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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 , UniProt , Accession Q95K50, Species MACFA (Macaca fascicularis, Crab-eating macaque), Gene NOP56, Length 594 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
1M49.4Very low82.3Confident188 Ų18847.5 Ų47.593%0.92625%0.247SC*.  091.80-86169.2-179.700111.8E21M1-E21 WeakPolarHBondContact CA-OE1 3.5Å; M1-E21 VanDerWaalsContact CE-OE2 3.23Å; M1-E21 WeakPolarHBondContact CE-OE2 3.41Å; M1-E21 WeakPolarHBondContact CG-OE1 3.36Å
2V58.7Low83.1Confident74 Ų7446.5 Ų46.545%0.44825%0.245SC..  trans-83.3120.4157.1170.90000105.4L4 L92V2-L4 PolarHBondContact O-N 3.07Å; V2-L92 HydrophobicContact CG1-CB 3.94Å
3L71.3Confident83.8Confident82 Ų8242.9 Ų42.943%0.42923%0.226SC..EExtended strand (participates in β ladder)trans-84.997179.1-70.9170.1000109H5 L92L3-H5 PolarHBondContact O-N 3.29Å; L3-H5 PolarHBondContact O-ND1 3.19Å; L3-L92 PolarHBondContact O-N 3.36Å
4L84Confident84.5Confident32 Ų3240.1 Ų40.117%0.16821%0.211CC..EExtended strand (participates in β ladder)trans-75.4114.9173.2-177.959.4000109.5V2 L19 L92 I118V2-L4 PolarHBondContact O-N 3.07Å; L4-L19 HydrophobicContact CB-CD1 4.49Å; L4-L19 HydrophobicContact CD2-CD1 3.57Å; L4-L19 HydrophobicContact CG-CD1 3.83Å; L4-L19 PolarHBondContact O-N 3.43Å; L4-L92 WeakPolarHBondContact CA-O 3.37Å; L4-L92 HydrophobicContact CD1-CB 3.85Å; L4-L92 HydrophobicContact CD1-CD2 4.09Å; L4-L92 HydrophobicContact CD1-CG 3.98Å; L4-I118 HydrophobicContact CD1-CD1 4.41Å
5H88.4Confident85.1Confident14 Ų1437.4 Ų37.47%0.06520%0.197CC..EExtended strand (participates in β ladder)trans-102.7151.2169.5-66.271.6000108.8L3 L16 L17 L84 L92 L93 G94L3-H5 PolarHBondContact O-N 3.29Å; L3-H5 PolarHBondContact O-ND1 3.19Å; H5-L16 HydrophobicContact CB-CD1 4.08Å; H5-L17 CarbonylContact C-O 3.44Å; H5-L17 VanDerWaalsContact CA-O 3.24Å; H5-L17 WeakPolarHBondContact CA-O 3.15Å; H5-L84 HydrophobicContact CB-CD2 3.99Å; H5-L92 PolarHBondContact N-O 3.31Å; H5-L93 HydrophobicContact CB-CD1 4.07Å; H5-L93 CarbonylContact O-C 3.53Å; H5-L93 WeakPolarHBondContact O-CA 3.34Å; H5-G94 PolarHBondContact O-N 2.91Å
6V90.8Very high85.5Confident0 Ų035.1 Ų35.10%018%0.184CC..EExtended strand (participates in β ladder)trans-123.6127176.6177.10000108.5L17 L19 G94 I121 L122V6-L17 PolarHBondContact N-O 3Å; V6-L17 PolarHBondContact O-N 3.24Å; V6-L19 HydrophobicContact CG2-CD1 3.64Å; V6-L19 HydrophobicContact CG2-CG 4.06Å; V6-G94 WeakPolarHBondContact CA-O 3.35Å; V6-I121 HydrophobicContact CG2-CG2 4.25Å; V6-L122 HydrophobicContact CG1-CD2 3.39Å; V6-L122 HydrophobicContact CG1-CG 3.82Å
7L93Very high85.8Confident4 Ų433.1 Ų33.12%0.02117%0.174CC..EExtended strand (participates in β ladder)trans-88.5122.1172176.766.9000109.1L76 L79 L93 G94 I104 L122L7-L76 HydrophobicContact CD1-CD1 3.73Å; L7-L76 HydrophobicContact CD2-CD1 3.73Å; L7-L76 HydrophobicContact CD2-CD2 4.3Å; L7-L76 HydrophobicContact CG-CD1 4.37Å; L7-L79 HydrophobicContact CD1-CD2 4.07Å; L7-L93 HydrophobicContact CB-CD1 4.31Å; L7-G94 PolarHBondContact N-O 3.47Å; L7-I104 HydrophobicContact CD2-CD1 3.99Å; L7-L122 WeakPolarHBondContact O-CD2 3.3Å
8F93.1Very high86Confident10 Ų1032.3 Ų32.34%0.04417%0.173CC..EExtended strand (participates in β ladder)trans-116.9116.7173.3-176.7-99.9000110.3H10 A15 L17 L122 V125 R126 F129F8-H10 HydrophobicContact CD1-CB 4.24Å; F8-H10 HydrophobicContact CE1-CB 3.87Å; F8-A15 HydrophobicContact CB-CB 4.41Å; F8-A15 PolarHBondContact N-O 3.34Å; F8-A15 PolarHBondContact O-N 3.15Å; F8-L17 HydrophobicContact CB-CD1 3.8Å; F8-L122 HydrophobicContact CB-CD2 4.27Å; F8-L122 HydrophobicContact CD2-CD2 3.83Å; F8-V125 HydrophobicContact CB-CG1 3.94Å; F8-V125 HydrophobicContact CD1-CG1 3.8Å; F8-V125 HydrophobicContact CD2-CB 4.17Å; F8-V125 HydrophobicContact CD2-CG1 3.65Å; F8-V125 HydrophobicContact CE1-CG1 4.18Å; F8-V125 HydrophobicContact CE2-CB 4.46Å; F8-V125 HydrophobicContact CE2-CG1 4.06Å; F8-V125 HydrophobicContact CG-CB 4.47Å; F8-V125 HydrophobicContact CG-CG1 3.51Å; F8-V125 HydrophobicContact CZ-CG1 4.3Å; F8-R126 HydrophobicContact CE2-CB 3.93Å; F8-R126 HydrophobicContact CZ-CB 4.04Å; F8-R126 HydrophobicContact CZ-CG 4.31Å; F8-F129 AromaticContact CD1-CD2 3.53Å; F8-F129 HydrophobicContact CD1-CD2 3.53Å; F8-F129 AromaticContact CD1-CE2 3.44Å; F8-F129 HydrophobicContact CD1-CE2 3.44Å; F8-F129 VanDerWaalsContact CD1-CE2 3.44Å; F8-F129 HydrophobicContact CD1-CG 4.3Å; F8-F129 HydrophobicContact CD1-CZ 4.15Å; F8-F129 HydrophobicContact CE1-CB 4.27Å; F8-F129 HydrophobicContact CE1-CD1 4.19Å; F8-F129 AromaticContact CE1-CD2 3.35Å; F8-F129 HydrophobicContact CE1-CD2 3.35Å; F8-F129 HydrophobicContact CE1-CE1 4.43Å; F8-F129 AromaticContact CE1-CE2 3.64Å; F8-F129 HydrophobicContact CE1-CE2 3.64Å; F8-F129 AromaticContact CE1-CG 3.66Å; F8-F129 HydrophobicContact CE1-CG 3.66Å; F8-F129 HydrophobicContact CE1-CZ 4.17Å; F8-F129 HydrophobicContact CZ-CD2 4.36Å; F8-F129 HydrophobicContact CZ-CG 4.47Å
