2.96Å; H312-L351 HydrophobicContact CB-CD1 3.87Å
313A93.3Very high93.8Very high5 Ų536.5 Ų36.54%0.04120%0.197CC..Hα-helixtrans-80.9-14172.800000113.4L309 I310 S311 S315 N318 L319 Y322L309-A313 WeakPolarHBondContact O-CB 3.3Å; L309-A313 PolarHBondContact O-N 3.27Å; I310-A313 PolarHBondContact O-N 3.47Å; S311-A313 VanDerWaalsContact C-N 3.29Å; S311-A313 PolarHBondContact O-N 3.41Å; A313-S315 PolarHBondContact O-N 3.03Å; A313-N318 VanDerWaalsContact O-CB 3.32Å; A313-N318 WeakPolarHBondContact O-CB 3.21Å; A313-N318 PolarHBondContact O-ND2 3.45Å; A313-L319 HydrophobicContact CB-CB 3.76Å; A313-L319 HydrophobicContact CB-CD1 4.11Å; A313-L319 HydrophobicContact CB-CG 4.5Å; A313-Y322 HydrophobicContact CB-CD2 4.19Å; A313-Y322 HydrophobicContact CB-CE2 3.63Å
314G91.4Very high93.9Very high43 Ų4334.2 Ų34.244%0.44319%0.189SC..THydrogen-bonded Turntrans77.6-13.3-178.500000115.5I170 I310 S311 H312I170-G314 WeakPolarHBondContact CD1-O 3.26Å; I310-G314 PolarHBondContact O-N 3.21Å; S311-G314 PolarHBondContact O-N 2.88Å; H312-G314 VanDerWaalsContact C-N 3.34Å
315S91.9Very high93.9Very high20 Ų2035.8 Ų35.814%0.1420%0.202CC..SBendtrans-165.2159.4169.762.60000110.4D166 A313 T317 N318 L319D166-S315 WeakPolarHBondContact OD2-CA 3.22Å; D166-S315 VanDerWaalsContact OD2-CB 3.27Å; D166-S315 WeakPolarHBondContact OD2-CB 3.43Å; A313-S315 PolarHBondContact O-N 3.03Å; S315-T317 PolarHBondContact O-N 3.46Å; S315-N318 PolarHBondContact O-N 3.3Å; S315-N318 VanDerWaalsContact OG-CB 3.3Å; S315-N318 WeakPolarHBondContact OG-CB 3.4Å; S315-N318 PolarHBondContact OG-N 2.97Å; S315-N318 PolarHBondContact OG-ND2 3.24Å; S315-N318 VanDerWaalsContact OG-ND2 3.16Å; S315-L319 PolarHBondContact O-N 2.99Å; S315-L319 VanDerWaalsContact O-N 3.07Å
316L92.3Very high94Very high7 Ų737.5 Ų37.54%0.03721%0.213CC..Hα-helixtrans-64.5-33.6173.5-179.862000111D166 V293 A294 I310 L319 A320 D384 C385D166-L316 HydrophobicContact CB-CB 4.28Å; D166-L316 PolarHBondContact OD2-N 3.29Å; V293-L316 HydrophobicContact CG1-CD2 4Å; A294-L316 HydrophobicContact CB-CD2 4.35Å; I310-L316 HydrophobicContact CD1-CD1 4.03Å; I310-L316 HydrophobicContact CG1-CD1 4.1Å; L316-L319 HydrophobicContact CD1-CD2 4.46Å; L316-L319 PolarHBondContact O-N 2.96Å; L316-A320 WeakPolarHBondContact O-CB 3.42Å; L316-A320 PolarHBondContact O-N 2.92Å; L316-D384 HydrophobicContact CD2-CB 4.41Å; L316-C385 HydrophobicContact CD2-CB 4.36Å; L316-C385 HydrophobicContact CG-CB 4.11Å
317T91.9Very high94Very high48 Ų4837.6 Ų37.629%0.29421%0.213SC..Hα-helixtrans-65.8-41.8177.8-57.20000111.9S315 A320 K321S315-T317 PolarHBondContact O-N 3.46Å; T317-A320 PolarHBondContact O-N 3.15Å; T317-K321 WeakPolarHBondContact O-CG 3.42Å; T317-K321 PolarHBondContact O-N 3.27Å
318N92.6Very high94Very high63 Ų6338.8 Ų38.834%0.33722%0.219SC..Hα-helixtrans-67.1-40.9175.7-70.3-15.4000111.1A313 S315 A320 K321 Y322A313-N318 VanDerWaalsContact O-CB 3.32Å; A313-N318 WeakPolarHBondContact O-CB 3.21Å; A313-N318 PolarHBondContact O-ND2 3.45Å; S315-N318 PolarHBondContact O-N 3.3Å; S315-N318 VanDerWaalsContact OG-CB 3.3Å; S315-N318 WeakPolarHBondContact OG-CB 3.4Å; S315-N318 PolarHBondContact OG-N 2.97Å; S315-N318 PolarHBondContact OG-ND2 3.24Å; S315-N318 VanDerWaalsContact OG-ND2 3.16Å; N318-A320 VanDerWaalsContact C-N 3.31Å; N318-A320 PolarHBondContact O-N 3.15Å; N318-K321 WeakPolarHBondContact O-CB 3.47Å; N318-K321 PolarHBondContact O-N 3.19Å; N318-K321 VanDerWaalsContact O-N 3.11Å; N318-Y322 WeakPolarHBondContact O-CD1 3.13Å; N318-Y322 PolarHBondContact O-N 2.92Å; N318-Y322 VanDerWaalsContact O-N 3.07Å
319L94.4Very high93.9Very high1 Ų137.8 Ų37.81%0.00522%0.217CC..Hα-helixtrans-59.3-41.9175.5-175.462.2000111.8L297 L309 I310 A313 S315 L316 K321 Y322 V327 L330L297-L319 HydrophobicContact CD2-CD2 4.03Å; L309-L319 HydrophobicContact CB-CD1 4.39Å; L309-L319 HydrophobicContact CB-CD2 4.09Å; I310-L319 HydrophobicContact CG1-CD2 3.78Å; A313-L319 HydrophobicContact CB-CB 3.76Å; A313-L319 HydrophobicContact CB-CD1 4.11Å; A313-L319 HydrophobicContact CB-CG 4.5Å; S315-L319 PolarHBondContact O-N 2.99Å; S315-L319 VanDerWaalsContact O-N 3.07Å; L316-L319 HydrophobicContact CD1-CD2 4.46Å; L316-L319 PolarHBondContact O-N 2.96Å; L319-K321 VanDerWaalsContact C-N 3.28Å; L319-K321 PolarHBondContact O-N 3.27Å; L319-Y322 HydrophobicContact CD1-CD2 4.45Å; L319-Y322 PolarHBondContact O-N 3.39Å; L319-V327 HydrophobicContact CD1-CG2 4.06Å; L319-L330 HydrophobicContact CD1-CD2 4.38Å
320A93.7Very high93.8Very high2 Ų238 Ų382%0.01722%0.218CC..Hα-helixtrans-64.4-31.5176.800000113.2L316 T317 N318 R382 C385 F386L316-A320 WeakPolarHBondContact O-CB 3.42Å; L316-A320 PolarHBondContact O-N 2.92Å; T317-A320 PolarHBondContact O-N 3.15Å; N318-A320 VanDerWaalsContact C-N 3.31Å; N318-A320 PolarHBondContact O-N 3.15Å; A320-R382 HydrophobicContact CB-CG 3.99Å; A320-R382 WeakPolarHBondContact O-CG 3.26Å; A320-R382 PolarHBondContact O-NE 2.78Å; A320-C385 HydrophobicContact CB-CB 3.8Å; A320-F386 HydrophobicContact CB-CE2 4.13Å
321K94.4Very high93.6Very high140 Ų14039.8 Ų39.861%0.60924%0.236SC*.Hα-helixtrans-76.5-27.1176.8-71171.3-178.1175.60112.8T317 N318 L319T317-K321 WeakPolarHBondContact O-CG 3.42Å; T317-K321 PolarHBondContact O-N 3.27Å; N318-K321 WeakPolarHBondContact O-CB 3.47Å; N318-K321 PolarHBondContact O-N 3.19Å; N318-K321 VanDerWaalsContact O-N 3.11Å; L319-K321 VanDerWaalsContact C-N 3.28Å; L319-K321 PolarHBondContact O-N 3.27Å
322Y94.8Very high93.5Very high74 Ų7438.8 Ų38.829%0.2923%0.231SC..SBendtrans-62.8140.5179.5-69.9-12.4000112A313 N318 L319 T326 L330 T378A313-Y322 HydrophobicContact CB-CD2 4.19Å; A313-Y322 HydrophobicContact CB-CE2 3.63Å; N318-Y322 WeakPolarHBondContact O-CD1 3.13Å; N318-Y322 PolarHBondContact O-N 2.92Å; N318-Y322 VanDerWaalsContact O-N 3.07Å; L319-Y322 HydrophobicContact CD1-CD2 4.45Å; L319-Y322 PolarHBondContact O-N 3.39Å; Y322-T326 HydrophobicContact CD2-CG2 4.25Å; Y322-T326 HydrophobicContact CG-CG2 4.29Å; Y322-L330 HydrophobicContact CD2-CD1 4.42Å; Y322-L330 HydrophobicContact CE2-CD1 4.12Å; Y322-T378 WeakPolarHBondContact O-CG2 3.48Å
323P96.1Very high93.3Very high63 Ų6337 Ų3741%0.40922%0.223SC..  trans-72.2156170.432-33.9000109.8S325 T326 V327P323-S325 PolarHBondContact O-N 3.15Å; P323-T326 WeakPolarHBondContact CG-OG1 3.42Å; P323-T326 WeakPolarHBondContact O-CB 3.32Å; P323-T326 PolarHBondContact O-N 2.89Å; P323-V327 PolarHBondContact O-N 3.38Å; P323-V327 VanDerWaalsContact O-N 3.11Å
324A95Very high93.1Very high17 Ų1745.6 Ų45.614%0.1426%0.259CS..Hα-helixtrans-61.1-29.9-17800000113.5T326 V327 Q328 A374 N375 T378A324-T326 VanDerWaalsContact C-N 3.33Å; A324-T326 PolarHBondContact O-N 3.44Å; A324-V327 PolarHBondContact O-N 3.14Å; A324-Q328 WeakPolarHBondContact O-CB 3.46Å; A324-Q328 PolarHBondContact O-N 2.93Å; A324-A374 WeakPolarHBondContact O-CB 3.17Å; A324-N375 HydrophobicContact CB-CB 4.4Å; A324-N375 WeakPolarHBondContact CB-OD1 3.28Å; A324-T378 WeakPolarHBondContact CA-OG1 3.37Å
325S93.4Very high93.1Very high75 Ų7545 Ų4552%0.52425%0.25SC..Hα-helixtrans-63.5-36.6174.250.80000112.8P323P323-S325 PolarHBondContact O-N 3.15Å
326T93.8Very high93Very high51 Ų5145.5 Ų45.531%0.31325%0.251SS..Hα-helixtrans-71.3-44.8173.9-59.60000110.5Y322 P323 A324 Q328 I329 L330Y322-T326 HydrophobicContact CD2-CG2 4.25Å; Y322-T326 HydrophobicContact CG-CG2 4.29Å; P323-T326 WeakPolarHBondContact CG-OG1 3.42Å; P323-T326 WeakPolarHBondContact O-CB 3.32Å; P323-T326 PolarHBondContact O-N 2.89Å; A324-T326 VanDerWaalsContact C-N 3.33Å; A324-T326 PolarHBondContact O-N 3.44Å; T326-Q328 PolarHBondContact O-N 2.89Å; T326-I329 WeakPolarHBondContact O-CG1 3.3Å; T326-I329 PolarHBondContact O-N 3.46Å; T326-I329 VanDerWaalsContact O-N 3.15Å; T326-L330 PolarHBondContact O-N 3.07Å
327V94.9Very high92.9Very high2 Ų251.8 Ų51.81%0.01228%0.278CS..Hα-helixtrans-59.4-35.5177.6172.70000111.8L319 P323 A324 I329 I352 A374 C377L319-V327 HydrophobicContact CD1-CG2 4.06Å; P323-V327 PolarHBondContact O-N 3.38Å; P323-V327 VanDerWaalsContact O-N 3.11Å; A324-V327 PolarHBondContact O-N 3.14Å; V327-I329 VanDerWaalsContact C-N 3.3Å; V327-I329 PolarHBondContact O-N 2.93Å; V327-I352 HydrophobicContact CG1-CD1 3.63Å; V327-I352 WeakPolarHBondContact O-CD1 3.27Å; V327-A374 HydrophobicContact CG1-CB 4.37Å; V327-C377 HydrophobicContact CG1-CB 4.38Å
328Q94.8Very high93Very high24 Ų2457.2 Ų57.211%0.11229%0.293CS..Hα-helixtrans-58.7-38.6176.8-175.6-177.2-12.100113.3A324 T326 K348 Y349 G350 A374A324-Q328 WeakPolarHBondContact O-CB 3.46Å; A324-Q328 PolarHBondContact O-N 2.93Å; T326-Q328 PolarHBondContact O-N 2.89Å; Q328-K348 PolarHBondContact NE2-O 3.41Å; Q328-Y349 CarbonylContact O-C 3.57Å; Q328-Y349 WeakPolarHBondContact O-CA 3.46Å; Q328-G350 PolarHBondContact O-N 3.08Å; Q328-A374 HydrophobicContact CB-CB 3.75Å; Q328-A374 HydrophobicContact CG-CB 4.42Å
329I94.3Very high93Very high35 Ų3554.6 Ų54.618%0.17928%0.28CS..Hα-helixtrans-107.84.9-172.966.2-172.8000113.2T326 V327 G331 A332 L336T326-I329 WeakPolarHBondContact O-CG1 3.3Å; T326-I329 PolarHBondContact O-N 3.46Å; T326-I329 VanDerWaalsContact O-N 3.15Å; V327-I329 VanDerWaalsContact C-N 3.3Å; V327-I329 PolarHBondContact O-N 2.93Å; I329-G331 PolarHBondContact O-N 3.33Å; I329-A332 WeakPolarHBondContact O-CB 3.38Å; I329-A332 PolarHBondContact O-N 3.19Å; I329-L336 HydrophobicContact CD1-CD1 4.26Å; I329-L336 HydrophobicContact CD1-CD2 3.55Å; I329-L336 HydrophobicContact CD1-CG 4.47Å
330L93.2Very high92.8Very high4 Ų459.5 Ų59.52%0.02131%0.306CS..THydrogen-bonded Turntrans-57.5128.8-179.3-160.771.4000110.2L309 H312 L319 Y322 T326 E333 G350 L351L309-L330 HydrophobicContact CD2-CB 4.43Å; L309-L330 HydrophobicContact CD2-CD2 3.81Å; H312-L330 HydrophobicContact CB-CD2 4.09Å; H312-L330 HydrophobicContact CB-CG 4.2Å; L319-L330 HydrophobicContact CD1-CD2 4.38Å; Y322-L330 HydrophobicContact CD2-CD1 4.42Å; Y322-L330 HydrophobicContact CE2-CD1 4.12Å; T326-L330 PolarHBondContact O-N 3.07Å; L330-E333 WeakPolarHBondContact CA-OE1 3.45Å; L330-G350 CarbonylContact O-C 3.58Å; L330-G350 VanDerWaalsContact O-CA 3.27Å; L330-G350 WeakPolarHBondContact O-CA 3.34Å; L330-L351 WeakPolarHBondContact O-CG 3.32Å; L330-L351 PolarHBondContact O-N 3.09Å
331G90.6Very high92.8Very high37 Ų3768.5 Ų68.538%0.38135%0.345SS..THydrogen-bonded Turntrans84-4.2-17200000115.9I329 E333I329-G331 PolarHBondContact O-N 3.33Å; G331-E333 WeakPolarHBondContact CA-OE2 3.37Å; G331-E333 VanDerWaalsContact N-CD 3.27Å; G331-E333 PolarHBondContact N-OE1 3.46Å; G331-E333 PolarHBondContact N-OE2 3.39Å
332A92.9Very high92.7Very high16 Ų1666.7 Ų66.713%0.13235%0.345CS..  trans-108.619.9173.100000112.8I329 K334 A335 L336 P347I329-A332 WeakPolarHBondContact O-CB 3.38Å; I329-A332 PolarHBondContact O-N 3.19Å; A332-K334 VanDerWaalsContact C-N 3.33Å; A332-K334 PolarHBondContact O-N 2.95Å; A332-A335 PolarHBondContact O-N 2.89Å; A332-A335 VanDerWaalsContact O-N 3.12Å; A332-L336 PolarHBondContact O-N 2.91Å; A332-P347 HydrophobicContact CB-CB 4.13Å; A332-P347 HydrophobicContact CB-CG 4.14Å