9E92Very high85.9Confident76 Ų7631.6 Ų31.636%0.35517%0.169SC..EExtended strand (participates in β ladder)trans-86.4131.1173.562.6-160.2-16200110.9Y14 V67E9-Y14 HydrophobicContact CB-CD1 3.93Å; E9-Y14 HydrophobicContact CB-CE1 3.97Å; E9-V67 WeakPolarHBondContact OE2-CG1 3.23Å
10H92Very high85.6Confident23 Ų2335.9 Ų35.911%0.10619%0.186CC..EExtended strand (participates in β ladder)trans-136.2158.2177.6-169.2-104.3000110.9F8 V12 G13 F54 F129 Q145F8-H10 HydrophobicContact CD1-CB 4.24Å; F8-H10 HydrophobicContact CE1-CB 3.87Å; H10-V12 PolarHBondContact ND1-N 2.91Å; H10-V12 PolarHBondContact O-N 3.19Å; H10-G13 WeakPolarHBondContact CB-O 3.42Å; H10-G13 PolarHBondContact N-O 2.85Å; H10-G13 PolarHBondContact O-N 3.34Å; H10-G13 VanDerWaalsContact O-O 3.06Å; H10-F54 WeakPolarHBondContact O-CE2 3.37Å; H10-F129 HydrophobicContact CB-CD1 4.35Å; H10-F129 HydrophobicContact CB-CE1 3.68Å; H10-F129 HydrophobicContact CB-CZ 3.81Å; H10-F129 AromaticContact CD2-CD1 3.79Å; H10-F129 AromaticContact CD2-CE1 3.92Å; H10-F129 AromaticContact CE1-CE1 3.96Å; H10-F129 AromaticContact CG-CD1 3.72Å; H10-F129 AromaticContact CG-CE1 3.34Å; H10-F129 AromaticContact ND1-CD1 3.86Å; H10-F129 AromaticContact ND1-CE1 3.38Å; H10-F129 WeakPolarHBondContact ND1-CE1 3.49Å; H10-Q145 PolarHBondContact NE2-NE2 3.45Å
11A92.3Very high84.6Confident19 Ų1940.4 Ų40.416%0.15721%0.206CC..THydrogen-bonded Turntrans-60.5-12.8179.500000115Q145 L148A11-Q145 HydrophobicContact CB-CB 4.29Å; A11-Q145 HydrophobicContact CB-CG 3.73Å; A11-L148 HydrophobicContact CB-CB 4.29Å; A11-L148 HydrophobicContact CB-CD2 3.67Å
12V92.2Very high85.2Confident36 Ų3633.9 Ų33.922%0.21818%0.177CC..THydrogen-bonded Turntrans-98.3-21.3178-174.10000111.7H10 F51 P53 F54 L136 A144H10-V12 PolarHBondContact ND1-N 2.91Å; H10-V12 PolarHBondContact O-N 3.19Å; V12-F51 HydrophobicContact CB-CZ 4.28Å; V12-F51 HydrophobicContact CG1-CZ 3.89Å; V12-P53 CarbonylContact O-C 3.53Å; V12-P53 VanDerWaalsContact O-CA 3.3Å; V12-P53 WeakPolarHBondContact O-CA 3.47Å; V12-F54 PolarHBondContact O-N 3.16Å; V12-L136 HydrophobicContact CG2-CD1 4.15Å; V12-A144 HydrophobicContact CG2-CB 3.62Å
13G92.6Very high85.5Confident0 Ų037.1 Ų37.10%019%0.188CC..EExtended strand (participates in β ladder)trans156.8-178.9-17200000113.2H10 C52H10-G13 WeakPolarHBondContact CB-O 3.42Å; H10-G13 PolarHBondContact N-O 2.85Å; H10-G13 PolarHBondContact O-N 3.34Å; H10-G13 VanDerWaalsContact O-O 3.06Å; G13-C52 CarbonylContact C-O 3.54Å; G13-C52 WeakPolarHBondContact CA-O 3.44Å
14Y93.7Very high85.2Confident3 Ų339 Ų391%0.01219%0.194CC..EExtended strand (participates in β ladder)trans-95136.4175-59.7-67.6000111.3E9 F51 C52 F54 N63 V67 D75 L76E9-Y14 HydrophobicContact CB-CD1 3.93Å; E9-Y14 HydrophobicContact CB-CE1 3.97Å; Y14-F51 WeakPolarHBondContact O-CA 3.25Å; Y14-F51 WeakPolarHBondContact O-CD2 3.26Å; Y14-C52 PolarHBondContact N-O 3.26Å; Y14-C52 PolarHBondContact O-N 3.43Å; Y14-F54 AromaticContact CD2-CE1 3.88Å; Y14-F54 HydrophobicContact CD2-CE1 3.88Å; Y14-F54 HydrophobicContact CD2-CZ 4.18Å; Y14-F54 HydrophobicContact CE1-CZ 4.39Å; Y14-F54 AromaticContact CE2-CE1 3.56Å; Y14-F54 HydrophobicContact CE2-CE1 3.56Å; Y14-F54 AromaticContact CE2-CZ 3.86Å; Y14-F54 HydrophobicContact CE2-CZ 3.86Å; Y14-F54 AromaticContact CZ-CZ 3.95Å; Y14-N63 WeakPolarHBondContact CE2-OD1 3.26Å; Y14-N63 WeakPolarHBondContact OH-CB 3.4Å; Y14-N63 PolarHBondContact OH-OD1 3.49Å; Y14-V67 HydrophobicContact CE1-CG2 4.1Å; Y14-V67 WeakPolarHBondContact OH-CG2 3.44Å; Y14-D75 HydrophobicContact CE2-CB 4.46Å; Y14-L76 HydrophobicContact CD1-CD1 4.16Å; Y14-L76 HydrophobicContact CD2-CB 4.29Å; Y14-L76 HydrophobicContact CD2-CD1 4.2Å; Y14-L76 HydrophobicContact CE1-CD1 4.33Å; Y14-L76 HydrophobicContact CE1-CD2 4.5Å; Y14-L76 HydrophobicContact CE2-CB 3.78Å; Y14-L76 HydrophobicContact CE2-CD1 4.34Å; Y14-L76 HydrophobicContact CG-CD1 4.11Å