333E89.6Confident92.5Very high51 Ų5174.5 Ų74.524%0.23837%0.374CS..Hα-helixtrans-60.7-40.8-173-60.479.4-171.900111.7H312 L330 G331 A335 L336 F337H312-E333 IonicContact CE1-OE1 2.63Å; H312-E333 PolarHBondContact CE1-OE1 3.4Å; H312-E333 IonicContact CE1-OE2 3.74Å; H312-E333 IonicContact ND1-OE1 3.62Å; H312-E333 IonicContact NE2-OE1 3.24Å; H312-E333 IonicContact NE2-OE2 2.96Å; L330-E333 WeakPolarHBondContact CA-OE1 3.45Å; G331-E333 WeakPolarHBondContact CA-OE2 3.37Å; G331-E333 VanDerWaalsContact N-CD 3.27Å; G331-E333 PolarHBondContact N-OE1 3.46Å; G331-E333 PolarHBondContact N-OE2 3.39Å; E333-A335 VanDerWaalsContact C-N 3.29Å; E333-A335 PolarHBondContact O-N 2.95Å; E333-L336 WeakPolarHBondContact O-CB 3.38Å; E333-L336 PolarHBondContact O-N 3.48Å; E333-L336 VanDerWaalsContact O-N 3.16Å; E333-F337 HydrophobicContact CB-CD2 4.13Å; E333-F337 HydrophobicContact CB-CE2 3.96Å; E333-F337 WeakPolarHBondContact O-CD2 3.48Å; E333-F337 PolarHBondContact O-N 3.43Å
334K90.1Very high92.2Very high185 Ų18573.2 Ų73.280%0.80437%0.372SS*.Hα-helixtrans-59.7-41.9178.1-67-177.5-178.61770111.8A332 R338A332-K334 VanDerWaalsContact C-N 3.33Å; A332-K334 PolarHBondContact O-N 2.95Å; K334-R338 WeakPolarHBondContact O-CB 3.42Å; K334-R338 PolarHBondContact O-N 3.2Å; K334-R338 VanDerWaalsContact O-N 3.08Å
335A90.2Very high91.9Very high30 Ų3080.2 Ų80.225%0.24841%0.407CS..Hα-helixtrans-70.3-38.1177.400000111.4A332 E333 R338 A339 P347A332-A335 PolarHBondContact O-N 2.89Å; A332-A335 VanDerWaalsContact O-N 3.12Å; E333-A335 VanDerWaalsContact C-N 3.29Å; E333-A335 PolarHBondContact O-N 2.95Å; A335-R338 PolarHBondContact O-N 3.42Å; A335-A339 WeakPolarHBondContact O-CB 3.36Å; A335-A339 PolarHBondContact O-N 2.97Å; A335-P347 HydrophobicContact CB-CG 4.31Å
336L90.4Very high91.7Very high31 Ų3180.3 Ų80.316%0.16241%0.405CS..Hα-helixtrans-61-51.6174.4-179.372.4000111.8I329 A332 E333 R338 A339 L340 T346 P347I329-L336 HydrophobicContact CD1-CD1 4.26Å; I329-L336 HydrophobicContact CD1-CD2 3.55Å; I329-L336 HydrophobicContact CD1-CG 4.47Å; A332-L336 PolarHBondContact O-N 2.91Å; E333-L336 WeakPolarHBondContact O-CB 3.38Å; E333-L336 PolarHBondContact O-N 3.48Å; E333-L336 VanDerWaalsContact O-N 3.16Å; L336-R338 VanDerWaalsContact C-N 3.3Å; L336-R338 PolarHBondContact O-N 2.81Å; L336-A339 PolarHBondContact O-N 3.35Å; L336-L340 HydrophobicContact CG-CD1 4.12Å; L336-L340 WeakPolarHBondContact O-CG 3.27Å; L336-L340 PolarHBondContact O-N 3.39Å; L336-T346 HydrophobicContact CD1-CG2 3.94Å; L336-P347 HydrophobicContact CB-CG 3.94Å; L336-P347 HydrophobicContact CD1-CG 4.32Å
337F90.9Very high91.5Very high138 Ų13879.3 Ų79.361%0.60540%0.399SS*.Hα-helixtrans-64.3-36.3-179.8-73.6-59.7000112.2E333 L340 K341E333-F337 HydrophobicContact CB-CD2 4.13Å; E333-F337 HydrophobicContact CB-CE2 3.96Å; E333-F337 WeakPolarHBondContact O-CD2 3.48Å; E333-F337 PolarHBondContact O-N 3.43Å; F337-L340 HydrophobicContact CD1-CD1 4.48Å; F337-K341 WeakPolarHBondContact O-CB 3.41Å; F337-K341 PolarHBondContact O-N 3.36Å
338R92.9Very high91.2Very high163 Ų16385.8 Ų85.862%0.61543%0.427SS*.Hα-helixtrans-62.3-48.8172.1-174.8174.163.3-131.60.3111.2K334 A335 L336 L340 K341 T342K334-R338 WeakPolarHBondContact O-CB 3.42Å; K334-R338 PolarHBondContact O-N 3.2Å; K334-R338 VanDerWaalsContact O-N 3.08Å; A335-R338 PolarHBondContact O-N 3.42Å; L336-R338 VanDerWaalsContact C-N 3.3Å; L336-R338 PolarHBondContact O-N 2.81Å; R338-L340 VanDerWaalsContact C-N 3.34Å; R338-L340 PolarHBondContact O-N 2.97Å; R338-K341 PolarHBondContact O-N 2.93Å; R338-T342 WeakPolarHBondContact O-CG2 3.39Å; R338-T342 PolarHBondContact O-N 3.3Å; R338-T342 PolarHBondContact O-OG1 3.5Å; R338-T342 VanDerWaalsContact O-OG1 3.05Å
339A92.1Very high91Very high7 Ų789.2 Ų89.26%0.05844%0.44CS..Hα-helixtrans-61.2-40.9178.700000112.2A335 L336 T342 R343 G344 N345 T346A335-A339 WeakPolarHBondContact O-CB 3.36Å; A335-A339 PolarHBondContact O-N 2.97Å; L336-A339 PolarHBondContact O-N 3.35Å; A339-T342 CarbonylContact O-C 3.42Å; A339-T342 PolarHBondContact O-N 3.48Å; A339-R343 CarbonylContact O-C 3.15Å; A339-R343 VanDerWaalsContact O-CA 3.26Å; A339-R343 WeakPolarHBondContact O-CA 3.49Å; A339-R343 PolarHBondContact O-N 3Å; A339-G344 PolarHBondContact O-N 2.89Å; A339-N345 VanDerWaalsContact CB-O 3.32Å; A339-N345 WeakPolarHBondContact CB-O 3.08Å; A339-T346 HydrophobicContact CB-CG2 4.46Å
340L90.9Very high90.8Very high105 Ų10588 Ų8855%0.5544%0.436SS..Hα-helixtrans-63.3-42.1175.4-72.4170.2000111.7L336 F337 R338 R343L336-L340 HydrophobicContact CG-CD1 4.12Å; L336-L340 WeakPolarHBondContact O-CG 3.27Å; L336-L340 PolarHBondContact O-N 3.39Å; F337-L340 HydrophobicContact CD1-CD1 4.48Å; R338-L340 VanDerWaalsContact C-N 3.34Å; R338-L340 PolarHBondContact O-N 2.97Å; L340-R343 PolarHBondContact O-N 2.9Å
341K94Very high90.8Very high191 Ų19189 Ų8983%0.8344%0.441SS*.Hα-helixtrans-66.4-39.7178.4-171173.7-177.6178.60112.4F337 R338F337-K341 WeakPolarHBondContact O-CB 3.41Å; F337-K341 PolarHBondContact O-N 3.36Å; R338-K341 PolarHBondContact O-N 2.93Å
342T91.9Very high90.9Very high101 Ų10187.2 Ų87.262%0.6242%0.423SS*.THydrogen-bonded Turntrans-91.63.9-179.664.10000113.4R338 A339 G344R338-T342 WeakPolarHBondContact O-CG2 3.39Å; R338-T342 PolarHBondContact O-N 3.3Å; R338-T342 PolarHBondContact O-OG1 3.5Å; R338-T342 VanDerWaalsContact O-OG1 3.05Å; A339-T342 CarbonylContact O-C 3.42Å; A339-T342 PolarHBondContact O-N 3.48Å; T342-G344 PolarHBondContact O-N 3.29Å; T342-G344 VanDerWaalsContact O-N 3.14Å
343R90Very high90.8Very high239 Ų23989.9 Ų89.990%0.90243%0.432SS*.THydrogen-bonded Turntrans4736.8-169.5-62.9-176175-179.4-1.2113.3A339 L340A339-R343 CarbonylContact O-C 3.15Å; A339-R343 VanDerWaalsContact O-CA 3.26Å; A339-R343 WeakPolarHBondContact O-CA 3.49Å; A339-R343 PolarHBondContact O-N 3Å; L340-R343 PolarHBondContact O-N 2.9Å
344G90.3Very high90.8Very high36 Ų3693.3 Ų93.337%0.37145%0.447SS..  trans-92.7-175.3178.300000113.3A339 T342 T346A339-G344 PolarHBondContact O-N 2.89Å; T342-G344 PolarHBondContact O-N 3.29Å; T342-G344 VanDerWaalsContact O-N 3.14Å; G344-T346 PolarHBondContact O-N 3.02Å
345N88.2Confident90.8Very high164 Ų16484.6 Ų84.688%0.87741%0.41SS*.PPolyproline II helixtrans-67.7126.2178.8-70.4-30.5000111.9A339A339-N345 VanDerWaalsContact CB-O 3.32Å; A339-N345 WeakPolarHBondContact CB-O 3.08Å
346T89Confident90.7Very high77 Ų7787.4 Ų87.447%0.47242%0.424SS..PPolyproline II helixtrans-72.6146.5176.155.90000111.8L336 A339 G344L336-T346 HydrophobicContact CD1-CG2 3.94Å; A339-T346 HydrophobicContact CB-CG2 4.46Å; G344-T346 PolarHBondContact O-N 3.02Å
347P91.1Very high90.7Very high30 Ų3086 Ų8620%0.19542%0.417CS..PPolyproline II helixtrans-62.1144.4174.727.3-34.4000111.2A332 A335 L336A332-P347 HydrophobicContact CB-CB 4.13Å; A332-P347 HydrophobicContact CB-CG 4.14Å; A335-P347 HydrophobicContact CB-CG 4.31Å; L336-P347 HydrophobicContact CB-CG 3.94Å; L336-P347 HydrophobicContact CD1-CG 4.32Å
348K88.3Confident90.7Very high137 Ų13779.4 Ų79.460%0.59639%0.388SS*.SBendtrans-97.2-11.7-178.7-64.7-179.2-177.5174.60113.6Q328 S370Q328-K348 PolarHBondContact NE2-O 3.41Å; K348-S370 PolarHBondContact O-OG 3.33Å
349Y90.2Very high90.4Very high96 Ų9674.2 Ų74.238%0.37639%0.385SS..  trans-155.5149-175.944.4-101.2000109.7Q328 F353Q328-Y349 CarbonylContact O-C 3.57Å; Q328-Y349 WeakPolarHBondContact O-CA 3.46Å; Y349-F353 AromaticContact CD1-CD2 3.99Å; Y349-F353 HydrophobicContact CD1-CD2 3.99Å; Y349-F353 HydrophobicContact CD1-CE2 4.44Å; Y349-F353 HydrophobicContact CD2-CB 3.64Å; Y349-F353 HydrophobicContact CD2-CD1 4.47Å; Y349-F353 AromaticContact CD2-CD2 3.31Å; Y349-F353 HydrophobicContact CD2-CD2 3.31Å; Y349-F353 HydrophobicContact CD2-CE2 4.07Å; Y349-F353 AromaticContact CD2-CG 3.55Å; Y349-F353 HydrophobicContact CD2-CG 3.55Å; Y349-F353 HydrophobicContact CE1-CD2 4.08Å; Y349-F353 HydrophobicContact CE1-CE2 4.1Å; Y349-F353 HydrophobicContact CE2-CB 4.36Å; Y349-F353 HydrophobicContact CE2-CD1 4.37Å; Y349-F353 AromaticContact CE2-CD2 3.4Å; Y349-F353 HydrophobicContact CE2-CD2 3.4Å; Y349-F353 VanDerWaalsContact CE2-CD2 3.4Å; Y349-F353 AromaticContact CE2-CE2 3.68Å; Y349-F353 HydrophobicContact CE2-CE2 3.68Å; Y349-F353 AromaticContact CE2-CG 3.79Å; Y349-F353 HydrophobicContact CE2-CG 3.79Å; Y349-F353 HydrophobicContact CE2-CZ 4.28Å; Y349-F353 HydrophobicContact CG-CB 4.13Å; Y349-F353 AromaticContact CG-CD2 3.61Å; Y349-F353 HydrophobicContact CG-CD2 3.61Å; Y349-F353 HydrophobicContact CG-CE2 4.43Å; Y349-F353 HydrophobicContact CG-CG 4.18Å; Y349-F353 AromaticContact CZ-CD2 3.8Å; Y349-F353 AromaticContact CZ-CE2 3.69Å
350G91.1Very high90.3Very high10 Ų1080 Ų8010%0.10341%0.405CS..SBendtrans-118.6-124.9169.200000111.1Q328 L330 I352 F353Q328-G350 PolarHBondContact O-N 3.08Å; L330-G350 CarbonylContact O-C 3.58Å; L330-G350 VanDerWaalsContact O-CA 3.27Å; L330-G350 WeakPolarHBondContact O-CA 3.34Å; G350-I352 PolarHBondContact O-N 3.05Å; G350-F353 WeakPolarHBondContact O-CB 3.4Å; G350-F353 PolarHBondContact O-N 2.97Å
351L92.1Very high90.2Very high25 Ų2575.2 Ų75.213%0.13138%0.381CS..G310 helixtrans-58.6-30.6-177.7-66174.1000113.7R308 L309 H312 L330 F353 H354R308-L351 HydrophobicContact CG-CD1 4.04Å; R308-L351 HydrophobicContact CG-CD2 4.18Å; L309-L351 HydrophobicContact CD2-CB 3.93Å; L309-L351 HydrophobicContact CD2-CD1 4.25Å; H312-L351 HydrophobicContact CB-CD1 3.87Å; L330-L351 WeakPolarHBondContact O-CG 3.32Å; L330-L351 PolarHBondContact O-N 3.09Å; L351-F353 PolarHBondContact O-N 3.3Å; L351-F353 VanDerWaalsContact O-N 3.14Å; L351-H354 PolarHBondContact O-N 3.3Å
352I92.4Very high90Very high0 Ų069 Ų690%037%0.365CS..G310 helixtrans-64.3-17.7178.3-61.8178.2000111.7L309 V327 G350 H354 S355 I358 L373 A374L309-I352 HydrophobicContact CD1-CD1 4.32Å; L309-I352 HydrophobicContact CD1-CG1 4.06Å; L309-I352 HydrophobicContact CD2-CD1 4.5Å; L309-I352 HydrophobicContact CD2-CG1 3.97Å; V327-I352 HydrophobicContact CG1-CD1 3.63Å; V327-I352 WeakPolarHBondContact O-CD1 3.27Å; G350-I352 PolarHBondContact O-N 3.05Å; I352-H354 PolarHBondContact O-N 3.37Å; I352-H354 VanDerWaalsContact O-N 3.14Å; I352-S355 VanDerWaalsContact O-CB 3.23Å; I352-S355 WeakPolarHBondContact O-CB 3.33Å; I352-S355 PolarHBondContact O-N 2.96Å; I352-S355 PolarHBondContact O-OG 3.23Å; I352-I358 HydrophobicContact CG2-CD1 3.8Å; I352-I358 WeakPolarHBondContact O-CD1 3.38Å; I352-L373 HydrophobicContact CG2-CB 4.48Å; I352-L373 HydrophobicContact CG2-CD2 3.42Å; I352-L373 VanDerWaalsContact CG2-CD2 3.42Å; I352-L373 HydrophobicContact CG2-CG 3.87Å; I352-A374 HydrophobicContact CD1-CB 4.14Å
353F91.6Very high89.8Confident71 Ų7168.3 Ų68.331%0.31137%0.369SS..G310 helixtrans-56.2-29.8175.3-174.3-106.5000113.4Y349 G350 L351 S355 I358 K366Y349-F353 AromaticContact CD1-CD2 3.99Å; Y349-F353 HydrophobicContact CD1-CD2 3.99Å; Y349-F353 HydrophobicContact CD1-CE2 4.44Å; Y349-F353 HydrophobicContact CD2-CB 3.64Å; Y349-F353 HydrophobicContact CD2-CD1 4.47Å; Y349-F353 AromaticContact CD2-CD2 3.31Å; Y349-F353 HydrophobicContact CD2-CD2 3.31Å; Y349-F353 HydrophobicContact CD2-CE2 4.07Å; Y349-F353 AromaticContact CD2-CG 3.55Å; Y349-F353 HydrophobicContact CD2-CG 3.55Å; Y349-F353 HydrophobicContact CE1-CD2 4.08Å; Y349-F353 HydrophobicContact CE1-CE2 4.1Å; Y349-F353 HydrophobicContact CE2-CB 4.36Å; Y349-F353 HydrophobicContact CE2-CD1 4.37Å; Y349-F353 AromaticContact CE2-CD2 3.4Å; Y349-F353 HydrophobicContact CE2-CD2 3.4Å; Y349-F353 VanDerWaalsContact CE2-CD2 3.4Å; Y349-F353 AromaticContact CE2-CE2 3.68Å; Y349-F353 HydrophobicContact CE2-CE2 3.68Å; Y349-F353 AromaticContact CE2-CG 3.79Å; Y349-F353 HydrophobicContact CE2-CG 3.79Å; Y349-F353 HydrophobicContact CE2-CZ 4.28Å; Y349-F353 HydrophobicContact CG-CB 4.13Å; Y349-F353 AromaticContact CG-CD2 3.61Å; Y349-F353 HydrophobicContact CG-CD2 3.61Å; Y349-F353 HydrophobicContact CG-CE2 4.43Å; Y349-F353 HydrophobicContact CG-CG 4.18Å; Y349-F353 AromaticContact CZ-CD2 3.8Å; Y349-F353 AromaticContact CZ-CE2 3.69Å; G350-F353 WeakPolarHBondContact O-CB 3.4Å; G350-F353 PolarHBondContact O-N 2.97Å; L351-F353 PolarHBondContact O-N 3.3Å; L351-F353 VanDerWaalsContact O-N 3.14Å; F353-S355 PolarHBondContact O-N 2.91Å; F353-I358 HydrophobicContact CD2-CG2 3.7Å; F353-I358 HydrophobicContact CE2-CG2 4.02Å; F353-K366 HydrophobicContact CE2-CD 4.46Å
354H88.8Confident89.8Confident123 Ų12366.3 Ų66.357%0.56937%0.367SS*.G310 helixtrans-75.80.6177-61.4-67.7000113.9V305 L351 I352V305-H354 HydrophobicContact CG2-CB 4.27Å; L351-H354 PolarHBondContact O-N 3.3Å; I352-H354 PolarHBondContact O-N 3.37Å; I352-H354 VanDerWaalsContact O-N 3.14Å
355S90.4Very high89.8Confident3 Ų366 Ų662%0.02136%0.357CS..SBendtrans-71.2143.817265.10000111.7I352 F353 F357 I358 G359 L373I352-S355 VanDerWaalsContact O-CB 3.23Å; I352-S355 WeakPolarHBondContact O-CB 3.33Å; I352-S355 PolarHBondContact O-N 2.96Å; I352-S355 PolarHBondContact O-OG 3.23Å; F353-S355 PolarHBondContact O-N 2.91Å; S355-F357 PolarHBondContact O-N 2.91Å; S355-I358 PolarHBondContact O-N 3.08Å; S355-I358 WeakPolarHBondContact OG-CG1 3.41Å; S355-G359 PolarHBondContact O-N 2.82Å; S355-L373 VanDerWaalsContact OG-CD2 3.28Å; S355-L373 WeakPolarHBondContact OG-CD2 3.41Å
356T89.3Confident89.9Confident89 Ų8960.8 Ų60.855%0.54633%0.326SS..Hα-helixtrans-61.5-30.2179.257.80000112.6G359 R360T356-G359 PolarHBondContact O-N 3.46Å; T356-R360 WeakPolarHBondContact O-CG 3.39Å; T356-R360 PolarHBondContact O-N 3.32Å; T356-R360 VanDerWaalsContact O-N 3.1Å; T356-R360 PolarHBondContact O-NE 3.38Å
357F89.7Confident90Very high1 Ų157.9 Ų57.90%0.00431%0.312CS..Hα-helixtrans-63.5-41.9177.3-57.9-74.9000112.9L300 S355 R360 A361 L373 R399 V402 E403L300-F357 WeakPolarHBondContact O-CE2 3.35Å; S355-F357 PolarHBondContact O-N 2.91Å; F357-R360 VanDerWaalsContact CD1-NH2 3.26Å; F357-A361 PolarHBondContact O-N 3.42Å; F357-L373 HydrophobicContact CB-CD2 4.42Å; F357-L373 HydrophobicContact CD2-CD2 4.39Å; F357-R399 HydrophobicContact CE1-CG 4.4Å; F357-R399 HydrophobicContact CZ-CG 3.7Å; F357-V402 HydrophobicContact CB-CG1 4.12Å; F357-V402 HydrophobicContact CD1-CG1 3.66Å; F357-V402 HydrophobicContact CD2-CG1 4.34Å; F357-V402 HydrophobicContact CE1-CG1 4.2Å; F357-V402 HydrophobicContact CG-CG1 3.75Å; F357-E403 HydrophobicContact CD1-CG 4.37Å; F357-E403 HydrophobicContact CE1-CG 3.6Å
358I89.6Confident90Very high0 Ų063.3 Ų63.30%033%0.329CS..Hα-helixtrans-76.2-31.9179.4-62.4-178.1000110.9I352 F353 S355 A361 K366 I369 L373I352-I358 HydrophobicContact CG2-CD1 3.8Å; I352-I358 WeakPolarHBondContact O-CD1 3.38Å; F353-I358 HydrophobicContact CD2-CG2 3.7Å; F353-I358 HydrophobicContact CE2-CG2 4.02Å; S355-I358 PolarHBondContact O-N 3.08Å; S355-I358 WeakPolarHBondContact OG-CG1 3.41Å; I358-A361 PolarHBondContact O-N 3.48Å; I358-K366 HydrophobicContact CG2-CB 4.36Å; I358-K366 HydrophobicContact CG2-CD 4.36Å; I358-K366 HydrophobicContact CG2-CG 4.28Å; I358-K366 WeakPolarHBondContact O-CE 3.3Å; I358-I369 HydrophobicContact CG1-CG2 4.35Å; I358-L373 HydrophobicContact CD1-CD2 4.32Å; I358-L373 HydrophobicContact CG1-CD2 4.3Å
359G88.4Confident90.2Very high53 Ų5357 Ų5755%0.54630%0.301SS..Hα-helixtrans-58.5-46.7172.300000112.7S355 T356S355-G359 PolarHBondContact O-N 2.82Å; T356-G359 PolarHBondContact O-N 3.46Å
360R88.6Confident90.4Very high130 Ų13052.4 Ų52.449%0.49128%0.283SS..Hα-helixtrans-70.3-30.3179.7-71-176-74.6174.5-2.3114T356 F357 L406T356-R360 WeakPolarHBondContact O-CG 3.39Å; T356-R360 PolarHBondContact O-N 3.32Å; T356-R360 VanDerWaalsContact O-N 3.1Å; T356-R360 PolarHBondContact O-NE 3.38Å; F357-R360 VanDerWaalsContact CD1-NH2 3.26Å; R360-L406 HydrophobicContact CB-CD2 4.14Å
361A90Very high90.6Very high4 Ų458.8 Ų58.83%0.03330%0.304CS..SBendtrans-65.4140.4-176.300000114.4F357 I358 K366 I369 L406F357-A361 PolarHBondContact O-N 3.42Å; I358-A361 PolarHBondContact O-N 3.48Å; A361-K366 HydrophobicContact CB-CG 4.05Å; A361-K366 WeakPolarHBondContact O-CE 3.43Å; A361-K366 WeakPolarHBondContact O-CG 3.42Å; A361-I369 HydrophobicContact CB-CD1 3.38Å; A361-L406 HydrophobicContact CB-CD1 3.99Å
362A89.9Confident90.6Very high60 Ų6060.2 Ų60.250%0.49631%0.308SS..  trans-57.8143.4170.600000112.3K364 N365 K366A362-K364 PolarHBondContact O-N 3.49Å; A362-N365 WeakPolarHBondContact O-CA 3.33Å; A362-N365 PolarHBondContact O-N 2.87Å; A362-K366 PolarHBondContact O-N 2.95Å
363A87.6Confident90.7Very high86 Ų8660.2 Ų60.271%0.71131%0.308SS*.THydrogen-bonded Turntrans-52.6-37.3-172.600000114.4N365A363-N365 VanDerWaalsContact C-N 3.31Å; A363-N365 PolarHBondContact O-N 3.16Å
364K89.4Confident90.9Very high197 Ų19756.9 Ų56.986%0.85729%0.293SS*.THydrogen-bonded Turntrans-65.5-34176.8-64.6-178.3-179177.40112.4A362A362-K364 PolarHBondContact O-N 3.49Å
365N90.1Very high91.3Very high31 Ų3154.5 Ų54.517%0.16629%0.285CS..THydrogen-bonded Turntrans-95.2-14.2-174-65.9-27.4000113.6A362 A363 G367 R368 I369A362-N365 WeakPolarHBondContact O-CA 3.33Å; A362-N365 PolarHBondContact O-N 2.87Å; A363-N365 VanDerWaalsContact C-N 3.31Å; A363-N365 PolarHBondContact O-N 3.16Å; N365-G367 VanDerWaalsContact C-N 3.27Å; N365-G367 PolarHBondContact O-N 3.39Å; N365-G367 VanDerWaalsContact O-N 3.16Å; N365-R368 WeakPolarHBondContact O-CB 3.34Å; N365-R368 PolarHBondContact O-N 3.2Å; N365-I369 HydrophobicContact CB-CD1 4.24Å; N365-I369 PolarHBondContact O-N 2.63Å
366K91.3Very high91.5Very high53 Ų5354.8 Ų54.823%0.2329%0.286CS..Hα-helixtrans-49.5-43.6179-73.2-170.9178.8-169.60113.5F353 I358 A361 A362 S370F353-K366 HydrophobicContact CE2-CD 4.46Å; I358-K366 HydrophobicContact CG2-CB 4.36Å; I358-K366 HydrophobicContact CG2-CD 4.36Å; I358-K366 HydrophobicContact CG2-CG 4.28Å; I358-K366 WeakPolarHBondContact O-CE 3.3Å; A361-K366 HydrophobicContact CB-CG 4.05Å; A361-K366 WeakPolarHBondContact O-CE 3.43Å; A361-K366 WeakPolarHBondContact O-CG 3.42Å; A362-K366 PolarHBondContact O-N 2.95Å; K366-S370 WeakPolarHBondContact O-CB 3.36Å; K366-S370 PolarHBondContact O-N 3.48Å
367G90.7Very high91.8Very high16 Ų1650.6 Ų50.617%0.16526%0.26CS..Hα-helixtrans-68.3-33.6178.300000114N365 R371N365-G367 VanDerWaalsContact C-N 3.27Å; N365-G367 PolarHBondContact O-N 3.39Å; N365-G367 VanDerWaalsContact O-N 3.16Å; G367-R371 PolarHBondContact O-N 2.8Å
368R91Very high92Very high145 Ų14550.7 Ų50.755%0.54726%0.261SS..Hα-helixtrans-72.6-42.7178-64.7-179.9176.4-176.3-2.6110.8N365 R371 Y372N365-R368 WeakPolarHBondContact O-CB 3.34Å; N365-R368 PolarHBondContact O-N 3.2Å; R368-R371 PolarHBondContact O-N 3.46Å; R368-Y372 PolarHBondContact O-N 2.83Å; R368-Y372 VanDerWaalsContact O-N 3.16Å
369I93Very high92.2Very high4 Ų453.4 Ų53.42%0.02128%0.275CS..Hα-helixtrans-69.1-41.5177.6-69.5163.5000110.7I358 A361 N365 R371 Y372 L373 L406 Y409I358-I369 HydrophobicContact CG1-CG2 4.35Å; A361-I369 HydrophobicContact CB-CD1 3.38Å; N365-I369 HydrophobicContact CB-CD1 4.24Å; N365-I369 PolarHBondContact O-N 2.63Å; I369-R371 VanDerWaalsContact C-N 3.3Å; I369-R371 PolarHBondContact O-N 3.28Å; I369-Y372 PolarHBondContact O-N 2.96Å; I369-Y372 VanDerWaalsContact O-N 3.08Å; I369-L373 WeakPolarHBondContact O-CB 3.43Å; I369-L373 PolarHBondContact O-N 3.42Å; I369-L406 HydrophobicContact CD1-CD1 3.54Å; I369-Y409 HydrophobicContact CD1-CD2 3.82Å; I369-Y409 HydrophobicContact CD1-CE2 4.16Å; I369-Y409 HydrophobicContact CG1-CD2 3.85Å; I369-Y409 HydrophobicContact CG1-CE2 3.66Å
370S94Very high92.5Very high0 Ų050.9 Ų50.90%025%0.249CC..Hα-helixtrans-52.9-46.3174.1179.90000112.3K348 K366 L373 A374K348-S370 PolarHBondContact O-OG 3.33Å; K366-S370 WeakPolarHBondContact O-CB 3.36Å; K366-S370 PolarHBondContact O-N 3.48Å; S370-L373 PolarHBondContact O-N 2.79Å; S370-A374 WeakPolarHBondContact O-CB 3.4Å; S370-A374 PolarHBondContact O-N 2.95Å
371R93.9Very high92.8Very high143 Ų14344.8 Ų44.854%0.5423%0.226SC..Hα-helixtrans-63.4-44.4175.8-172.9-173.4-61.9137.3-2.4112.4G367 R368 I369 A374 N375G367-R371 PolarHBondContact O-N 2.8Å; R368-R371 PolarHBondContact O-N 3.46Å; I369-R371 VanDerWaalsContact C-N 3.3Å; I369-R371 PolarHBondContact O-N 3.28Å; R371-A374 PolarHBondContact O-N 3.32Å; R371-N375 PolarHBondContact O-N 3.37Å; R371-N375 VanDerWaalsContact O-N 3.1Å
372Y93.8Very high93Very high56 Ų5650 Ų5022%0.2225%0.245CC..Hα-helixtrans-63.8-45.1179.3-172-99.6000111.4R368 I369 N375 K376 V402 R405R368-Y372 PolarHBondContact O-N 2.83Å; R368-Y372 VanDerWaalsContact O-N 3.16Å; I369-Y372 PolarHBondContact O-N 2.96Å; I369-Y372 VanDerWaalsContact O-N 3.08Å; Y372-N375 WeakPolarHBondContact O-CB 3.41Å; Y372-N375 PolarHBondContact O-N 2.92Å; Y372-K376 HydrophobicContact CD1-CG 4.3Å; Y372-K376 HydrophobicContact CE1-CD 4.47Å; Y372-K376 HydrophobicContact CE1-CG 4.03Å; Y372-K376 WeakPolarHBondContact O-CG 3.41Å; Y372-K376 PolarHBondContact O-N 2.86Å; Y372-K376 VanDerWaalsContact O-N 3.13Å; Y372-K376 WeakPolarHBondContact OH-CE 3.45Å; Y372-V402 HydrophobicContact CD1-CG2 4.04Å; Y372-V402 HydrophobicContact CE1-CG2 3.91Å; Y372-R405 HydrophobicContact CD1-CB 4.14Å; Y372-R405 HydrophobicContact CD1-CG 4.05Å; Y372-R405 HydrophobicContact CD2-CG 4.43Å; Y372-R405 HydrophobicContact CE1-CB 3.89Å; Y372-R405 HydrophobicContact CE1-CG 4.13Å; Y372-R405 HydrophobicContact CE2-CG 4.49Å; Y372-R405 HydrophobicContact CG-CG 4.21Å
373L94.7Very high93Very high0 Ų049.2 Ų49.20%023%0.232CC..Hα-helixtrans-62.9-44.9177.1-176.956.5000111.2L300 I301 I352 S355 F357 I358 I369 S370 N375 K376 C377 V402L300-L373 HydrophobicContact CD1-CD1 4.32Å; L300-L373 HydrophobicContact CD2-CD1 4.31Å; L300-L373 HydrophobicContact CG-CD1 4.16Å; I301-L373 HydrophobicContact CG2-CD1 3.79Å; I301-L373 HydrophobicContact CG2-CD2 4.17Å; I301-L373 HydrophobicContact CG2-CG 4.18Å; I352-L373 HydrophobicContact CG2-CB 4.48Å; I352-L373 HydrophobicContact CG2-CD2 3.42Å; I352-L373 VanDerWaalsContact CG2-CD2 3.42Å; I352-L373 HydrophobicContact CG2-CG 3.87Å; S355-L373 VanDerWaalsContact OG-CD2 3.28Å; S355-L373 WeakPolarHBondContact OG-CD2 3.41Å; F357-L373 HydrophobicContact CB-CD2 4.42Å; F357-L373 HydrophobicContact CD2-CD2 4.39Å; I358-L373 HydrophobicContact CD1-CD2 4.32Å; I358-L373 HydrophobicContact CG1-CD2 4.3Å; I369-L373 WeakPolarHBondContact O-CB 3.43Å; I369-L373 PolarHBondContact O-N 3.42Å; S370-L373 PolarHBondContact O-N 2.79Å; L373-N375 VanDerWaalsContact C-N 3.3Å; L373-N375 PolarHBondContact O-N 3.07Å; L373-K376 PolarHBondContact O-N 3.41Å; L373-C377 PolarHBondContact O-N 3.09Å; L373-C377 PolarHBondContact O-SG 3.2Å; L373-V402 HydrophobicContact CD1-CG1 4.36Å; L373-V402 HydrophobicContact CD1-CG2 4.1Å