15A92.8Very high84.2Confident0 Ų044.3 Ų44.30%022%0.221CC..EExtended strand (participates in β ladder)trans-112.6132.117100000110.2F8 L17 L48 A50 F51 F129F8-A15 HydrophobicContact CB-CB 4.41Å; F8-A15 PolarHBondContact N-O 3.34Å; F8-A15 PolarHBondContact O-N 3.15Å; A15-L17 HydrophobicContact CB-CD1 4.1Å; A15-L48 HydrophobicContact CB-CD1 3.93Å; A15-A50 WeakPolarHBondContact CA-O 3.41Å; A15-F51 HydrophobicContact CB-CD2 4.06Å; A15-F129 HydrophobicContact CB-CE2 3.83Å; A15-F129 HydrophobicContact CB-CZ 4.33Å
16L92.3Very high83.1Confident0 Ų044.9 Ų44.90%023%0.227CC..EExtended strand (participates in β ladder)trans-106.2121.3169.5-171.670.6000108.5H5 V49 A50 L80 H83 L84 L93H5-L16 HydrophobicContact CB-CD1 4.08Å; L16-V49 WeakPolarHBondContact O-CB 3.29Å; L16-V49 PolarHBondContact O-N 3.42Å; L16-A50 HydrophobicContact CB-CB 4.37Å; L16-A50 PolarHBondContact N-O 3.07Å; L16-A50 PolarHBondContact O-N 3.28Å; L16-A50 VanDerWaalsContact O-N 3.14Å; L16-L80 HydrophobicContact CD1-CD2 4.48Å; L16-H83 HydrophobicContact CD2-CB 3.64Å; L16-L84 HydrophobicContact CD1-CD2 4.3Å; L16-L84 HydrophobicContact CD2-CD2 3.88Å; L16-L84 HydrophobicContact CD2-CG 4.25Å; L16-L93 HydrophobicContact CD1-CD1 3.96Å
17L90.9Very high81.9Confident1 Ų145.5 Ų45.51%0.00523%0.23CC..EExtended strand (participates in β ladder)trans-116.8140-178.5-52.2104.4000109.7H5 V6 F8 A15 V46 R47 L48 V125 L132H5-L17 CarbonylContact C-O 3.44Å; H5-L17 VanDerWaalsContact CA-O 3.24Å; H5-L17 WeakPolarHBondContact CA-O 3.15Å; V6-L17 PolarHBondContact N-O 3Å; V6-L17 PolarHBondContact O-N 3.24Å; F8-L17 HydrophobicContact CB-CD1 3.8Å; A15-L17 HydrophobicContact CB-CD1 4.1Å; L17-V46 HydrophobicContact CB-CG1 3.63Å; L17-V46 HydrophobicContact CD2-CG1 3.54Å; L17-V46 HydrophobicContact CG-CG1 4.18Å; L17-R47 CarbonylContact C-O 3.54Å; L17-R47 WeakPolarHBondContact CA-O 3.37Å; L17-L48 HydrophobicContact CD2-CB 4.47Å; L17-L48 HydrophobicContact CD2-CD1 4.12Å; L17-L48 HydrophobicContact CG-CD1 4.04Å; L17-V125 HydrophobicContact CD1-CG1 4.09Å; L17-V125 HydrophobicContact CD1-CG2 4.3Å; L17-V125 HydrophobicContact CD2-CG1 4.37Å; L17-V125 HydrophobicContact CD2-CG2 4.22Å; L17-L132 HydrophobicContact CD2-CD1 4.04Å
18A88.3Confident80.7Confident20 Ų2052.2 Ų52.217%0.16527%0.265CS..EExtended strand (participates in β ladder)trans-99.1137.917100000109.4R47 V49A18-R47 PolarHBondContact N-O 2.98Å; A18-R47 PolarHBondContact O-N 3.42Å; A18-V49 HydrophobicContact CB-CG2 3.46Å; A18-V49 VanDerWaalsContact CB-CG2 3.46Å
19L85Confident79.9Confident19 Ų1956 Ų5610%0.09928%0.283CS..EExtended strand (participates in β ladder)trans-93.7137.7172.9-63175.1000110.1L4 V6 I45 V46 I121L4-L19 HydrophobicContact CB-CD1 4.49Å; L4-L19 HydrophobicContact CD2-CD1 3.57Å; L4-L19 HydrophobicContact CG-CD1 3.83Å; L4-L19 PolarHBondContact O-N 3.43Å; V6-L19 HydrophobicContact CG2-CD1 3.64Å; V6-L19 HydrophobicContact CG2-CG 4.06Å; L19-I45 HydrophobicContact CD2-CG2 4.28Å; L19-V46 HydrophobicContact CD2-CB 4.23Å; L19-V46 HydrophobicContact CD2-CG1 4.13Å; L19-V46 HydrophobicContact CD2-CG2 3.66Å; L19-I121 HydrophobicContact CD1-CD1 3.39Å; L19-I121 HydrophobicContact CD1-CG2 4.21Å; L19-I121 HydrophobicContact CD2-CD1 3.99Å; L19-I121 HydrophobicContact CD2-CG2 3.77Å; L19-I121 HydrophobicContact CG-CD1 4.33Å
20K78.3Confident79.2Confident117 Ų11756.6 Ų56.651%0.50929%0.293SS..PPolyproline II helixtrans-73.5147.9158.1-59.5-171.4-161.2144.20107.7V22 N44 I45K20-V22 WeakPolarHBondContact O-CG2 3.45Å; K20-V22 PolarHBondContact O-N 3.4Å; K20-N44 VanDerWaalsContact CD-O 3.29Å; K20-N44 WeakPolarHBondContact CD-O 3.49Å; K20-N44 WeakPolarHBondContact CE-O 3.41Å; K20-N44 PolarHBondContact NZ-O 3.4Å; K20-I45 PolarHBondContact N-O 2.91Å
21E65.8Low78.4Confident130 Ų13062.1 Ų62.161%0.60732%0.319SS*.  trans-55.2115.3-174.7-67.1179.7142.600110.4M1M1-E21 WeakPolarHBondContact CA-OE1 3.5Å; M1-E21 VanDerWaalsContact CE-OE2 3.23Å; M1-E21 WeakPolarHBondContact CE-OE2 3.41Å; M1-E21 WeakPolarHBondContact CG-OE1 3.36Å
22V61.4Low77.4Confident52 Ų5262.6 Ų62.632%0.31532%0.32SS..  trans-112.4131.7171.8-166.70000107.3K20 E24 L27 I45K20-V22 WeakPolarHBondContact O-CG2 3.45Å; K20-V22 PolarHBondContact O-N 3.4Å; V22-E24 PolarHBondContact O-N 3.07Å; V22-L27 HydrophobicContact CB-CD1 3.93Å; V22-L27 HydrophobicContact CG1-CD1 3.45Å; V22-L27 VanDerWaalsContact CG1-CD1 3.45Å; V22-L27 HydrophobicContact CG1-CD2 4.3Å; V22-L27 HydrophobicContact CG1-CG 3.73Å; V22-I45 HydrophobicContact CG2-CG2 3.73Å
23E65.8Low76.6Confident142 Ų14265.5 Ų65.566%0.66433%0.331SS*.  trans-66.7123.1174-63.9175.7155.700110I25 S26E23-I25 PolarHBondContact O-N 2.62Å; E23-I25 VanDerWaalsContact O-N 3.15Å; E23-S26 PolarHBondContact O-N 3.14Å; E23-S26 PolarHBondContact OE2-OG 3.02Å
24E64.7Low75.9Confident121 Ų12171.5 Ų71.557%0.56536%0.359SS*.THydrogen-bonded Turntrans-57.5-33.2-175.3-58.7-173.1145.100112.8V22 S26 V117V22-E24 PolarHBondContact O-N 3.07Å; E24-S26 VanDerWaalsContact C-N 3.33Å; E24-S26 PolarHBondContact O-N 3.5Å; E24-V117 HydrophobicContact CB-CG2 3.98Å; E24-V117 HydrophobicContact CG-CG2 4.14Å
25I62.3Low75.1Confident143 Ų14372 Ų7273%0.73336%0.364SS*.THydrogen-bonded Turntrans-67.3-34.9179.8-56.2174000111.3E23E23-I25 PolarHBondContact O-N 2.62Å; E23-I25 VanDerWaalsContact O-N 3.15Å
26S66.2Low74.6Confident27 Ų2772.8 Ų72.819%0.18937%0.368CS..G310 helixtrans-77.4-24.7-171.7-61.60000112.5E23 E24 L28 Q29 V32E23-S26 PolarHBondContact O-N 3.14Å; E23-S26 PolarHBondContact OE2-OG 3.02Å; E24-S26 VanDerWaalsContact C-N 3.33Å; E24-S26 PolarHBondContact O-N 3.5Å; S26-L28 VanDerWaalsContact C-N 3.3Å; S26-L28 PolarHBondContact O-N 3.15Å; S26-Q29 WeakPolarHBondContact O-CB 3.35Å; S26-Q29 PolarHBondContact O-N 3.36Å; S26-Q29 VanDerWaalsContact O-N 3.15Å; S26-V32 WeakPolarHBondContact O-CB 3.29Å; S26-V32 WeakPolarHBondContact O-CG2 3.32Å
27L66.4Low74.2Confident12 Ų1278.4 Ų78.46%0.06340%0.398CS..G310 helixtrans-67.4-23-179.8-81.3137.6000115V22 Q29 V32 V117V22-L27 HydrophobicContact CB-CD1 3.93Å; V22-L27 HydrophobicContact CG1-CD1 3.45Å; V22-L27 VanDerWaalsContact CG1-CD1 3.45Å; V22-L27 HydrophobicContact CG1-CD2 4.3Å; V22-L27 HydrophobicContact CG1-CG 3.73Å; L27-Q29 VanDerWaalsContact C-N 3.25Å; L27-Q29 PolarHBondContact O-N 3.04Å; L27-V32 HydrophobicContact CD2-CG1 4.01Å; L27-V32 HydrophobicContact CG-CG1 4.17Å; L27-V117 HydrophobicContact CD1-CB 4.21Å; L27-V117 HydrophobicContact CD1-CG1 3.5Å; L27-V117 HydrophobicContact CD1-CG2 3.81Å
28L67.6Low74Confident146 Ų14682.5 Ų82.576%0.76442%0.42SS*.G310 helixtrans-82.80.7175.1-69.2171.2000113.2S26S26-L28 VanDerWaalsContact C-N 3.3Å; S26-L28 PolarHBondContact O-N 3.15Å
29Q75.5Confident73.8Confident90 Ų9084.8 Ų84.842%0.42143%0.428SS..SBendtrans-82.8135.9173.7-60.8-176.4-1.300109.8S26 L27 Q31 V32 E33S26-Q29 WeakPolarHBondContact O-CB 3.35Å; S26-Q29 PolarHBondContact O-N 3.36Å; S26-Q29 VanDerWaalsContact O-N 3.15Å; L27-Q29 VanDerWaalsContact C-N 3.25Å; L27-Q29 PolarHBondContact O-N 3.04Å; Q29-Q31 PolarHBondContact O-N 3.39Å; Q29-Q31 VanDerWaalsContact O-N 3.07Å; Q29-V32 HydrophobicContact CB-CG2 4.5Å; Q29-V32 PolarHBondContact O-N 3.23Å; Q29-E33 PolarHBondContact O-N 3.36Å
30P77.1Confident73.8Confident87 Ų8786 Ų8657%0.56545%0.446SS*.Hα-helixtrans-59.1-28.2-178.522.6-33.6000112.8V32 E33 E34P30-V32 VanDerWaalsContact C-N 3.25Å; P30-V32 PolarHBondContact O-N 2.88Å; P30-E33 PolarHBondContact O-N 3.14Å; P30-E34 WeakPolarHBondContact O-CG 3.38Å; P30-E34 PolarHBondContact O-N 3.07Å
31Q74.7Confident74.1Confident139 Ų13985.5 Ų85.565%0.6544%0.444SS*.Hα-helixtrans-62.6-29.9174-61.71792.200113.2Q29 S35Q29-Q31 PolarHBondContact O-N 3.39Å; Q29-Q31 VanDerWaalsContact O-N 3.07Å; Q31-S35 PolarHBondContact O-N 3.43Å
32V71.3Confident75Confident29 Ų2979.4 Ų79.418%0.17642%0.415CS..Hα-helixtrans-87-33.8177-177.20000110.8S26 L27 Q29 P30 S35 V36S26-V32 WeakPolarHBondContact O-CB 3.29Å; S26-V32 WeakPolarHBondContact O-CG2 3.32Å; L27-V32 HydrophobicContact CD2-CG1 4.01Å; L27-V32 HydrophobicContact CG-CG1 4.17Å; Q29-V32 HydrophobicContact CB-CG2 4.5Å; Q29-V32 PolarHBondContact O-N 3.23Å; P30-V32 VanDerWaalsContact C-N 3.25Å; P30-V32 PolarHBondContact O-N 2.88Å; V32-S35 WeakPolarHBondContact O-CA 3.04Å; V32-S35 VanDerWaalsContact O-CB 3.26Å; V32-S35 WeakPolarHBondContact O-CB 3.16Å; V32-S35 PolarHBondContact O-N 2.85Å; V32-S35 PolarHBondContact O-OG 2.93Å; V32-V36 PolarHBondContact O-N 3.43Å; V32-V36 VanDerWaalsContact O-N 3.14Å