374A95.8Very high93.2Very high0 Ų045.3 Ų45.30%020%0.199CC..Hα-helixtrans-58.5-41176.200000112.4A324 V327 Q328 I352 S370 R371 K376 C377 T378A324-A374 WeakPolarHBondContact O-CB 3.17Å; V327-A374 HydrophobicContact CG1-CB 4.37Å; Q328-A374 HydrophobicContact CB-CB 3.75Å; Q328-A374 HydrophobicContact CG-CB 4.42Å; I352-A374 HydrophobicContact CD1-CB 4.14Å; S370-A374 WeakPolarHBondContact O-CB 3.4Å; S370-A374 PolarHBondContact O-N 2.95Å; R371-A374 PolarHBondContact O-N 3.32Å; A374-K376 VanDerWaalsContact C-N 3.34Å; A374-K376 PolarHBondContact O-N 3.17Å; A374-C377 PolarHBondContact O-N 3.46Å; A374-T378 PolarHBondContact O-N 2.94Å; A374-T378 PolarHBondContact O-OG1 3.47Å; A374-T378 VanDerWaalsContact O-OG1 3.13Å
375N95.4Very high93.2Very high73 Ų7336 Ų3639%0.3916%0.159SC..Hα-helixtrans-59.4-44.4173.8-70.5-21.7000111.8A324 R371 Y372 L373 T378 I379A324-N375 HydrophobicContact CB-CB 4.4Å; A324-N375 WeakPolarHBondContact CB-OD1 3.28Å; R371-N375 PolarHBondContact O-N 3.37Å; R371-N375 VanDerWaalsContact O-N 3.1Å; Y372-N375 WeakPolarHBondContact O-CB 3.41Å; Y372-N375 PolarHBondContact O-N 2.92Å; L373-N375 VanDerWaalsContact C-N 3.3Å; L373-N375 PolarHBondContact O-N 3.07Å; N375-T378 PolarHBondContact O-N 3.01Å; N375-I379 WeakPolarHBondContact O-CG1 3.42Å; N375-I379 PolarHBondContact O-N 2.93Å; N375-I379 VanDerWaalsContact O-N 3.15Å
376K95.1Very high93.2Very high10 Ų1040.9 Ų40.94%0.04318%0.179CC..Hα-helixtrans-68.8-39.9179.7-62.8-71.3171.5-179.30111.7L300 Y372 L373 A374 I379 A380 L398 V402 N418L300-K376 HydrophobicContact CD2-CB 3.85Å; Y372-K376 HydrophobicContact CD1-CG 4.3Å; Y372-K376 HydrophobicContact CE1-CD 4.47Å; Y372-K376 HydrophobicContact CE1-CG 4.03Å; Y372-K376 WeakPolarHBondContact O-CG 3.41Å; Y372-K376 PolarHBondContact O-N 2.86Å; Y372-K376 VanDerWaalsContact O-N 3.13Å; Y372-K376 WeakPolarHBondContact OH-CE 3.45Å; L373-K376 PolarHBondContact O-N 3.41Å; A374-K376 VanDerWaalsContact C-N 3.34Å; A374-K376 PolarHBondContact O-N 3.17Å; K376-I379 PolarHBondContact O-N 2.98Å; K376-A380 WeakPolarHBondContact O-CB 3.23Å; K376-A380 PolarHBondContact O-N 3.15Å; K376-L398 HydrophobicContact CD-CD2 3.44Å; K376-L398 VanDerWaalsContact CD-CD2 3.44Å; K376-V402 HydrophobicContact CB-CG2 4.39Å; K376-V402 HydrophobicContact CG-CG2 4.06Å; K376-N418 PolarHBondContact NZ-OD1 2.95Å
377C95Very high92.9Very high0 Ų040.3 Ų40.30%018%0.182CC..Hα-helixtrans-59.8-47.3173.2-66.80000111.5L297 L300 I301 V327 L373 A374 I379 A380 S381L297-C377 HydrophobicContact CD1-CB 4.16Å; L300-C377 HydrophobicContact CD2-CB 4.39Å; I301-C377 VanDerWaalsContact CG2-SG 3.52Å; V327-C377 HydrophobicContact CG1-CB 4.38Å; L373-C377 PolarHBondContact O-N 3.09Å; L373-C377 PolarHBondContact O-SG 3.2Å; A374-C377 PolarHBondContact O-N 3.46Å; C377-I379 VanDerWaalsContact C-N 3.29Å; C377-I379 PolarHBondContact O-N 3.44Å; C377-A380 PolarHBondContact O-N 3.18Å; C377-S381 WeakPolarHBondContact O-CB 3.47Å; C377-S381 PolarHBondContact O-N 2.96Å; C377-S381 PolarHBondContact O-OG 3.38Å
378T95.4Very high92.3Very high4 Ų447.3 Ų47.33%0.02521%0.21CC..Hα-helixtrans-61.1-38.4177.8-60.90000112Y322 A324 A374 N375 R382Y322-T378 WeakPolarHBondContact O-CG2 3.48Å; A324-T378 WeakPolarHBondContact CA-OG1 3.37Å; A374-T378 PolarHBondContact O-N 2.94Å; A374-T378 PolarHBondContact O-OG1 3.47Å; A374-T378 VanDerWaalsContact O-OG1 3.13Å; N375-T378 PolarHBondContact O-N 3.01Å; T378-R382 VanDerWaalsContact O-CG 3.24Å; T378-R382 WeakPolarHBondContact O-CG 3.48Å; T378-R382 PolarHBondContact O-N 3.25Å; T378-R382 VanDerWaalsContact O-N 3.13Å
379I93.9Very high91.8Very high56 Ų5642.3 Ų42.329%0.28719%0.194SC..Hα-helixtrans-65.3-49.2175-66.2165000110.3N375 K376 C377 S381 R382 I383 L398 M422N375-I379 WeakPolarHBondContact O-CG1 3.42Å; N375-I379 PolarHBondContact O-N 2.93Å; N375-I379 VanDerWaalsContact O-N 3.15Å; K376-I379 PolarHBondContact O-N 2.98Å; C377-I379 VanDerWaalsContact C-N 3.29Å; C377-I379 PolarHBondContact O-N 3.44Å; I379-S381 PolarHBondContact O-N 3.31Å; I379-R382 PolarHBondContact O-N 2.97Å; I379-I383 HydrophobicContact CG2-CD1 3.88Å; I379-I383 WeakPolarHBondContact O-CG1 3.13Å; I379-I383 PolarHBondContact O-N 3.47Å; I379-L398 HydrophobicContact CG2-CD1 4.48Å; I379-M422 HydrophobicContact CG2-CE 3.85Å
380A94.4Very high91.2Very high0 Ų044.5 Ų44.50%021%0.208CC..Hα-helixtrans-58.2-46.817800000111.9N296 L300 K376 C377 R382 I383 D384 L398N296-A380 HydrophobicContact CB-CB 4.06Å; L300-A380 HydrophobicContact CD2-CB 4.34Å; K376-A380 WeakPolarHBondContact O-CB 3.23Å; K376-A380 PolarHBondContact O-N 3.15Å; C377-A380 PolarHBondContact O-N 3.18Å; A380-R382 VanDerWaalsContact C-N 3.28Å; A380-R382 PolarHBondContact O-N 2.88Å; A380-I383 PolarHBondContact O-N 3.21Å; A380-D384 PolarHBondContact O-N 3.14Å; A380-L398 HydrophobicContact CB-CD1 3.97Å
381S93.8Very high90.9Very high2 Ų245.3 Ų45.31%0.01421%0.213CC..Hα-helixtrans-61.8-34177.6-56.50000112.9C377 I379 C385C377-S381 WeakPolarHBondContact O-CB 3.47Å; C377-S381 PolarHBondContact O-N 2.96Å; C377-S381 PolarHBondContact O-OG 3.38Å; I379-S381 PolarHBondContact O-N 3.31Å; S381-C385 WeakPolarHBondContact O-CB 3.46Å; S381-C385 PolarHBondContact O-N 2.77Å
382R94.1Very high90.7Very high114 Ų11441 Ų4143%0.4321%0.205SC..Hα-helixtrans-70.2-41.6175.2-74.4170.3-177.5179.73.5111.8A320 T378 I379 A380 C385 F386A320-R382 HydrophobicContact CB-CG 3.99Å; A320-R382 WeakPolarHBondContact O-CG 3.26Å; A320-R382 PolarHBondContact O-NE 2.78Å; T378-R382 VanDerWaalsContact O-CG 3.24Å; T378-R382 WeakPolarHBondContact O-CG 3.48Å; T378-R382 PolarHBondContact O-N 3.25Å; T378-R382 VanDerWaalsContact O-N 3.13Å; I379-R382 PolarHBondContact O-N 2.97Å; A380-R382 VanDerWaalsContact C-N 3.28Å; A380-R382 PolarHBondContact O-N 2.88Å; R382-C385 PolarHBondContact O-N 3.45Å; R382-F386 HydrophobicContact CB-CD2 4.49Å; R382-F386 WeakPolarHBondContact O-CB 3.19Å; R382-F386 WeakPolarHBondContact O-CD2 3.27Å; R382-F386 PolarHBondContact O-N 3.16Å
383I91.8Very high90.5Very high43 Ų4339.2 Ų39.222%0.22120%0.2CC..Hα-helixtrans-62.8-48.7175.9-65167.9000109.6I379 A380 C385 F386 S387 F394I379-I383 HydrophobicContact CG2-CD1 3.88Å; I379-I383 WeakPolarHBondContact O-CG1 3.13Å; I379-I383 PolarHBondContact O-N 3.47Å; A380-I383 PolarHBondContact O-N 3.21Å; I383-C385 VanDerWaalsContact C-N 3.32Å; I383-C385 PolarHBondContact O-N 3.38Å; I383-F386 PolarHBondContact O-N 2.8Å; I383-S387 WeakPolarHBondContact O-CB 3.41Å; I383-S387 PolarHBondContact O-N 3.35Å; I383-F394 HydrophobicContact CD1-CB 4.09Å; I383-F394 HydrophobicContact CD1-CD1 4.32Å; I383-F394 HydrophobicContact CD1-CG 4.1Å; I383-F394 HydrophobicContact CG2-CD2 3.87Å; I383-F394 HydrophobicContact CG2-CE2 4.36Å; I383-F394 HydrophobicContact CG2-CG 4.38Å
384D91.4Very high90.4Very high5 Ų540.8 Ų40.83%0.02721%0.207CC..Hα-helixtrans-60.7-40.1177.7-73.9-24.4000112.3A294 N296 L297 L316 A380A294-D384 WeakPolarHBondContact CA-OD2 3.31Å; A294-D384 HydrophobicContact CB-CB 4.14Å; N296-D384 VanDerWaalsContact CB-OD1 3.27Å; N296-D384 WeakPolarHBondContact CB-OD1 3.44Å; N296-D384 WeakPolarHBondContact CB-OD2 3.12Å; N296-D384 PolarHBondContact N-OD1 2.82Å; N296-D384 PolarHBondContact N-OD2 3.06Å; N296-D384 PolarHBondContact ND2-OD1 2.95Å; L297-D384 PolarHBondContact N-OD2 3.45Å; L316-D384 HydrophobicContact CD2-CB 4.41Å; A380-D384 PolarHBondContact O-N 3.14Å
385C89.6Confident90.2Very high1 Ų140.8 Ų40.81%0.00721%0.207CC..Hα-helixtrans-76.2-34.4-177.8-172.70000113.9R164 L316 A320 S381 R382 I383R164-C385 PolarHBondContact NH1-O 2.94Å; R164-C385 PolarHBondContact NH2-O 2.89Å; L316-C385 HydrophobicContact CD2-CB 4.36Å; L316-C385 HydrophobicContact CG-CB 4.11Å; A320-C385 HydrophobicContact CB-CB 3.8Å; S381-C385 WeakPolarHBondContact O-CB 3.46Å; S381-C385 PolarHBondContact O-N 2.77Å; R382-C385 PolarHBondContact O-N 3.45Å; I383-C385 VanDerWaalsContact C-N 3.32Å; I383-C385 PolarHBondContact O-N 3.38Å
386F88.4Confident90.1Very high133 Ų13340.5 Ų40.558%0.58321%0.205SC*.Hα-helixtrans-107.4-9.8-172.6-65.9-68.3000114A320 R382 I383A320-F386 HydrophobicContact CB-CE2 4.13Å; R382-F386 HydrophobicContact CB-CD2 4.49Å; R382-F386 WeakPolarHBondContact O-CB 3.19Å; R382-F386 WeakPolarHBondContact O-CD2 3.27Å; R382-F386 PolarHBondContact O-N 3.16Å; I383-F386 PolarHBondContact O-N 2.8Å
387S86.1Confident90Very high42 Ų4241 Ų4129%0.29421%0.207SC..  trans-70.2145170.6-168.90000111.4R164 I383 L389R164-S387 PolarHBondContact NH2-O 3.2Å; I383-S387 WeakPolarHBondContact O-CB 3.41Å; I383-S387 PolarHBondContact O-N 3.35Å; S387-L389 PolarHBondContact OG-N 3.32Å; S387-L389 PolarHBondContact OG-O 2.88Å
388E78.7Confident89.9Confident163 Ų16341 Ų4176%0.76221%0.208SC*.SBendtrans-77.3-35.7170.1-63.6-173.4161.900111.4
389L80.3Confident89.8Confident40 Ų4044.9 Ų44.921%0.20922%0.222CC..SBendtrans-123104.3177.1-68175.4000108.6S387 T391 A433 K437S387-L389 PolarHBondContact OG-N 3.32Å; S387-L389 PolarHBondContact OG-O 2.88Å; L389-T391 PolarHBondContact O-N 3.47Å; L389-A433 HydrophobicContact CD1-CB 4.49Å; L389-K437 HydrophobicContact CD1-CD 4.16Å; L389-K437 VanDerWaalsContact CD1-CE 3.42Å; L389-K437 HydrophobicContact CD1-CG 3.7Å
390P80.6Confident89.8Confident49 Ų4945.3 Ų45.332%0.31822%0.223SC..  trans-75.2128177.131.7-33.7000109.7P295P295-P390 HydrophobicContact CG-CB 3.68Å; P295-P390 HydrophobicContact CG-CG 4.5Å
391T87.3Confident89.7Confident17 Ų1745.4 Ų45.410%0.10422%0.223CC..  trans-121.7150.4176.855.20000109.1N296 L389 V432N296-T391 PolarHBondContact ND2-O 3.11Å; N296-T391 PolarHBondContact OD1-O 2.82Å; L389-T391 PolarHBondContact O-N 3.47Å; T391-V432 HydrophobicContact CG2-CG1 4.15Å
392S88.8Confident89.6Confident54 Ų5445.4 Ų45.438%0.37822%0.223SC..SBendtrans-78-17.4179.165.10000114.8N296 F394 G395 D396N296-S392 PolarHBondContact OD1-O 2.9Å; S392-F394 VanDerWaalsContact C-N 3.28Å; S392-F394 PolarHBondContact O-N 3.27Å; S392-F394 VanDerWaalsContact O-N 3.15Å; S392-G395 WeakPolarHBondContact O-CA 3.42Å; S392-G395 PolarHBondContact O-N 3.42Å; S392-D396 PolarHBondContact O-N 3.05Å; S392-D396 PolarHBondContact OG-OD2 3.09Å
393V90.9Very high89.5Confident17 Ų1743.5 Ų43.510%0.10322%0.219CC..Hα-helixtrans-50.2-44-172.3178.90000112.9G395 D396 K397 E428 A429 V432V393-G395 PolarHBondContact O-N 3.28Å; V393-D396 PolarHBondContact O-N 3.01Å; V393-K397 WeakPolarHBondContact O-CG 3.44Å; V393-K397 PolarHBondContact O-N 3.04Å; V393-K397 VanDerWaalsContact O-N 3.11Å; V393-E428 HydrophobicContact CG1-CB 3.7Å; V393-E428 WeakPolarHBondContact CG1-OE2 3.28Å; V393-A429 HydrophobicContact CB-CB 4.49Å; V393-V432 HydrophobicContact CG2-CG2 4.14Å