33E75.4Confident76.1Confident97 Ų9782.4 Ų82.445%0.45343%0.425SS..Hα-helixtrans-58-47.2167.6-60.7-174.3164.500111.4Q29 P30 S35 V36 L37Q29-E33 PolarHBondContact O-N 3.36Å; P30-E33 PolarHBondContact O-N 3.14Å; E33-S35 PolarHBondContact O-N 3.23Å; E33-V36 WeakPolarHBondContact O-CB 3.45Å; E33-V36 PolarHBondContact O-N 3.36Å; E33-L37 PolarHBondContact O-N 2.98Å
34E78.9Confident77Confident126 Ų12680.5 Ų80.559%0.58942%0.42SS*.Hα-helixtrans-59-29.9171.4-75.3-179.5-172.900112.8P30 V36 L37P30-E34 WeakPolarHBondContact O-CG 3.38Å; P30-E34 PolarHBondContact O-N 3.07Å; E34-V36 VanDerWaalsContact C-N 3.34Å; E34-L37 PolarHBondContact O-N 3.03Å
35S76.9Confident77.9Confident15 Ų1575.9 Ų75.911%0.10540%0.399CS..Hα-helixtrans-69.6-31.4176.389.50000112.8Q31 V32 E33 L37 N38 K41Q31-S35 PolarHBondContact O-N 3.43Å; V32-S35 WeakPolarHBondContact O-CA 3.04Å; V32-S35 VanDerWaalsContact O-CB 3.26Å; V32-S35 WeakPolarHBondContact O-CB 3.16Å; V32-S35 PolarHBondContact O-N 2.85Å; V32-S35 PolarHBondContact O-OG 2.93Å; E33-S35 PolarHBondContact O-N 3.23Å; S35-L37 VanDerWaalsContact C-N 3.34Å; S35-N38 PolarHBondContact O-N 2.83Å; S35-K41 WeakPolarHBondContact O-CB 3.14Å
36V81.3Confident79.1Confident15 Ų1569.1 Ų69.19%0.09136%0.364CS..Hα-helixtrans-71.2-31.4176.6175.50000111.3V32 E33 E34 N38 F42 H128V32-V36 PolarHBondContact O-N 3.43Å; V32-V36 VanDerWaalsContact O-N 3.14Å; E33-V36 WeakPolarHBondContact O-CB 3.45Å; E33-V36 PolarHBondContact O-N 3.36Å; E34-V36 VanDerWaalsContact C-N 3.34Å; V36-N38 VanDerWaalsContact C-N 3.29Å; V36-N38 PolarHBondContact O-N 3.44Å; V36-F42 HydrophobicContact CB-CD2 4.31Å; V36-F42 HydrophobicContact CG1-CD2 3.97Å; V36-F42 HydrophobicContact CG1-CE2 3.97Å; V36-F42 HydrophobicContact CG2-CD2 4.3Å; V36-F42 HydrophobicContact CG2-CE2 4.46Å; V36-H128 PolarHBondContact O-CD2 3.05Å; V36-H128 PolarHBondContact O-NE2 3.28Å
37L85Confident80.1Confident119 Ų11976.3 Ų76.362%0.62339%0.387SS*.Hα-helixtrans-68-27.5175.7-61.2179.1000113E33 E34 S35 L127 H128E33-L37 PolarHBondContact O-N 2.98Å; E34-L37 PolarHBondContact O-N 3.03Å; S35-L37 VanDerWaalsContact C-N 3.34Å; L37-L127 HydrophobicContact CD2-CD2 3.95Å; L37-H128 PolarHBondContact O-CE1 3.06Å; L37-H128 VanDerWaalsContact O-CE1 3.23Å; L37-H128 PolarHBondContact O-NE2 3.05Å
38N85.9Confident81.1Confident87 Ų8778.1 Ų78.147%0.46540%0.397SS..SBendtrans-94114.3-178-172-55.4000111.8S35 V36 G40 K41 F42S35-N38 PolarHBondContact O-N 2.83Å; V36-N38 VanDerWaalsContact C-N 3.29Å; V36-N38 PolarHBondContact O-N 3.44Å; N38-G40 VanDerWaalsContact C-N 3.27Å; N38-G40 PolarHBondContact O-N 3.39Å; N38-G40 VanDerWaalsContact O-N 3.14Å; N38-G40 PolarHBondContact OD1-N 3.22Å; N38-K41 HydrophobicContact CB-CB 4.31Å; N38-K41 HydrophobicContact CB-CD 4.29Å; N38-K41 HydrophobicContact CB-CG 4.33Å; N38-K41 PolarHBondContact O-N 3.23Å; N38-K41 VanDerWaalsContact O-N 3.07Å; N38-F42 WeakPolarHBondContact O-CB 3.44Å; N38-F42 PolarHBondContact O-N 3.15Å
39L84.7Confident82.1Confident67 Ų6774.3 Ų74.335%0.35138%0.379SS..Hα-helixtrans-49.1-42.9-178.9179.166000113.8F42 H43 H128 N131L39-F42 PolarHBondContact O-N 2.81Å; L39-H43 WeakPolarHBondContact O-CB 3.42Å; L39-H43 PolarHBondContact O-N 3.32Å; L39-H128 HydrophobicContact CD1-CB 3.84Å; L39-N131 HydrophobicContact CD1-CB 3.75Å; L39-N131 HydrophobicContact CD2-CB 3.97Å
40G85.3Confident82.8Confident45 Ų4570.4 Ų70.446%0.46436%0.363SS..Hα-helixtrans-68.9-36.7-177.300000113N38 N44N38-G40 VanDerWaalsContact C-N 3.27Å; N38-G40 PolarHBondContact O-N 3.39Å; N38-G40 VanDerWaalsContact O-N 3.14Å; N38-G40 PolarHBondContact OD1-N 3.22Å; G40-N44 PolarHBondContact O-ND2 2.91Å
41K83.1Confident83.5Confident107 Ų10769 Ų6947%0.46535%0.348SS..Hα-helixtrans-72.1-42.3172.1-67.7-177.8179-178.90110.6S35 N38 H43 N44S35-K41 WeakPolarHBondContact O-CB 3.14Å; N38-K41 HydrophobicContact CB-CB 4.31Å; N38-K41 HydrophobicContact CB-CD 4.29Å; N38-K41 HydrophobicContact CB-CG 4.33Å; N38-K41 PolarHBondContact O-N 3.23Å; N38-K41 VanDerWaalsContact O-N 3.07Å; K41-H43 PolarHBondContact O-N 3.04Å; K41-N44 WeakPolarHBondContact O-CB 3.39Å; K41-N44 PolarHBondContact O-N 3.47Å
42F85.4Confident84.3Confident1 Ų164.5 Ų64.50%0.00433%0.331CS..Hα-helixtrans-63.2-39.5-179.6-167.2-108.8000113.4V36 N38 L39 N44 I45 V46 V125 H128 L132V36-F42 HydrophobicContact CB-CD2 4.31Å; V36-F42 HydrophobicContact CG1-CD2 3.97Å; V36-F42 HydrophobicContact CG1-CE2 3.97Å; V36-F42 HydrophobicContact CG2-CD2 4.3Å; V36-F42 HydrophobicContact CG2-CE2 4.46Å; N38-F42 WeakPolarHBondContact O-CB 3.44Å; N38-F42 PolarHBondContact O-N 3.15Å; L39-F42 PolarHBondContact O-N 2.81Å; F42-N44 PolarHBondContact O-N 3.18Å; F42-I45 WeakPolarHBondContact O-CB 3.38Å; F42-I45 PolarHBondContact O-N 2.87Å; F42-V46 HydrophobicContact CD1-CG2 4.37Å; F42-V46 HydrophobicContact CD2-CG2 4.3Å; F42-V46 HydrophobicContact CE1-CB 4.21Å; F42-V46 HydrophobicContact CE1-CG2 3.77Å; F42-V46 HydrophobicContact CE2-CG2 3.69Å; F42-V46 HydrophobicContact CZ-CB 4.3Å; F42-V46 HydrophobicContact CZ-CG2 3.39Å; F42-V46 PolarHBondContact O-N 3.34Å; F42-V125 HydrophobicContact CE1-CG2 4.07Å; F42-V125 HydrophobicContact CZ-CB 4.49Å; F42-V125 HydrophobicContact CZ-CG2 3.82Å; F42-H128 HydrophobicContact CD1-CB 4.23Å; F42-H128 AromaticContact CD1-CD2 3.68Å; F42-H128 AromaticContact CG-CD2 3.87Å; F42-L132 HydrophobicContact CE1-CD1 4.28Å
43H85Confident85.3Confident115 Ų11566.7 Ų66.753%0.53235%0.346SS..Hα-helixtrans-66.1-17.6174.5-168.9-71.9000113.2L39 K41L39-H43 WeakPolarHBondContact O-CB 3.42Å; L39-H43 PolarHBondContact O-N 3.32Å; K41-H43 PolarHBondContact O-N 3.04Å
44N83.7Confident86.1Confident103 Ų10363.6 Ų63.655%0.55133%0.331SS*.Hα-helixtrans-76.4-32170.6-71.6-32.7000112.2K20 G40 K41 F42K20-N44 VanDerWaalsContact CD-O 3.29Å; K20-N44 WeakPolarHBondContact CD-O 3.49Å; K20-N44 WeakPolarHBondContact CE-O 3.41Å; K20-N44 PolarHBondContact NZ-O 3.4Å; G40-N44 PolarHBondContact O-ND2 2.91Å; K41-N44 WeakPolarHBondContact O-CB 3.39Å; K41-N44 PolarHBondContact O-N 3.47Å; F42-N44 PolarHBondContact O-N 3.18Å
45I84Confident86.7Confident24 Ų2462.5 Ų62.512%0.12334%0.344CS..Hα-helixtrans-77.8-49.6179.5-59.4169000110.7L19 K20 V22 F42L19-I45 HydrophobicContact CD2-CG2 4.28Å; K20-I45 PolarHBondContact N-O 2.91Å; V22-I45 HydrophobicContact CG2-CG2 3.73Å; F42-I45 WeakPolarHBondContact O-CB 3.38Å; F42-I45 PolarHBondContact O-N 2.87Å
46V86.9Confident87.4Confident1 Ų164 Ų641%0.00635%0.354CS..EExtended strand (participates in β ladder)trans-112131.5-168.9-166.70000111.6L17 L19 F42 I121 V125L17-V46 HydrophobicContact CB-CG1 3.63Å; L17-V46 HydrophobicContact CD2-CG1 3.54Å; L17-V46 HydrophobicContact CG-CG1 4.18Å; L19-V46 HydrophobicContact CD2-CB 4.23Å; L19-V46 HydrophobicContact CD2-CG1 4.13Å; L19-V46 HydrophobicContact CD2-CG2 3.66Å; F42-V46 HydrophobicContact CD1-CG2 4.37Å; F42-V46 HydrophobicContact CD2-CG2 4.3Å; F42-V46 HydrophobicContact CE1-CB 4.21Å; F42-V46 HydrophobicContact CE1-CG2 3.77Å; F42-V46 HydrophobicContact CE2-CG2 3.69Å; F42-V46 HydrophobicContact CZ-CB 4.3Å; F42-V46 HydrophobicContact CZ-CG2 3.39Å; F42-V46 PolarHBondContact O-N 3.34Å; V46-I121 HydrophobicContact CG2-CG2 4.37Å; V46-V125 HydrophobicContact CG1-CG2 4.32Å
47R87.5Confident87.9Confident177 Ų17767.5 Ų67.567%0.66838%0.379SS*.EExtended strand (participates in β ladder)trans-119.8122.9173-179.1177.8178.2172.21.2110.5L17 A18 V49L17-R47 CarbonylContact C-O 3.54Å; L17-R47 WeakPolarHBondContact CA-O 3.37Å; A18-R47 PolarHBondContact N-O 2.98Å; A18-R47 PolarHBondContact O-N 3.42Å; R47-V49 PolarHBondContact O-N 3.13Å
48L89Confident88.2Confident51 Ų5168.5 Ų68.527%0.26738%0.38SS..EExtended strand (participates in β ladder)trans-62.3124.8169.6-174.265.9000109.8A15 L17 A50 F51 L132 V133A15-L48 HydrophobicContact CB-CD1 3.93Å; L17-L48 HydrophobicContact CD2-CB 4.47Å; L17-L48 HydrophobicContact CD2-CD1 4.12Å; L17-L48 HydrophobicContact CG-CD1 4.04Å; L48-A50 WeakPolarHBondContact CD1-O 3.2Å; L48-F51 HydrophobicContact CD2-CB 4.39Å; L48-L132 WeakPolarHBondContact CD2-O 3.48Å; L48-V133 HydrophobicContact CD2-CG2 4.27Å
49V88.7Confident88.6Confident65 Ų6566 Ų6639%0.39437%0.368SS..EExtended strand (participates in β ladder)trans-95.4-49.4175.8176.40000109.8L16 A18 R47L16-V49 WeakPolarHBondContact O-CB 3.29Å; L16-V49 PolarHBondContact O-N 3.42Å; A18-V49 HydrophobicContact CB-CG2 3.46Å; A18-V49 VanDerWaalsContact CB-CG2 3.46Å; R47-V49 PolarHBondContact O-N 3.13Å
50A90Very high89Confident9 Ų963.1 Ų63.17%0.07435%0.354CS..EExtended strand (participates in β ladder)trans-147.5151-176.900000111.1A15 L16 L48 L79 H83A15-A50 WeakPolarHBondContact CA-O 3.41Å; L16-A50 HydrophobicContact CB-CB 4.37Å; L16-A50 PolarHBondContact N-O 3.07Å; L16-A50 PolarHBondContact O-N 3.28Å; L16-A50 VanDerWaalsContact O-N 3.14Å; L48-A50 WeakPolarHBondContact CD1-O 3.2Å; A50-L79 HydrophobicContact CB-CD1 4.19Å; A50-H83 HydrophobicContact CB-CB 4.28Å; A50-H83 WeakPolarHBondContact CB-CD2 3.39Å; A50-H83 WeakPolarHBondContact CB-NE2 3.48Å