394F91.2Very high89.5Confident33 Ų3343.1 Ų43.115%0.14522%0.216CC..Hα-helixtrans-66.3-40.2179-65.2-75000111.3N296 I383 S392 L398 M422 A425 V426 A429N296-F394 WeakPolarHBondContact OD1-CB 3.23Å; N296-F394 PolarHBondContact OD1-N 3.47Å; I383-F394 HydrophobicContact CD1-CB 4.09Å; I383-F394 HydrophobicContact CD1-CD1 4.32Å; I383-F394 HydrophobicContact CD1-CG 4.1Å; I383-F394 HydrophobicContact CG2-CD2 3.87Å; I383-F394 HydrophobicContact CG2-CE2 4.36Å; I383-F394 HydrophobicContact CG2-CG 4.38Å; S392-F394 VanDerWaalsContact C-N 3.28Å; S392-F394 PolarHBondContact O-N 3.27Å; S392-F394 VanDerWaalsContact O-N 3.15Å; F394-L398 VanDerWaalsContact O-CB 3.28Å; F394-L398 WeakPolarHBondContact O-CB 3.38Å; F394-L398 WeakPolarHBondContact O-CD1 3.33Å; F394-L398 WeakPolarHBondContact O-CG 3.43Å; F394-L398 PolarHBondContact O-N 3.46Å; F394-M422 HydrophobicContact CD1-SD 4.48Å; F394-A425 HydrophobicContact CD1-CB 3.6Å; F394-A425 HydrophobicContact CE1-CB 3.74Å; F394-V426 HydrophobicContact CE1-CG2 3.94Å; F394-V426 HydrophobicContact CZ-CG2 4.15Å; F394-A429 HydrophobicContact CD2-CB 4.26Å; F394-A429 HydrophobicContact CE1-CB 4.49Å; F394-A429 HydrophobicContact CE2-CB 3.44Å; F394-A429 VanDerWaalsContact CE2-CB 3.44Å; F394-A429 HydrophobicContact CZ-CB 3.58Å
395G92.1Very high89.4Confident0 Ų046 Ų460%023%0.227CC..Hα-helixtrans-61.6-43.4176.600000112.3N296 S392 V393 L398 R399N296-G395 PolarHBondContact OD1-N 2.84Å; S392-G395 WeakPolarHBondContact O-CA 3.42Å; S392-G395 PolarHBondContact O-N 3.42Å; V393-G395 PolarHBondContact O-N 3.28Å; G395-L398 PolarHBondContact O-N 3.44Å; G395-R399 WeakPolarHBondContact O-CB 3.46Å; G395-R399 PolarHBondContact O-N 3.02Å
396D93.3Very high89.4Confident68 Ų6846.7 Ų46.736%0.36423%0.23SC..Hα-helixtrans-63.6-48.1178.6-62.4-39.4000111.2S392 V393 L398 R399 E400S392-D396 PolarHBondContact O-N 3.05Å; S392-D396 PolarHBondContact OG-OD2 3.09Å; V393-D396 PolarHBondContact O-N 3.01Å; D396-L398 PolarHBondContact O-N 2.93Å; D396-R399 VanDerWaalsContact O-CB 3.28Å; D396-R399 WeakPolarHBondContact O-CB 3.3Å; D396-R399 PolarHBondContact O-N 3.42Å; D396-R399 VanDerWaalsContact O-N 3.13Å; D396-E400 PolarHBondContact O-N 2.86Å
397K92.7Very high89.5Confident20 Ų2042.1 Ų42.19%0.08722%0.215CC..Hα-helixtrans-65.9-35.7176-63-68.8-175.1179.80112.7V393 R399 Q401 V421 E424 A425 E428V393-K397 WeakPolarHBondContact O-CG 3.44Å; V393-K397 PolarHBondContact O-N 3.04Å; V393-K397 VanDerWaalsContact O-N 3.11Å; K397-R399 VanDerWaalsContact C-N 3.3Å; K397-Q401 WeakPolarHBondContact O-CG 3.37Å; K397-Q401 PolarHBondContact O-N 2.99Å; K397-Q401 VanDerWaalsContact O-N 3.16Å; K397-V421 HydrophobicContact CB-CG1 3.79Å; K397-V421 HydrophobicContact CD-CG1 4.45Å; K397-V421 HydrophobicContact CG-CG1 4.46Å; K397-E424 IonicContact NZ-OE1 3.46Å; K397-E424 PolarHBondContact NZ-OE1 2.98Å; K397-A425 HydrophobicContact CB-CB 4.35Å; K397-A425 HydrophobicContact CG-CB 4.04Å; K397-E428 WeakPolarHBondContact CE-OE1 3.5Å; K397-E428 WeakPolarHBondContact CE-OE2 3.25Å; K397-E428 IonicContact NZ-OE1 3.51Å; K397-E428 PolarHBondContact NZ-OE1 3.28Å; K397-E428 IonicContact NZ-OE2 2.93Å; K397-E428 PolarHBondContact NZ-OE2 3.31Å
398L93.4Very high89.7Confident1 Ų143 Ų431%0.00521%0.213CC..Hα-helixtrans-67.4-33.7174.1-71168.5000111.4L300 K376 I379 A380 F394 G395 D396 Q401 V402 M422L300-L398 HydrophobicContact CD1-CB 4.05Å; K376-L398 HydrophobicContact CD-CD2 3.44Å; K376-L398 VanDerWaalsContact CD-CD2 3.44Å; I379-L398 HydrophobicContact CG2-CD1 4.48Å; A380-L398 HydrophobicContact CB-CD1 3.97Å; F394-L398 VanDerWaalsContact O-CB 3.28Å; F394-L398 WeakPolarHBondContact O-CB 3.38Å; F394-L398 WeakPolarHBondContact O-CD1 3.33Å; F394-L398 WeakPolarHBondContact O-CG 3.43Å; F394-L398 PolarHBondContact O-N 3.46Å; G395-L398 PolarHBondContact O-N 3.44Å; D396-L398 PolarHBondContact O-N 2.93Å; L398-Q401 PolarHBondContact O-N 3.44Å; L398-V402 WeakPolarHBondContact O-CG2 3.45Å; L398-V402 PolarHBondContact O-N 3.34Å; L398-M422 HydrophobicContact CD2-CE 3.82Å
399R93.3Very high90.1Very high84 Ų8437.8 Ų37.832%0.31719%0.187SC..Hα-helixtrans-66.2-48.5175-171.2-165.7175.7108-6.6111A299 L300 F357 G395 D396 K397 Q401 V402 E403A299-R399 PolarHBondContact O-NH1 3.31Å; L300-R399 HydrophobicContact CD1-CB 4.19Å; F357-R399 HydrophobicContact CE1-CG 4.4Å; F357-R399 HydrophobicContact CZ-CG 3.7Å; G395-R399 WeakPolarHBondContact O-CB 3.46Å; G395-R399 PolarHBondContact O-N 3.02Å; D396-R399 VanDerWaalsContact O-CB 3.28Å; D396-R399 WeakPolarHBondContact O-CB 3.3Å; D396-R399 PolarHBondContact O-N 3.42Å; D396-R399 VanDerWaalsContact O-N 3.13Å; K397-R399 VanDerWaalsContact C-N 3.3Å; R399-Q401 PolarHBondContact O-N 2.99Å; R399-V402 WeakPolarHBondContact O-CB 3.41Å; R399-V402 PolarHBondContact O-N 3.38Å; R399-E403 IonicContact NE-OE1 3.66Å; R399-E403 PolarHBondContact NE-OE1 3.31Å; R399-E403 IonicContact NH2-OE1 3.35Å; R399-E403 PolarHBondContact O-N 3.38Å
400E93.1Very high90.4Very high66 Ų6642.4 Ų42.431%0.30821%0.208SC..Hα-helixtrans-52.4-44.9173.8-72.4176.9-157.400111.2D396 V402 E403 E404 R416D396-E400 PolarHBondContact O-N 2.86Å; E400-V402 VanDerWaalsContact C-N 3.31Å; E400-V402 PolarHBondContact O-N 3.08Å; E400-E403 WeakPolarHBondContact O-CB 3.5Å; E400-E403 PolarHBondContact O-N 3.31Å; E400-E403 VanDerWaalsContact O-N 3.1Å; E400-E404 WeakPolarHBondContact O-CG 3.44Å; E400-E404 PolarHBondContact O-N 2.91Å; E400-R416 IonicContact OE2-CZ 2.69Å; E400-R416 IonicContact OE2-NH2 3.99Å; E400-R416 PolarHBondContact OE2-NH2 3.29Å
401Q92.4Very high90.7Very high1 Ų144.4 Ų44.41%0.00522%0.219CC..Hα-helixtrans-63.5-33.3177.7-72.9178.3-22.500113.9K397 L398 R399 R405 N418 V421K397-Q401 WeakPolarHBondContact O-CG 3.37Å; K397-Q401 PolarHBondContact O-N 2.99Å; K397-Q401 VanDerWaalsContact O-N 3.16Å; L398-Q401 PolarHBondContact O-N 3.44Å; R399-Q401 PolarHBondContact O-N 2.99Å; Q401-R405 VanDerWaalsContact O-CB 3.3Å; Q401-R405 WeakPolarHBondContact O-CB 3.44Å; Q401-R405 PolarHBondContact O-N 3.5Å; Q401-N418 PolarHBondContact NE2-OD1 3.3Å; Q401-N418 VanDerWaalsContact NE2-OD1 3.14Å; Q401-N418 PolarHBondContact OE1-OD1 3.31Å; Q401-V421 HydrophobicContact CG-CG1 4.1Å; Q401-V421 HydrophobicContact CG-CG2 4.32Å
402V92.5Very high90.7Very high3 Ų345.8 Ų45.82%0.01824%0.237CC..Hα-helixtrans-71.3-36.8174.4175.80000110.3L300 F357 Y372 L373 K376 L398 R399 E400 R405 L406L300-V402 HydrophobicContact CD1-CG2 4.1Å; F357-V402 HydrophobicContact CB-CG1 4.12Å; F357-V402 HydrophobicContact CD1-CG1 3.66Å; F357-V402 HydrophobicContact CD2-CG1 4.34Å; F357-V402 HydrophobicContact CE1-CG1 4.2Å; F357-V402 HydrophobicContact CG-CG1 3.75Å; Y372-V402 HydrophobicContact CD1-CG2 4.04Å; Y372-V402 HydrophobicContact CE1-CG2 3.91Å; L373-V402 HydrophobicContact CD1-CG1 4.36Å; L373-V402 HydrophobicContact CD1-CG2 4.1Å; K376-V402 HydrophobicContact CB-CG2 4.39Å; K376-V402 HydrophobicContact CG-CG2 4.06Å; L398-V402 WeakPolarHBondContact O-CG2 3.45Å; L398-V402 PolarHBondContact O-N 3.34Å; R399-V402 WeakPolarHBondContact O-CB 3.41Å; R399-V402 PolarHBondContact O-N 3.38Å; E400-V402 VanDerWaalsContact C-N 3.31Å; E400-V402 PolarHBondContact O-N 3.08Å; V402-R405 PolarHBondContact O-N 3.28Å; V402-L406 PolarHBondContact O-N 3.18Å
403E91.8Very high90.5Very high73 Ų7349.8 Ų49.834%0.34125%0.249SC..Hα-helixtrans-66.4-47.1175.6-69.3-178.9172.100111.9F357 R399 E400 R405 L406 S407F357-E403 HydrophobicContact CD1-CG 4.37Å; F357-E403 HydrophobicContact CE1-CG 3.6Å; R399-E403 IonicContact NE-OE1 3.66Å; R399-E403 PolarHBondContact NE-OE1 3.31Å; R399-E403 IonicContact NH2-OE1 3.35Å; R399-E403 PolarHBondContact O-N 3.38Å; E400-E403 WeakPolarHBondContact O-CB 3.5Å; E400-E403 PolarHBondContact O-N 3.31Å; E400-E403 VanDerWaalsContact O-N 3.1Å; E403-R405 PolarHBondContact O-N 2.9Å; E403-L406 WeakPolarHBondContact O-CA 3.48Å; E403-L406 WeakPolarHBondContact O-CB 3.42Å; E403-L406 PolarHBondContact O-N 3.04Å; E403-S407 PolarHBondContact O-N 3.06Å
404E91.8Very high90.3Very high35 Ų3555.1 Ų55.116%0.16428%0.282CS..Hα-helixtrans-58.8-35.8172.1-71.5175.2-160.200112.1E400 L406 S407 F408 P415 R416E400-E404 WeakPolarHBondContact O-CG 3.44Å; E400-E404 PolarHBondContact O-N 2.91Å; E404-L406 VanDerWaalsContact C-N 3.33Å; E404-S407 WeakPolarHBondContact CA-OG 3.47Å; E404-S407 PolarHBondContact O-OG 3.04Å; E404-F408 WeakPolarHBondContact O-CB 3.41Å; E404-F408 PolarHBondContact O-N 3.4Å; E404-P415 HydrophobicContact CB-CB 3.9Å; E404-R416 IonicContact OE1-CZ 2.9Å; E404-R416 IonicContact OE1-NE 2.68Å; E404-R416 PolarHBondContact OE1-NE 3.25Å; E404-R416 IonicContact OE1-NH2 3.11Å; E404-R416 PolarHBondContact OE1-NH2 3.45Å; E404-R416 PolarHBondContact OE2-N 2.66Å; E404-R416 IonicContact OE2-NE 3.67Å
405R90Very high90.1Very high67 Ų6754.9 Ų54.925%0.25328%0.284SS..Hα-helixtrans-72.7-30.6177.7-16760.8176.1178.44.5111.9Y372 Q401 V402 E403 Y409Y372-R405 HydrophobicContact CD1-CB 4.14Å; Y372-R405 HydrophobicContact CD1-CG 4.05Å; Y372-R405 HydrophobicContact CD2-CG 4.43Å; Y372-R405 HydrophobicContact CE1-CB 3.89Å; Y372-R405 HydrophobicContact CE1-CG 4.13Å; Y372-R405 HydrophobicContact CE2-CG 4.49Å; Y372-R405 HydrophobicContact CG-CG 4.21Å; Q401-R405 VanDerWaalsContact O-CB 3.3Å; Q401-R405 WeakPolarHBondContact O-CB 3.44Å; Q401-R405 PolarHBondContact O-N 3.5Å; V402-R405 PolarHBondContact O-N 3.28Å; E403-R405 PolarHBondContact O-N 2.9Å; R405-Y409 HydrophobicContact CG-CE2 4.07Å; R405-Y409 PolarHBondContact NH2-OH 3.49Å; R405-Y409 WeakPolarHBondContact O-CD2 3.44Å
406L89.6Confident89.8Confident15 Ų1560.3 Ų60.38%0.07930%0.304CS..Hα-helixtrans-69.3-48.5173.4-175.768.3000109.9R360 A361 I369 V402 E403 E404 F408 Y409 E410R360-L406 HydrophobicContact CB-CD2 4.14Å; A361-L406 HydrophobicContact CB-CD1 3.99Å; I369-L406 HydrophobicContact CD1-CD1 3.54Å; V402-L406 PolarHBondContact O-N 3.18Å; E403-L406 WeakPolarHBondContact O-CA 3.48Å; E403-L406 WeakPolarHBondContact O-CB 3.42Å; E403-L406 PolarHBondContact O-N 3.04Å; E404-L406 VanDerWaalsContact C-N 3.33Å; L406-F408 VanDerWaalsContact C-N 3.33Å; L406-F408 PolarHBondContact O-N 2.88Å; L406-Y409 PolarHBondContact O-N 3.48Å; L406-E410 PolarHBondContact O-N 3.33Å
407S89.3Confident89.5Confident37 Ų3764.5 Ų64.526%0.25932%0.319SS..Hα-helixtrans-61.1-40177.266.50000111.7E403 E404 Y409 E410 T411E403-S407 PolarHBondContact O-N 3.06Å; E404-S407 WeakPolarHBondContact CA-OG 3.47Å; E404-S407 PolarHBondContact O-OG 3.04Å; S407-Y409 PolarHBondContact O-N 2.91Å; S407-Y409 VanDerWaalsContact O-N 3.11Å; S407-E410 CarbonylContact O-C 3.57Å; S407-E410 WeakPolarHBondContact O-CA 3.4Å; S407-E410 PolarHBondContact O-N 3.27Å; S407-T411 PolarHBondContact O-N 3.06Å; S407-T411 PolarHBondContact O-OG1 3.04Å
408F91.4Very high89.1Confident60 Ų6066.6 Ų66.626%0.26333%0.331SS..Hα-helixtrans-52.7-36.4173.3171.2-108.4000113.3E404 L406 E410 G412 E413E404-F408 WeakPolarHBondContact O-CB 3.41Å; E404-F408 PolarHBondContact O-N 3.4Å; L406-F408 VanDerWaalsContact C-N 3.33Å; L406-F408 PolarHBondContact O-N 2.88Å; F408-E410 VanDerWaalsContact C-N 3.29Å; F408-G412 WeakPolarHBondContact O-CA 3.34Å; F408-G412 PolarHBondContact O-N 3.35Å; F408-E413 WeakPolarHBondContact CB-O 3.23Å; F408-E413 WeakPolarHBondContact CD2-O 3.44Å
409Y87.4Confident88.8Confident54 Ų5472.8 Ų72.821%0.21236%0.362CS..Hα-helixtrans-78.1-14.1178.2-69.4-53.8000113.8I369 R405 L406 S407I369-Y409 HydrophobicContact CD1-CD2 3.82Å; I369-Y409 HydrophobicContact CD1-CE2 4.16Å; I369-Y409 HydrophobicContact CG1-CD2 3.85Å; I369-Y409 HydrophobicContact CG1-CE2 3.66Å; R405-Y409 HydrophobicContact CG-CE2 4.07Å; R405-Y409 PolarHBondContact NH2-OH 3.49Å; R405-Y409 WeakPolarHBondContact O-CD2 3.44Å; L406-Y409 PolarHBondContact O-N 3.48Å; S407-Y409 PolarHBondContact O-N 2.91Å; S407-Y409 VanDerWaalsContact O-N 3.11Å