51F91.3Very high89.4Confident57 Ų5762.8 Ų62.825%0.2534%0.342CS..EExtended strand (participates in β ladder)trans-138.5119.5171.4175.9-115.9000108.3V12 Y14 A15 L48 P53 F129 V133V12-F51 HydrophobicContact CB-CZ 4.28Å; V12-F51 HydrophobicContact CG1-CZ 3.89Å; Y14-F51 WeakPolarHBondContact O-CA 3.25Å; Y14-F51 WeakPolarHBondContact O-CD2 3.26Å; A15-F51 HydrophobicContact CB-CD2 4.06Å; L48-F51 HydrophobicContact CD2-CB 4.39Å; F51-P53 HydrophobicContact CE1-CB 3.85Å; F51-P53 HydrophobicContact CE1-CG 4.3Å; F51-P53 HydrophobicContact CZ-CB 4.17Å; F51-P53 WeakPolarHBondContact O-CD 3.41Å; F51-F129 HydrophobicContact CD2-CZ 4.45Å; F51-F129 AromaticContact CE2-CZ 3.99Å; F51-F129 HydrophobicContact CE2-CZ 3.99Å; F51-V133 HydrophobicContact CD1-CG1 3.64Å; F51-V133 HydrophobicContact CD2-CG2 4.22Å; F51-V133 HydrophobicContact CE1-CG1 3.68Å; F51-V133 HydrophobicContact CE2-CG2 4.43Å; F51-V133 HydrophobicContact CG-CG1 4.14Å; F51-V133 HydrophobicContact CG-CG2 4.29Å; F51-V133 HydrophobicContact CZ-CG1 4.23Å
52C91.4Very high89.9Confident45 Ų4562.8 Ų62.830%0.30434%0.343SS..EExtended strand (participates in β ladder)trans-107.4101175.5-175.20000108.5G13 Y14 L79G13-C52 CarbonylContact C-O 3.54Å; G13-C52 WeakPolarHBondContact CA-O 3.44Å; Y14-C52 PolarHBondContact N-O 3.26Å; Y14-C52 PolarHBondContact O-N 3.43Å; C52-L79 HydrophobicContact CB-CD1 3.71Å
53P92.1Very high90.3Very high74 Ų7462.8 Ų62.848%0.48134%0.343SS..EExtended strand (participates in β ladder)trans-72.2143.5174.229.9-33.5000111.1V12 F51 A55V12-P53 CarbonylContact O-C 3.53Å; V12-P53 VanDerWaalsContact O-CA 3.3Å; V12-P53 WeakPolarHBondContact O-CA 3.47Å; F51-P53 HydrophobicContact CE1-CB 3.85Å; F51-P53 HydrophobicContact CE1-CG 4.3Å; F51-P53 HydrophobicContact CZ-CB 4.17Å; F51-P53 WeakPolarHBondContact O-CD 3.41Å; P53-A55 PolarHBondContact O-N 3.32Å
54F93.2Very high90.7Very high33 Ų3358.4 Ų58.415%0.14533%0.327CS..  trans-68.1130.2173.4-60.1-49.8000110.7H10 V12 Y14 S56 V59 A60 N63H10-F54 WeakPolarHBondContact O-CE2 3.37Å; V12-F54 PolarHBondContact O-N 3.16Å; Y14-F54 AromaticContact CD2-CE1 3.88Å; Y14-F54 HydrophobicContact CD2-CE1 3.88Å; Y14-F54 HydrophobicContact CD2-CZ 4.18Å; Y14-F54 HydrophobicContact CE1-CZ 4.39Å; Y14-F54 AromaticContact CE2-CE1 3.56Å; Y14-F54 HydrophobicContact CE2-CE1 3.56Å; Y14-F54 AromaticContact CE2-CZ 3.86Å; Y14-F54 HydrophobicContact CE2-CZ 3.86Å; Y14-F54 AromaticContact CZ-CZ 3.95Å; F54-S56 VanDerWaalsContact C-N 3.27Å; F54-S56 PolarHBondContact O-N 2.93Å; F54-V59 HydrophobicContact CD1-CG1 4.3Å; F54-A60 HydrophobicContact CB-CB 3.97Å; F54-A60 HydrophobicContact CD2-CB 3.47Å; F54-A60 VanDerWaalsContact CD2-CB 3.47Å; F54-A60 HydrophobicContact CE2-CB 4.19Å; F54-A60 HydrophobicContact CG-CB 3.9Å; F54-N63 HydrophobicContact CD1-CB 4.44Å; F54-N63 HydrophobicContact CE1-CB 3.65Å; F54-N63 WeakPolarHBondContact CE1-ND2 3.47Å; F54-N63 HydrophobicContact CE2-CB 4.45Å; F54-N63 HydrophobicContact CZ-CB 3.65Å
55A90.7Very high91.1Very high103 Ų10355.2 Ų55.285%0.85131%0.31SS*.SBendtrans-67.8-23.2-177.500000114.2P53P53-A55 PolarHBondContact O-N 3.32Å
56S92.4Very high91.6Very high46 Ų4654.8 Ų54.832%0.32231%0.31SS..SBendtrans-152.8155.2-176.7175.20000110.9F54 Q58 V59 A60F54-S56 VanDerWaalsContact C-N 3.27Å; F54-S56 PolarHBondContact O-N 2.93Å; S56-Q58 PolarHBondContact O-N 3.37Å; S56-Q58 PolarHBondContact OG-N 2.92Å; S56-V59 PolarHBondContact O-N 3.34Å; S56-A60 PolarHBondContact O-N 2.84Å
57S90.2Very high91.8Very high88 Ų8855.8 Ų55.862%0.61532%0.316SS*.Hα-helixtrans-64.1-21.5172.958.10000113.4L61S57-L61 WeakPolarHBondContact O-CB 3.4Å; S57-L61 PolarHBondContact O-N 3.12Å; S57-L61 VanDerWaalsContact O-N 3.1Å
58Q92Very high92Very high140 Ų14050 Ų5065%0.65430%0.303SS*.Hα-helixtrans-69.1-51.5171.8-69.8174.1-38.300110.9S56 A60 L61 E62S56-Q58 PolarHBondContact O-N 3.37Å; S56-Q58 PolarHBondContact OG-N 2.92Å; Q58-A60 VanDerWaalsContact C-N 3.29Å; Q58-A60 PolarHBondContact O-N 3.08Å; Q58-L61 WeakPolarHBondContact O-CA 3.25Å; Q58-L61 WeakPolarHBondContact O-CB 3.36Å; Q58-L61 PolarHBondContact O-N 2.88Å; Q58-E62 WeakPolarHBondContact O-CG 3.24Å; Q58-E62 PolarHBondContact O-N 3.48Å