410E86.2Confident88.5Confident137 Ų13773 Ų7364%0.6437%0.369SS*.Hα-helixtrans-98.7-49.8177.8-66.1176.4175.500111.5L406 S407 F408L406-E410 PolarHBondContact O-N 3.33Å; S407-E410 CarbonylContact O-C 3.57Å; S407-E410 WeakPolarHBondContact O-CA 3.4Å; S407-E410 PolarHBondContact O-N 3.27Å; F408-E410 VanDerWaalsContact C-N 3.29Å
411T87.2Confident88.1Confident91 Ų9169.9 Ų69.956%0.55835%0.354SS*.Hα-helixtrans-103.9-20.9-172.564.60000113.9S407S407-T411 PolarHBondContact O-N 3.06Å; S407-T411 PolarHBondContact O-OG1 3.04Å
412G85.6Confident87.9Confident46 Ų4671.6 Ų71.647%0.47436%0.363SS..  trans84.71.7-176.900000115.4F408 V414F408-G412 WeakPolarHBondContact O-CA 3.34Å; F408-G412 PolarHBondContact O-N 3.35Å; G412-V414 PolarHBondContact O-N 3.11Å
413E86.1Confident87.6Confident137 Ų13777.5 Ų77.564%0.6439%0.389SS*.PPolyproline II helixtrans-68.6126.4-179.9-70.2-177.7162.300112.8F408 P415F408-E413 WeakPolarHBondContact CB-O 3.23Å; F408-E413 WeakPolarHBondContact CD2-O 3.44Å; E413-P415 WeakPolarHBondContact O-CD 3.47Å
414V85.4Confident87.4Confident130 Ų13077.5 Ų77.579%0.78839%0.388SS*.PPolyproline II helixtrans-68.7121.9-174.4-177.70000110.3G412G412-V414 PolarHBondContact O-N 3.11Å
415P87.4Confident87.1Confident28 Ų2875.8 Ų75.818%0.18238%0.381CS..PPolyproline II helixtrans-70.3157.4-178.428.6-34.7000111.8E404 E413E404-P415 HydrophobicContact CB-CB 3.9Å; E413-P415 WeakPolarHBondContact O-CD 3.47Å
416R86.8Confident87Confident113 Ų11376.3 Ų76.343%0.42639%0.391SS..PPolyproline II helixtrans-61.9148.9179.8-68.8-176.8-76.9173.2-2.8111.2E400 E404 V421E400-R416 IonicContact OE2-CZ 2.69Å; E400-R416 IonicContact OE2-NH2 3.99Å; E400-R416 PolarHBondContact OE2-NH2 3.29Å; E404-R416 IonicContact OE1-CZ 2.9Å; E404-R416 IonicContact OE1-NE 2.68Å; E404-R416 PolarHBondContact OE1-NE 3.25Å; E404-R416 IonicContact OE1-NH2 3.11Å; E404-R416 PolarHBondContact OE1-NH2 3.45Å; E404-R416 PolarHBondContact OE2-N 2.66Å; E404-R416 IonicContact OE2-NE 3.67Å; R416-V421 HydrophobicContact CB-CG2 3.9Å
417K86.3Confident86.9Confident156 Ų15682.4 Ų82.468%0.67842%0.417SS*.PPolyproline II helixtrans-68.2136.8176.1-71.9-178.3-177.5175.20109.9M419 D420 V421K417-M419 PolarHBondContact O-N 3.48Å; K417-M419 VanDerWaalsContact O-N 3.16Å; K417-D420 PolarHBondContact O-N 3.03Å; K417-V421 PolarHBondContact O-N 2.81Å
418N84Confident86.7Confident65 Ų6584 Ų8435%0.34842%0.42SS..Hα-helixtrans-58.8-32.8-178.2-174.871.9000113.4K376 Q401 D420 M422K376-N418 PolarHBondContact NZ-OD1 2.95Å; Q401-N418 PolarHBondContact NE2-OD1 3.3Å; Q401-N418 VanDerWaalsContact NE2-OD1 3.14Å; Q401-N418 PolarHBondContact OE1-OD1 3.31Å; N418-D420 VanDerWaalsContact C-N 3.32Å; N418-D420 PolarHBondContact O-N 3.24Å; N418-M422 WeakPolarHBondContact O-CB 3.29Å; N418-M422 WeakPolarHBondContact O-CG 3.45Å; N418-M422 PolarHBondContact O-N 3.17Å
419M86.9Confident86.3Confident131 Ų13181.5 Ų81.565%0.64541%0.411SS*.Hα-helixtrans-63.4-38.4-179.2-69.5-174.960.300112.8K417 K423K417-M419 PolarHBondContact O-N 3.48Å; K417-M419 VanDerWaalsContact O-N 3.16Å; M419-K423 VanDerWaalsContact O-CG 3.32Å; M419-K423 WeakPolarHBondContact O-CG 3.43Å; M419-K423 PolarHBondContact O-N 3.34Å; M419-K423 VanDerWaalsContact O-N 3.09Å
420D87.6Confident86.1Confident87 Ų8782.8 Ų82.847%0.46542%0.424SS..Hα-helixtrans-76.3-44.7-173.9-57.6-39.2000110.1K417 N418 M422 K423 E424K417-D420 PolarHBondContact O-N 3.03Å; N418-D420 VanDerWaalsContact C-N 3.32Å; N418-D420 PolarHBondContact O-N 3.24Å; D420-M422 VanDerWaalsContact C-N 3.3Å; D420-M422 PolarHBondContact O-N 3.26Å; D420-K423 PolarHBondContact O-N 2.81Å; D420-E424 PolarHBondContact O-N 3.17Å; D420-E424 VanDerWaalsContact O-N 3.07Å
421V85.6Confident86Confident1 Ų181.5 Ų81.51%0.00642%0.422CS..Hα-helixtrans-60.6-39.3174.1-179.80000111.7K397 Q401 R416 K417 E424 A425K397-V421 HydrophobicContact CB-CG1 3.79Å; K397-V421 HydrophobicContact CD-CG1 4.45Å; K397-V421 HydrophobicContact CG-CG1 4.46Å; Q401-V421 HydrophobicContact CG-CG1 4.1Å; Q401-V421 HydrophobicContact CG-CG2 4.32Å; R416-V421 HydrophobicContact CB-CG2 3.9Å; K417-V421 PolarHBondContact O-N 2.81Å; V421-E424 PolarHBondContact O-N 3.12Å; V421-A425 WeakPolarHBondContact O-CB 3.13Å; V421-A425 PolarHBondContact O-N 3.27Å
422M87.1Confident85.7Confident38 Ų3879.8 Ų79.819%0.18741%0.411CS..Hα-helixtrans-71.1-33.6178-71.6-61-141.600112.7I379 F394 L398 N418 D420 E424 A425 V426I379-M422 HydrophobicContact CG2-CE 3.85Å; F394-M422 HydrophobicContact CD1-SD 4.48Å; L398-M422 HydrophobicContact CD2-CE 3.82Å; N418-M422 WeakPolarHBondContact O-CB 3.29Å; N418-M422 WeakPolarHBondContact O-CG 3.45Å; N418-M422 PolarHBondContact O-N 3.17Å; D420-M422 VanDerWaalsContact C-N 3.3Å; D420-M422 PolarHBondContact O-N 3.26Å; M422-E424 VanDerWaalsContact C-N 3.34Å; M422-A425 PolarHBondContact O-N 2.82Å; M422-V426 VanDerWaalsContact O-CG2 3.27Å; M422-V426 WeakPolarHBondContact O-CG2 3.43Å; M422-V426 PolarHBondContact O-N 3.37Å
423K87.1Confident85.4Confident127 Ų12778.6 Ų78.655%0.55240%0.397SS*.Hα-helixtrans-64.7-41173.5-77.1172.2-178.9176.30111.6M419 D420 K427M419-K423 VanDerWaalsContact O-CG 3.32Å; M419-K423 WeakPolarHBondContact O-CG 3.43Å; M419-K423 PolarHBondContact O-N 3.34Å; M419-K423 VanDerWaalsContact O-N 3.09Å; D420-K423 PolarHBondContact O-N 2.81Å; K423-K427 WeakPolarHBondContact O-CG 3.3Å; K423-K427 PolarHBondContact O-N 3.33Å
424E87.3Confident85.1Confident72 Ų7274.2 Ų74.234%0.33638%0.384SS..Hα-helixtrans-63.2-48.2174.3-170.9-176.4152.400110.9K397 D420 V421 M422 V426 K427 E428K397-E424 IonicContact NZ-OE1 3.46Å; K397-E424 PolarHBondContact NZ-OE1 2.98Å; D420-E424 PolarHBondContact O-N 3.17Å; D420-E424 VanDerWaalsContact O-N 3.07Å; V421-E424 PolarHBondContact O-N 3.12Å; M422-E424 VanDerWaalsContact C-N 3.34Å; E424-V426 VanDerWaalsContact C-N 3.31Å; E424-V426 PolarHBondContact O-N 3.01Å; E424-K427 PolarHBondContact O-N 3.34Å; E424-K427 VanDerWaalsContact O-N 3.11Å; E424-E428 PolarHBondContact O-N 3.32Å
425A85.6Confident85Confident0 Ų072.9 Ų72.90%037%0.369CS..Hα-helixtrans-59.2-38.617800000112.8F394 K397 V421 M422 A429F394-A425 HydrophobicContact CD1-CB 3.6Å; F394-A425 HydrophobicContact CE1-CB 3.74Å; K397-A425 HydrophobicContact CB-CB 4.35Å; K397-A425 HydrophobicContact CG-CB 4.04Å; V421-A425 WeakPolarHBondContact O-CB 3.13Å; V421-A425 PolarHBondContact O-N 3.27Å; M422-A425 PolarHBondContact O-N 2.82Å; A425-A429 WeakPolarHBondContact O-CB 3.5Å; A425-A429 PolarHBondContact O-N 3.49Å
426V87.6Confident84.6Confident78 Ų7875.7 Ų75.747%0.47338%0.381SS..Hα-helixtrans-64.1-42.5176.5169.60000111.3F394 M422 E424 A429 T430F394-V426 HydrophobicContact CE1-CG2 3.94Å; F394-V426 HydrophobicContact CZ-CG2 4.15Å; M422-V426 VanDerWaalsContact O-CG2 3.27Å; M422-V426 WeakPolarHBondContact O-CG2 3.43Å; M422-V426 PolarHBondContact O-N 3.37Å; E424-V426 VanDerWaalsContact C-N 3.31Å; E424-V426 PolarHBondContact O-N 3.01Å; V426-A429 PolarHBondContact O-N 3.49Å; V426-T430 WeakPolarHBondContact O-CG2 3.34Å; V426-T430 PolarHBondContact O-N 2.86Å; V426-T430 PolarHBondContact O-OG1 3.28Å; V426-T430 VanDerWaalsContact O-OG1 3.11Å
427K86.7Confident84.2Confident143 Ų14375.2 Ų75.262%0.62238%0.382SS*.Hα-helixtrans-62.7-52.2178-70177.6179.5-176.50111.1K423 E424 A429 T430 D431K423-K427 WeakPolarHBondContact O-CG 3.3Å; K423-K427 PolarHBondContact O-N 3.33Å; E424-K427 PolarHBondContact O-N 3.34Å; E424-K427 VanDerWaalsContact O-N 3.11Å; K427-A429 VanDerWaalsContact C-N 3.32Å; K427-A429 PolarHBondContact O-N 3.01Å; K427-T430 PolarHBondContact O-N 3.28Å; K427-T430 PolarHBondContact O-OG1 2.76Å; K427-D431 PolarHBondContact O-N 3.49Å; K427-D431 VanDerWaalsContact O-N 3.12Å
428E86.5Confident84.1Confident70 Ų7076.2 Ų76.233%0.32738%0.381SS..Hα-helixtrans-60.3-42.1178-70.7177.6-174.800111.6V393 K397 E424 T430 D431 V432V393-E428 HydrophobicContact CG1-CB 3.7Å; V393-E428 WeakPolarHBondContact CG1-OE2 3.28Å; K397-E428 WeakPolarHBondContact CE-OE1 3.5Å; K397-E428 WeakPolarHBondContact CE-OE2 3.25Å; K397-E428 IonicContact NZ-OE1 3.51Å; K397-E428 PolarHBondContact NZ-OE1 3.28Å; K397-E428 IonicContact NZ-OE2 2.93Å; K397-E428 PolarHBondContact NZ-OE2 3.31Å; E424-E428 PolarHBondContact O-N 3.32Å; E428-T430 PolarHBondContact O-N 3.43Å; E428-D431 PolarHBondContact O-N 2.87Å; E428-V432 VanDerWaalsContact O-CG2 3.32Å; E428-V432 WeakPolarHBondContact O-CG2 3.38Å; E428-V432 PolarHBondContact O-N 3.25Å
429A82.8Confident84Confident8 Ų878.1 Ų78.17%0.06639%0.387CS..Hα-helixtrans-65.1-36.7177.600000112.5V393 F394 A425 V426 K427 A433V393-A429 HydrophobicContact CB-CB 4.49Å; F394-A429 HydrophobicContact CD2-CB 4.26Å; F394-A429 HydrophobicContact CE1-CB 4.49Å; F394-A429 HydrophobicContact CE2-CB 3.44Å; F394-A429 VanDerWaalsContact CE2-CB 3.44Å; F394-A429 HydrophobicContact CZ-CB 3.58Å; A425-A429 WeakPolarHBondContact O-CB 3.5Å; A425-A429 PolarHBondContact O-N 3.49Å; V426-A429 PolarHBondContact O-N 3.49Å; K427-A429 VanDerWaalsContact C-N 3.32Å; K427-A429 PolarHBondContact O-N 3.01Å; A429-A433 WeakPolarHBondContact O-CB 3.29Å; A429-A433 PolarHBondContact O-N 2.92Å
430T83.3Confident83.6Confident80 Ų8076.7 Ų76.749%0.49138%0.378SS..Hα-helixtrans-66.2-38.4175.447.60000112.4V426 K427 E428 A433 A434V426-T430 WeakPolarHBondContact O-CG2 3.34Å; V426-T430 PolarHBondContact O-N 2.86Å; V426-T430 PolarHBondContact O-OG1 3.28Å; V426-T430 VanDerWaalsContact O-OG1 3.11Å; K427-T430 PolarHBondContact O-N 3.28Å; K427-T430 PolarHBondContact O-OG1 2.76Å; E428-T430 PolarHBondContact O-N 3.43Å; T430-A433 PolarHBondContact O-N 2.87Å; T430-A434 WeakPolarHBondContact O-CB 3.36Å; T430-A434 PolarHBondContact O-N 3.35Å
431D83.9Confident83.2Confident110 Ų11077.7 Ų77.759%0.58838%0.38SS*.Hα-helixtrans-67.8-46.6178.5-66.4-26.8000110.9K427 E428 A433 A434 E435K427-D431 PolarHBondContact O-N 3.49Å; K427-D431 VanDerWaalsContact O-N 3.12Å; E428-D431 PolarHBondContact O-N 2.87Å; D431-A433 PolarHBondContact O-N 3.11Å; D431-A434 PolarHBondContact O-N 3.31Å; D431-E435 PolarHBondContact O-N 3.14Å
432V81.3Confident83.1Confident55 Ų5585 Ų8533%0.33341%0.412SS..Hα-helixtrans-63.5-41.6175.8174.40000111.1T391 V393 E428 A434 E435 M436T391-V432 HydrophobicContact CG2-CG1 4.15Å; V393-V432 HydrophobicContact CG2-CG2 4.14Å; E428-V432 VanDerWaalsContact O-CG2 3.32Å; E428-V432 WeakPolarHBondContact O-CG2 3.38Å; E428-V432 PolarHBondContact O-N 3.25Å; V432-A434 VanDerWaalsContact C-N 3.34Å; V432-A434 PolarHBondContact O-N 2.82Å; V432-E435 PolarHBondContact O-N 3.42Å; V432-M436 HydrophobicContact CG1-CG 4.36Å; V432-M436 WeakPolarHBondContact O-CB 3.06Å; V432-M436 VanDerWaalsContact O-CG 3.26Å; V432-M436 WeakPolarHBondContact O-CG 3.29Å; V432-M436 PolarHBondContact O-N 2.86Å
433A78.6Confident82.8Confident22 Ų2290.9 Ų90.918%0.18244%0.437CS..Hα-helixtrans-64.2-38.9176.800000111.9L389 A429 T430 D431 M436 K437L389-A433 HydrophobicContact CD1-CB 4.49Å; A429-A433 WeakPolarHBondContact O-CB 3.29Å; A429-A433 PolarHBondContact O-N 2.92Å; T430-A433 PolarHBondContact O-N 2.87Å; D431-A433 PolarHBondContact O-N 3.11Å; A433-M436 PolarHBondContact O-N 3.19Å; A433-K437 WeakPolarHBondContact O-CB 3.36Å; A433-K437 WeakPolarHBondContact O-CG 3.12Å; A433-K437 PolarHBondContact O-N 3.39Å
434A80.4Confident82.5Confident45 Ų4589.3 Ų89.337%0.37243%0.431SS..Hα-helixtrans-65.6-40.7175.400000111.8T430 D431 V432 K437 R438T430-A434 WeakPolarHBondContact O-CB 3.36Å; T430-A434 PolarHBondContact O-N 3.35Å; D431-A434 PolarHBondContact O-N 3.31Å; V432-A434 VanDerWaalsContact C-N 3.34Å; V432-A434 PolarHBondContact O-N 2.82Å; A434-K437 PolarHBondContact O-N 3.17Å; A434-R438 VanDerWaalsContact O-CG 3.32Å; A434-R438 WeakPolarHBondContact O-CG 3.28Å; A434-R438 PolarHBondContact O-N 3.3Å
435E83Confident82.2Confident102 Ų10293 Ų9348%0.47745%0.446SS..Hα-helixtrans-65.5-42.5175.4-159.2-167.3153.300111.8D431 V432 R438 K439D431-E435 PolarHBondContact O-N 3.14Å; V432-E435 PolarHBondContact O-N 3.42Å; E435-R438 PolarHBondContact O-N 3.44Å; E435-K439 WeakPolarHBondContact O-CG 3.36Å; E435-K439 PolarHBondContact O-N 3.39Å; E435-K439 WeakPolarHBondContact OE1-CE 3.48Å; E435-K439 IonicContact OE1-NZ 2.81Å; E435-K439 PolarHBondContact OE1-NZ 2.69Å
436M78.3Confident82.1Confident87 Ų87101 Ų10143%0.42948%0.481SS..Hα-helixtrans-62.6-43.8176.3-75.5-70-79.600112V432 A433 K439 Q440V432-M436 HydrophobicContact CG1-CG 4.36Å; V432-M436 WeakPolarHBondContact O-CB 3.06Å; V432-M436 VanDerWaalsContact O-CG 3.26Å; V432-M436 WeakPolarHBondContact O-CG 3.29Å; V432-M436 PolarHBondContact O-N 2.86Å; A433-M436 PolarHBondContact O-N 3.19Å; M436-K439 PolarHBondContact O-N 2.95Å; M436-Q440 WeakPolarHBondContact O-CG 3.2Å; M436-Q440 PolarHBondContact O-N 3.33Å
437K79.7Confident81.9Confident103 Ų103105 Ų10545%0.44849%0.487SS..Hα-helixtrans-59.8-46.4173.6-76.6-176.2178.9-174.20111.6L389 A433 A434 K439 Q440 E441L389-K437 HydrophobicContact CD1-CD 4.16Å; L389-K437 VanDerWaalsContact CD1-CE 3.42Å; L389-K437 HydrophobicContact CD1-CG 3.7Å; A433-K437 WeakPolarHBondContact O-CB 3.36Å; A433-K437 WeakPolarHBondContact O-CG 3.12Å; A433-K437 PolarHBondContact O-N 3.39Å; A434-K437 PolarHBondContact O-N 3.17Å; K437-K439 VanDerWaalsContact C-N 3.32Å; K437-K439 PolarHBondContact O-N 3.21Å; K437-Q440 PolarHBondContact O-N 2.94Å; K437-E441 WeakPolarHBondContact O-CG 3.37Å; K437-E441 PolarHBondContact O-N 3.21Å
438R82.9Confident81.6Confident176 Ų176103.8 Ų103.866%0.66448%0.482SS*.Hα-helixtrans-59.6-40175.6-73.6173.7177.1-176.71.3112.4A434 E435 K442A434-R438 VanDerWaalsContact O-CG 3.32Å; A434-R438 WeakPolarHBondContact O-CG 3.28Å; A434-R438 PolarHBondContact O-N 3.3Å; E435-R438 PolarHBondContact O-N 3.44Å; R438-K442 WeakPolarHBondContact O-CB 3.34Å; R438-K442 VanDerWaalsContact O-CG 3.31Å; R438-K442 WeakPolarHBondContact O-CG 3.44Å; R438-K442 PolarHBondContact O-N 3.2Å; R438-K442 VanDerWaalsContact O-N 3.08Å
439K81.4Confident81.4Confident106 Ų106107.3 Ų107.346%0.46150%0.496SS..Hα-helixtrans-67.2-42176.3-76177.1-176.8166.40111.7E435 M436 K437 K442 K443E435-K439 WeakPolarHBondContact O-CG 3.36Å; E435-K439 PolarHBondContact O-N 3.39Å; E435-K439 WeakPolarHBondContact OE1-CE 3.48Å; E435-K439 IonicContact OE1-NZ 2.81Å; E435-K439 PolarHBondContact OE1-NZ 2.69Å; M436-K439 PolarHBondContact O-N 2.95Å; K437-K439 VanDerWaalsContact C-N 3.32Å; K437-K439 PolarHBondContact O-N 3.21Å; K439-K442 PolarHBondContact O-N 2.95Å; K439-K443 WeakPolarHBondContact O-CG 3.41Å; K439-K443 PolarHBondContact O-N 3.28Å
440Q78.2Confident81.3Confident100 Ų100116.2 Ų116.247%0.46753%0.528SS..Hα-helixtrans-64.1-46.5176.7-74.3178-7.500111.6M436 K437 K442 K443 E444M436-Q440 WeakPolarHBondContact O-CG 3.2Å; M436-Q440 PolarHBondContact O-N 3.33Å; K437-Q440 PolarHBondContact O-N 2.94Å; Q440-K442 VanDerWaalsContact C-N 3.34Å; Q440-K442 PolarHBondContact O-N 3.17Å; Q440-K443 PolarHBondContact O-N 3.26Å; Q440-K443 VanDerWaalsContact O-N 3.15Å; Q440-E444 WeakPolarHBondContact O-CB 3.26Å; Q440-E444 PolarHBondContact O-N 3.2Å
441E80.4Confident81.1Confident108 Ų108116.2 Ų116.251%0.50552%0.523SS..Hα-helixtrans-60.9-40176.3-73175.4-172.600112.5K437 E444 K445K437-E441 WeakPolarHBondContact O-CG 3.37Å; K437-E441 PolarHBondContact O-N 3.21Å; E441-E444 PolarHBondContact O-N 3.5Å; E441-K445 WeakPolarHBondContact O-CB 3.2Å; E441-K445 VanDerWaalsContact O-CG 3.32Å; E441-K445 WeakPolarHBondContact O-CG 3.49Å; E441-K445 PolarHBondContact O-N 2.92Å
442K83.4Confident81Confident155 Ų155117.3 Ų117.367%0.67452%0.522SS*.Hα-helixtrans-63.7-43.3174.2-77.8178.7-179.1-177.30111.8R438 K439 Q440 K446R438-K442 WeakPolarHBondContact O-CB 3.34Å; R438-K442 VanDerWaalsContact O-CG 3.31Å; R438-K442 WeakPolarHBondContact O-CG 3.44Å; R438-K442 PolarHBondContact O-N 3.2Å; R438-K442 VanDerWaalsContact O-N 3.08Å; K439-K442 PolarHBondContact O-N 2.95Å; Q440-K442 VanDerWaalsContact C-N 3.34Å; Q440-K442 PolarHBondContact O-N 3.17Å; K442-K446 WeakPolarHBondContact O-CB 3.46Å; K442-K446 PolarHBondContact O-N 3.4Å
443K80.4Confident80.8Confident162 Ų162120.5 Ų120.570%0.70453%0.532SS*.Hα-helixtrans-63.7-42.9176.4-78.1-175.4177.1-174.10111.4K439 Q440 K446 R447K439-K443 WeakPolarHBondContact O-CG 3.41Å; K439-K443 PolarHBondContact O-N 3.28Å; Q440-K443 PolarHBondContact O-N 3.26Å; Q440-K443 VanDerWaalsContact O-N 3.15Å; K443-K446 PolarHBondContact O-N 2.87Å; K443-R447 PolarHBondContact O-N 3.33Å
444E80.5Confident80.5Confident94 Ų94125.8 Ų125.844%0.43955%0.553SS.*Hα-helixtrans-66.5-43.6179.1-161.6-169.2148.200111.9Q440 E441 K446 R447 K448Q440-E444 WeakPolarHBondContact O-CB 3.26Å; Q440-E444 PolarHBondContact O-N 3.2Å; E441-E444 PolarHBondContact O-N 3.5Å; E444-K446 VanDerWaalsContact C-N 3.3Å; E444-K446 PolarHBondContact O-N 3.36Å; E444-R447 PolarHBondContact O-N 3.09Å; E444-K448 HydrophobicContact CG-CD 4.49Å; E444-K448 PolarHBondContact O-N 3.34Å; E444-K448 WeakPolarHBondContact OE1-CE 3.37Å; E444-K448 IonicContact OE1-NZ 3.89Å; E444-K448 PolarHBondContact OE1-NZ 3.45Å
445K82.4Confident80.1Confident150 Ų150129.9 Ų129.965%0.65256%0.564SS**Hα-helixtrans-59.4-40.5172.4-75.9176.8-179.4176.80111.9E441 K449E441-K445 WeakPolarHBondContact O-CB 3.2Å; E441-K445 VanDerWaalsContact O-CG 3.32Å; E441-K445 WeakPolarHBondContact O-CG 3.49Å; E441-K445 PolarHBondContact O-N 2.92Å; K445-K449 WeakPolarHBondContact O-CB 3.38Å; K445-K449 PolarHBondContact O-N 3.27Å
446K82.9Confident79.7Confident167 Ų167129.3 Ų129.373%0.72656%0.562SS**Hα-helixtrans-66.2-39.3175.9-164.8178.5-179.2-175.80111.5K442 K443 E444 K449 R450K442-K446 WeakPolarHBondContact O-CB 3.46Å; K442-K446 PolarHBondContact O-N 3.4Å; K443-K446 PolarHBondContact O-N 2.87Å; E444-K446 VanDerWaalsContact C-N 3.3Å; E444-K446 PolarHBondContact O-N 3.36Å; K446-K449 PolarHBondContact O-N 3.03Å; K446-R450 PolarHBondContact O-N 3.45Å; K446-R450 VanDerWaalsContact O-N 3.07Å
447R82.3Confident79.2Confident161 Ų161131.6 Ų131.661%0.60858%0.575SS**Hα-helixtrans-66.3-50.3177.1-157.1-176.390.3-1671.6111.8K443 E444 K449 R450 E451K443-R447 PolarHBondContact O-N 3.33Å; E444-R447 PolarHBondContact O-N 3.09Å; R447-K449 VanDerWaalsContact C-N 3.27Å; R447-K449 PolarHBondContact O-N 3.01Å; R447-R450 WeakPolarHBondContact O-CA 3.13Å; R447-R450 WeakPolarHBondContact O-CB 3.33Å; R447-R450 PolarHBondContact O-N 3.27Å; R447-E451 IonicContact CZ-OE1 3.33Å; R447-E451 IonicContact NE-OE1 3.8Å; R447-E451 PolarHBondContact NE-OE1 3.5Å; R447-E451 IonicContact NH2-OE1 3.74Å; R447-E451 PolarHBondContact O-N 3.02Å
448K80.4Confident78.7Confident118 Ų118130.7 Ų130.751%0.51359%0.586SS.*Hα-helixtrans-57.2-39175.2-77174.8168.4164.10112.3E444 R450 K452E444-K448 HydrophobicContact CG-CD 4.49Å; E444-K448 PolarHBondContact O-N 3.34Å; E444-K448 WeakPolarHBondContact OE1-CE 3.37Å; E444-K448 IonicContact OE1-NZ 3.89Å; E444-K448 PolarHBondContact OE1-NZ 3.45Å; K448-R450 VanDerWaalsContact C-N 3.35Å; K448-K452 VanDerWaalsContact O-CB 3.3Å; K448-K452 WeakPolarHBondContact O-CB 3.46Å; K448-K452 PolarHBondContact O-N 2.67Å
449K83.1Confident77.7Confident144 Ų144130 Ų13063%0.62659%0.591SS**Hα-helixtrans-66.3-35174.5-170.6174.7-177.7177.10112.6K445 K446 R447 K453K445-K449 WeakPolarHBondContact O-CB 3.38Å; K445-K449 PolarHBondContact O-N 3.27Å; K446-K449 PolarHBondContact O-N 3.03Å; R447-K449 VanDerWaalsContact C-N 3.27Å; R447-K449 PolarHBondContact O-N 3.01Å; K449-K453 WeakPolarHBondContact O-CG 3.48Å; K449-K453 PolarHBondContact O-N 3.07Å; K449-K453 VanDerWaalsContact O-N 3.15Å
450R79.5Confident76.2Confident195 Ų195131 Ų13174%0.73660%0.601SS**Hα-helixtrans-73.4-44.3177.3-161.2178.4-174-179.82.1111.3K446 R447 K448 K453 Q454K446-R450 PolarHBondContact O-N 3.45Å; K446-R450 VanDerWaalsContact O-N 3.07Å; R447-R450 WeakPolarHBondContact O-CA 3.13Å; R447-R450 WeakPolarHBondContact O-CB 3.33Å; R447-R450 PolarHBondContact O-N 3.27Å; K448-R450 VanDerWaalsContact C-N 3.35Å; R450-K453 PolarHBondContact O-N 3.01Å; R450-Q454 WeakPolarHBondContact O-CB 3.46Å; R450-Q454 PolarHBondContact O-N 3.2Å
451E80.3Confident74.8Confident80 Ų80129.2 Ų129.237%0.37461%0.609SS.*Hα-helixtrans-60.1-45.1174.8-72.5166.8-175.400111.2R447 K453 Q454 Q455R447-E451 IonicContact CZ-OE1 3.33Å; R447-E451 IonicContact NE-OE1 3.8Å; R447-E451 PolarHBondContact NE-OE1 3.5Å; R447-E451 IonicContact NH2-OE1 3.74Å; R447-E451 PolarHBondContact O-N 3.02Å; E451-K453 PolarHBondContact O-N 3.5Å; E451-Q454 PolarHBondContact O-N 2.82Å; E451-Q454 VanDerWaalsContact O-N 3.15Å; E451-Q455 PolarHBondContact O-N 3.42Å
452K80.6Confident72.8Confident133 Ų133133 Ų13358%0.57863%0.627SS**Hα-helixtrans-62.8-43176.6-165.4177.2-179.2-177.10112.4K448 Q454 Q455 E456K448-K452 VanDerWaalsContact O-CB 3.3Å; K448-K452 WeakPolarHBondContact O-CB 3.46Å; K448-K452 PolarHBondContact O-N 2.67Å; K452-Q454 VanDerWaalsContact C-N 3.3Å; K452-Q454 PolarHBondContact O-N 3.3Å; K452-Q455 PolarHBondContact O-N 3.38Å; K452-E456 WeakPolarHBondContact CE-OE1 3.24Å; K452-E456 WeakPolarHBondContact O-CB 3.47Å; K452-E456 VanDerWaalsContact O-CG 3.3Å; K452-E456 WeakPolarHBondContact O-CG 3.09Å; K452-E456 PolarHBondContact O-N 2.91Å
453K78Confident70.6Confident122 Ų122131.9 Ų131.953%0.5363%0.634SS.*Hα-helixtrans-60.7-39.3172.9-83.8-171.3170.4-158.20112.3K449 R450 E451 E456 L457K449-K453 WeakPolarHBondContact O-CG 3.48Å; K449-K453 PolarHBondContact O-N 3.07Å; K449-K453 VanDerWaalsContact O-N 3.15Å; R450-K453 PolarHBondContact O-N 3.01Å; E451-K453 PolarHBondContact O-N 3.5Å; K453-E456 PolarHBondContact O-N 3.42Å; K453-L457 WeakPolarHBondContact O-CB 3.24Å; K453-L457 VanDerWaalsContact O-CD1 3.32Å; K453-L457 WeakPolarHBondContact O-CD1 3.32Å; K453-L457 WeakPolarHBondContact O-CG 3.41Å; K453-L457 PolarHBondContact O-N 3.14Å
454Q73.1Confident68.2Low133 Ų133132 Ų13262%0.62164%0.642SS**Hα-helixtrans-72.8-33.1-177.9-152.51681500111.9R450 E451 K452 A458R450-Q454 WeakPolarHBondContact O-CB 3.46Å; R450-Q454 PolarHBondContact O-N 3.2Å; E451-Q454 PolarHBondContact O-N 2.82Å; E451-Q454 VanDerWaalsContact O-N 3.15Å; K452-Q454 VanDerWaalsContact C-N 3.3Å; K452-Q454 PolarHBondContact O-N 3.3Å; Q454-A458 WeakPolarHBondContact O-CB 3.24Å; Q454-A458 PolarHBondContact O-N 2.97Å
455Q70.9Confident65.9Low131 Ų131131 Ų13161%0.61266%0.656SS**Hα-helixtrans-68.6-44.4168.9-80.1176.4-28.500112.1E451 K452 L457 A458 E459E451-Q455 PolarHBondContact O-N 3.42Å; K452-Q455 PolarHBondContact O-N 3.38Å; Q455-L457 VanDerWaalsContact C-N 3.29Å; Q455-L457 PolarHBondContact O-N 3.07Å; Q455-A458 PolarHBondContact O-N 2.82Å; Q455-A458 VanDerWaalsContact O-N 3.08Å; Q455-E459 PolarHBondContact O-N 2.8Å
456E74.2Confident63.2Low91 Ų91132.8 Ų132.843%0.42567%0.667SS.*Hα-helixtrans-61.2-37.1175.2-73.8168.5-17600111.7K452 K453 N460K452-E456 WeakPolarHBondContact CE-OE1 3.24Å; K452-E456 WeakPolarHBondContact O-CB 3.47Å; K452-E456 VanDerWaalsContact O-CG 3.3Å; K452-E456 WeakPolarHBondContact O-CG 3.09Å; K452-E456 PolarHBondContact O-N 2.91Å; K453-E456 PolarHBondContact O-N 3.42Å; E456-N460 WeakPolarHBondContact O-CB 3.43Å; E456-N460 PolarHBondContact O-N 2.99Å; E456-N460 VanDerWaalsContact O-N 3.14Å
457L69Low60.7Low135 Ų135129.8 Ų129.871%0.70767%0.673SS**Hα-helixtrans-68.6-33.3173-83.2153.6000113K453 Q455K453-L457 WeakPolarHBondContact O-CB 3.24Å; K453-L457 VanDerWaalsContact O-CD1 3.32Å; K453-L457 WeakPolarHBondContact O-CD1 3.32Å; K453-L457 WeakPolarHBondContact O-CG 3.41Å; K453-L457 PolarHBondContact O-N 3.14Å; Q455-L457 VanDerWaalsContact C-N 3.29Å; Q455-L457 PolarHBondContact O-N 3.07Å
458A68.8Low58Low83 Ų83130.4 Ų130.469%0.68668%0.683SS**Hα-helixtrans-77.8-31.5177.700000112.7Q454 Q455Q454-A458 WeakPolarHBondContact O-CB 3.24Å; Q454-A458 PolarHBondContact O-N 2.97Å; Q455-A458 PolarHBondContact O-N 2.82Å; Q455-A458 VanDerWaalsContact O-N 3.08Å
459E61.5Low55.6Low163 Ų163133.5 Ų133.576%0.76270%0.699SS**Hα-helixtrans-78.3-29.6176.8-76.3-179.3163.600112.9Q455Q455-E459 PolarHBondContact O-N 2.8Å
460N51Low52.9Low125 Ų125135.3 Ų135.367%0.66871%0.71SS**SBendtrans-85.6-0.3-175.4-81-16.2000116.2E456 E462E456-N460 WeakPolarHBondContact O-CB 3.43Å; E456-N460 PolarHBondContact O-N 2.99Å; E456-N460 VanDerWaalsContact O-N 3.14Å; N460-E462 PolarHBondContact O-N 3.43Å
461G48.9Very low50.3Low63 Ų63133.4 Ų133.465%0.64972%0.715SS**  trans51.329.8161.900000117.3T463G461-T463 PolarHBondContact O-N 2.79Å
462E36.8Very low47.7Very low189 Ų189133.3 Ų133.388%0.88374%0.735SS**  trans-88.194.3171.6-78.7-171.6156.400109.7N460 N464N460-E462 PolarHBondContact O-N 3.43Å; E462-N464 PolarHBondContact O-N 2.97Å
463T37.2Very low45.1Very low131 Ų131136.1 Ų136.180%0.80475%0.75SS**  trans-72.5106.6155.845.40000109.1G461G461-T463 PolarHBondContact O-N 2.79Å
464N31.5Very low42.6Very low165 Ų165137.8 Ų137.888%0.88277%0.765SS**  trans-166.3120.4140.4-110.9-8.9000113.1E462E462-N464 PolarHBondContact O-N 2.97Å
465G32.1Very low40.2Very low72 Ų72138.9 Ų138.974%0.74278%0.775SS**SBendtrans82.4116.5138.400000118.8
466E26Very low38Very low188 Ų188138.7 Ų138.788%0.87978%0.783SS**  trans77.483.4161.2-60.3178.2177.300116.9E468E466-E468 PolarHBondContact O-N 2.75Å
467A28.7Very low35.8Very low103 Ų103140.1 Ų140.185%0.85180%0.8SS**  trans-77.6100.515100000108.4
468E26.9Very low33.6Very low174 Ų174140.5 Ų140.581%0.81381%0.808SS**  trans-82113.5152.7-77.3-172.9155.500107.9E466 E470E466-E468 PolarHBondContact O-N 2.75Å; E468-E470 PolarHBondContact O-N 3.18Å
469E29.8Very low31.5Very low183 Ų183141.3 Ų141.386%0.85581%0.814SS**  trans-70.195.4163.3-75.6-176.915400108.6
470E25.3Very low29.5Very low183 Ų183143.2 Ų143.286%0.85582%0.82SS**  trans-91.3101.2157.2-95.2-170158.900109.2E468 G472E468-E470 PolarHBondContact O-N 3.18Å; E470-G472 PolarHBondContact O-N 2.7Å
471N25.9Very low28.2Very low155 Ų155146.4 Ų146.483%0.82983%0.828SS**  trans-52.2131160.8-87.4-37.8000109.7E473N471-E473 PolarHBondContact O-N 3.2Å
472G24.9Very low27Very low77 Ų77152.7 Ų152.779%0.79484%0.837SS**  trans-73.6121.417200000110.4E470E470-G472 PolarHBondContact O-N 2.7Å
473E26.5Very low26.2Very low193 Ų193153.2 Ų153.290%0.90284%0.837SS**  trans-151.2136148.1-115.5170-164.600111N471N471-E473 PolarHBondContact O-N 3.2Å
474D25.4Very low25.5Very low156 Ų156156.2 Ų156.283%0.83484%0.839SS**  trans78.2127.4157.2-110.9-17.3000124.4
475D23.9Very low25.1Very low156 Ų156159.3 Ų159.383%0.83484%0.838SS**  trans-107.594.7-179.5-142.3-9.3000106.4
476T22.8Very low24.6Very low127 Ų127164.8 Ų164.878%0.77984%0.844SS**  trans-142.4139.2154.243.60000111.7
477P28.4Very low24.3Very low121 Ų121160.5 Ų160.579%0.78684%0.841SS**  trans-105.5124.7-164.435.5-24.2000112.7
478V23.9Very low24Very low144 Ų144160 Ų16087%0.87384%0.837SS**  trans-137.6115.9163.1-175.70000112.7
479A23.2Very low23.7Very low100 Ų100159.7 Ų159.783%0.82684%0.835SS**  trans39.5131.9144.300000123.4
480K21.4Very low23.4Very low203 Ų203158.9 Ų158.988%0.88383%0.831SS**  trans-68.3159.2169.5-72.2171.3170.3171.50115
481K22.9Very low23.2Very low191 Ų191155.2 Ų155.283%0.8382%0.822SS**  trans98.8137158.5-70.4176.6172.7170.20113.6
482K23.2Very low23Very low195 Ų195155.6 Ų155.685%0.84882%0.819SS**  cis-166.5154.917.4-135.3176.4179.7-176.90110
483K20.9Very low23Very low201 Ų201160 Ų16087%0.87482%0.818SS**  trans-79.8138178.1-150-179.8-169.2177.30112.9
484K22.3Very low22.8Very low193 Ų193155.1 Ų155.184%0.83981%0.811SS**  trans159.1115.2141.8-99.5-174.5166.8-177.10109.8
485R21.6Very low22.7Very low230 Ų230156.5 Ų156.587%0.86881%0.813SS**  84.5137.576.1-106-169.5173.6-172.6-2114.5
486Q22Very low22.6Very low188 Ų188153.5 Ų153.588%0.87981%0.81SS**  trans95.6114.2172.1-62.6172.5-24.700113.5
487A21Very low22.7Very low97 Ų97154.6 Ų154.680%0.80282%0.816SS**  cis95.9124.835.200000114
488A21.4Very low22.4Very low93 Ų93156.9 Ų156.977%0.76982%0.816SS**  trans71.5139.9171.600000116
489E22Very low22.2Very low167 Ų167155.8 Ų155.878%0.7881%0.81SS**  cis-167.6146.517.4-133.1159.9-160.800108.3
490E22.1Very low22.6Very low166 Ų166156 Ų15678%0.77680%0.803SS**  trans42.9142.7141.8-76.3174.2-177.600122
491T21.3Very low22.6Very low106 Ų106151.8 Ų151.865%0.6579%0.794SS**  cis-166.2156.332.82.50000111.8
492E22.7Very low22.6Very low164 Ų164152 Ų15277%0.76680%0.795SS**  trans63.8139.7144.2-70.5169.3171.500120
493E23.4Very low22.5Very low168 Ų168152.3 Ų152.379%0.78580%0.796SS**  cis-165155.218-130.7173.6-178.200111.5
494A22.1Very low22.5Very low91 Ų91152.9 Ų152.975%0.75280%0.798SS**  trans14.7148.9154.600000122.2
495E24.4Very low22.5Very low185 Ų185153.5 Ų153.586%0.86480%0.801SS**  cis-153.2132.838.1-70.3175.1140.700109.1
496A21.6Very low22.5Very low94 Ų94154.2 Ų154.278%0.77780%0.804SS**  62.897.973.100000116.5
497V24.4Very low22.5Very low150 Ų150154.6 Ų154.691%0.90980%0.803SS**  trans-149.3118.8130.9-177.30000110.4
498E22.3Very low22.5Very low168 Ų168154.7 Ų154.779%0.78580%0.798SS**  trans-74.3129.6170.4-79.8-179137.600112.2
499T19.9Very low22.5Very low121 Ų121159.4 Ų159.474%0.74280%0.804SS**  62.8168.3100.580.60000118
500P30.9Very low22.5Very low105 Ų105157.7 Ų157.768%0.68281%0.805SS**  cis-141.3-170.6-2923.91.5000115.4
501V22.4Very low22.7Very low114 Ų114158.6 Ų158.669%0.69181%0.814SS**  trans89.6132.4149.1-161.40000116
502K22.7Very low22.8Very low197 Ų197158 Ų15886%0.85782%0.82SS**  cis-166.1147.239.8-137149.4-152.5171.70112.8
503K20.3Very low22.9Very low200 Ų200154.5 Ų154.587%0.8782%0.819SS**  trans-57.1147.9160.9-74165.4170166.60113.4
504K22.6Very low22.9Very low213 Ų213155.6 Ų155.693%0.92682%0.824SS**  trans-157.5122.4137.3-118.7176.1-175.2177.70114
505K20.8Very low23Very low206 Ų206156 Ų15690%0.89683%0.828SS**  trans-74.6147.8163.7-80.3173.3167.5175.30111.1
506R22Very low23Very low245 Ų245153.8 Ų153.893%0.92583%0.827SS**  trans-168.9104.2145.4-104.3178.5167.7-168.7-6.2106.7
507K21.7Very low23.3Very low196 Ų196158.7 Ų158.785%0.85283%0.834SS**  49108.280-103.6-168.8-179-172.10115.6
508S21.2Very low23.4Very low100 Ų100160.7 Ų160.770%0.69983%0.833SS**  trans48.1122.8134.761.50000120
509E22.7Very low23.8Very low192 Ų192160.8 Ų160.890%0.89784%0.838SS**  -162.8133.8117.9-111.4168.3-170.400112.6
510T21.6Very low24.2Very low131 Ų131160.9 Ų160.980%0.80484%0.841SS**  trans-74.9135.8166.638.40000110.8
511L25.8Very low24.2Very low184 Ų184164.4 Ų164.496%0.96385%0.848SS**  trans-142.1135.4150.2-87.8170.2000109.4
512A23.4Very low24.5Very low93 Ų93165 Ų16577%0.76985%0.854SS**  trans-98.4160.2-173.200000112.1
513A25.2Very low24.7Very low92 Ų92162.2 Ų162.276%0.7685%0.854SS**  trans64142.3155.600000116.1
514E23.6Very low24.9Very low190 Ų190161.2 Ų161.289%0.88885%0.854SS**  cis-170.5140.417.3-132.1169.1-164.800105.5
515A24.5Very low25.1Very low100 Ų100156.7 Ų156.783%0.82685%0.85SS**  trans-177.6117.8146.400000110.7
516T24.5Very low25.4Very low139 Ų139155.9 Ų155.985%0.85385%0.849SS**  trans-55.6136.8168.241.30000113.6
517E27Very low25.6Very low197 Ų197154.3 Ų154.392%0.92185%0.849SS**  trans-147.9130.5150-118.8178.5-174.100110.7
518E26.4Very low25.9Very low192 Ų192154.7 Ų154.790%0.89785%0.85SS**PPolyproline II helixtrans-74.3141.1-172.1-66.9171137.100112
519L29.8Very low26.2Very low170 Ų170159.9 Ų159.989%0.8986%0.86SS**PPolyproline II helixtrans-90.2128.3167.2-75.8159.9000109.4
520P29.6Very low26.6Very low122 Ų122160.8 Ų160.879%0.79286%0.861SS**PPolyproline II helixtrans-85.3135.9171.431.2-29.4000111.9
521E29.5Very low27Very low180 Ų180164.5 Ų164.584%0.84187%0.866SS**PPolyproline II helixtrans-67150.1170.5-66.9-175.6151.400112.5
522P29.8Very low27.2Very low125 Ų125166 Ų16681%0.81287%0.865SS**PPolyproline II helixtrans-84.6130.1175.332.3-30.9000112.6
523V26.4Very low27.6Very low140 Ų140169.5 Ų169.585%0.84886%0.863SS**PPolyproline II helixtrans-65.7125.6176176.60000111.9
524M25.7Very low28.1Very low178 Ų178172.6 Ų172.688%0.87786%0.862SS**PPolyproline II helixtrans-70.6127.8165-78.6179.640.700111
525S26.9Very low28.8Very low119 Ų119168.2 Ų168.283%0.83286%0.858SS**PPolyproline II helixtrans-99.9120.6170.6520000111.6
526E25.7Very low29.4Very low188 Ų188175.1 Ų175.188%0.87988%0.881SS**PPolyproline II helixtrans-71.4127.2172.8-69.4-176.1137.500111.8
527K27.6Very low29.7Very low213 Ų213176.9 Ų176.993%0.92688%0.882SS**  trans-84.6110166.8-89.4179.6176.8173.20110.8
528K27.6Very low29.8Very low203 Ų203175.8 Ų175.888%0.88388%0.88SS**  trans-63.4129.2168-85.5176.4175.5170.80112.3
529K27.6Very low30Very low209 Ų209174.9 Ų174.991%0.90988%0.879SS**  trans-60.9132.1161-75.6171.5174.4170.20110.5
530K29.9Very low30Very low212 Ų212175.2 Ų175.292%0.92288%0.879SS**  trans-119.1113.6158.4-104-177.8178.1177.60109.9
531K30.7Very low30Very low209 Ų209178.6 Ų178.691%0.90988%0.884SS**  trans-64.1140.2160.8-78.6173.7170.3176.30109.1
532K30.2Very low30.1Very low216 Ų216178.5 Ų178.594%0.93989%0.887SS**  trans-129.8122.1152.2-114.5-175.5177.3-174.50107.7
533K32.3Very low30.1Very low165 Ų165182.3 Ų182.372%0.71789%0.892SS**  trans-102138.6171.8-113.9-174.8168.5-115.70107.9
534E35.2Very low30.3Very low157 Ų157185.5 Ų185.573%0.73490%0.896SS**  trans59.5120.8141.3-69.8159.7-167.600120.8
535A38Very low30.7Very low98 Ų98186.2 Ų186.281%0.8190%0.897SS**  -169.9126.3121.800000110.7
536N37.3Very low31.1Very low245 Ų245192.3 Ų192.3100%1.3190%0.903SS**  trans660172.3-73.1-4.5000120.7

Retrieved 536 of 536 residues in 226.6 ms (Link to these results)

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