59V93.3Very high92.1Very high35 Ų3553.4 Ų53.421%0.21232%0.317CS..Hα-helixtrans-59.9-40.5175.5176.70000110.7F54 S56 L61 E62 N63 D75F54-V59 HydrophobicContact CD1-CG1 4.3Å; S56-V59 PolarHBondContact O-N 3.34Å; V59-L61 VanDerWaalsContact C-N 3.31Å; V59-L61 PolarHBondContact O-N 2.91Å; V59-E62 PolarHBondContact O-N 3.38Å; V59-N63 WeakPolarHBondContact CG1-ND2 3.24Å; V59-N63 WeakPolarHBondContact O-CB 3.32Å; V59-N63 PolarHBondContact O-N 2.88Å; V59-N63 PolarHBondContact O-ND2 3.28Å; V59-D75 VanDerWaalsContact CG1-OD2 3.24Å; V59-D75 WeakPolarHBondContact CG1-OD2 3.41Å
60A93.8Very high92.1Very high7 Ų750.9 Ų50.96%0.05830%0.304CS..Hα-helixtrans-61.6-37174.200000112.9F54 S56 Q58 A64 L148F54-A60 HydrophobicContact CB-CB 3.97Å; F54-A60 HydrophobicContact CD2-CB 3.47Å; F54-A60 VanDerWaalsContact CD2-CB 3.47Å; F54-A60 HydrophobicContact CE2-CB 4.19Å; F54-A60 HydrophobicContact CG-CB 3.9Å; S56-A60 PolarHBondContact O-N 2.84Å; Q58-A60 VanDerWaalsContact C-N 3.29Å; Q58-A60 PolarHBondContact O-N 3.08Å; A60-A64 VanDerWaalsContact O-CB 3.23Å; A60-A64 WeakPolarHBondContact O-CB 3.38Å; A60-A64 PolarHBondContact O-N 3.39Å; A60-L148 HydrophobicContact CB-CD1 4.12Å
61L93.6Very high92.2Very high38 Ų3854.2 Ų54.220%0.19932%0.324CS..Hα-helixtrans-71.4-40.5175.8175.162.4000112.2S57 Q58 V59 A64 N65 L148 Y152 A155S57-L61 WeakPolarHBondContact O-CB 3.4Å; S57-L61 PolarHBondContact O-N 3.12Å; S57-L61 VanDerWaalsContact O-N 3.1Å; Q58-L61 WeakPolarHBondContact O-CA 3.25Å; Q58-L61 WeakPolarHBondContact O-CB 3.36Å; Q58-L61 PolarHBondContact O-N 2.88Å; V59-L61 VanDerWaalsContact C-N 3.31Å; V59-L61 PolarHBondContact O-N 2.91Å; L61-A64 PolarHBondContact O-N 2.76Å; L61-N65 PolarHBondContact O-N 2.96Å; L61-N65 PolarHBondContact O-ND2 3.37Å; L61-L148 HydrophobicContact CB-CD1 4.37Å; L61-Y152 HydrophobicContact CD1-CD2 4.38Å; L61-A155 HydrophobicContact CD1-CB 4.38Å; L61-A155 HydrophobicContact CD2-CB 4.37Å
62E93.4Very high92.2Very high107 Ų10752 Ų5250%0.531%0.314SS..Hα-helixtrans-62.4-49.2175.5-72.7162.4176.500110.8Q58 V59 A64 N65 A66Q58-E62 WeakPolarHBondContact O-CG 3.24Å; Q58-E62 PolarHBondContact O-N 3.48Å; V59-E62 PolarHBondContact O-N 3.38Å; E62-A64 PolarHBondContact O-N 2.92Å; E62-N65 PolarHBondContact O-N 2.85Å; E62-A66 PolarHBondContact O-N 3.1Å
63N93.8Very high92.2Very high1 Ų151.9 Ų51.91%0.00531%0.309CS..Hα-helixtrans-57.4-46.6172.2-82.8-83.8000112.3Y14 F54 V59 N65 A66 V67 H73 D75Y14-N63 WeakPolarHBondContact CE2-OD1 3.26Å; Y14-N63 WeakPolarHBondContact OH-CB 3.4Å; Y14-N63 PolarHBondContact OH-OD1 3.49Å; F54-N63 HydrophobicContact CD1-CB 4.44Å; F54-N63 HydrophobicContact CE1-CB 3.65Å; F54-N63 WeakPolarHBondContact CE1-ND2 3.47Å; F54-N63 HydrophobicContact CE2-CB 4.45Å; F54-N63 HydrophobicContact CZ-CB 3.65Å; V59-N63 WeakPolarHBondContact CG1-ND2 3.24Å; V59-N63 WeakPolarHBondContact O-CB 3.32Å; V59-N63 PolarHBondContact O-N 2.88Å; V59-N63 PolarHBondContact O-ND2 3.28Å; N63-N65 VanDerWaalsContact C-N 3.31Å; N63-N65 PolarHBondContact O-N 3.43Å; N63-A66 PolarHBondContact O-N 2.74Å; N63-V67 WeakPolarHBondContact O-CB 3.28Å; N63-V67 VanDerWaalsContact O-CG2 3.29Å; N63-V67 WeakPolarHBondContact O-CG2 3.42Å; N63-V67 PolarHBondContact O-N 2.94Å; N63-H73 PolarHBondContact ND2-CE1 3.17Å; N63-H73 PolarHBondContact ND2-ND1 2.9Å; N63-H73 VanDerWaalsContact OD1-CB 3.3Å; N63-H73 WeakPolarHBondContact OD1-CB 3.46Å; N63-H73 VanDerWaalsContact OD1-CG 3.31Å; N63-H73 PolarHBondContact OD1-ND1 2.91Å; N63-D75 PolarHBondContact ND2-OD2 3.36Å
64A93.4Very high92.1Very high23 Ų2355.7 Ų55.719%0.1932%0.321CS..Hα-helixtrans-64.1-33178.700000113.4A60 L61 E62 S68 L148A60-A64 VanDerWaalsContact O-CB 3.23Å; A60-A64 WeakPolarHBondContact O-CB 3.38Å; A60-A64 PolarHBondContact O-N 3.39Å; L61-A64 PolarHBondContact O-N 2.76Å; E62-A64 PolarHBondContact O-N 2.92Å; A64-S68 VanDerWaalsContact O-CB 3.22Å; A64-S68 WeakPolarHBondContact O-CB 3.48Å; A64-S68 PolarHBondContact O-N 2.87Å; A64-L148 HydrophobicContact CB-CD1 4.08Å; A64-L148 HydrophobicContact CB-CD2 4.23Å; A64-L148 HydrophobicContact CB-CG 4.44Å
65N93.3Very high92Very high36 Ų3656.3 Ų56.319%0.19333%0.325CS..Hα-helixtrans-70.5-44.8172.3-72.7-48.3000111.4L61 E62 N63 S68 E69 Y152L61-N65 PolarHBondContact O-N 2.96Å; L61-N65 PolarHBondContact O-ND2 3.37Å; E62-N65 PolarHBondContact O-N 2.85Å; N63-N65 VanDerWaalsContact C-N 3.31Å; N63-N65 PolarHBondContact O-N 3.43Å; N65-S68 PolarHBondContact O-N 3.14Å; N65-E69 WeakPolarHBondContact O-CB 3.38Å; N65-E69 WeakPolarHBondContact O-CG 3.5Å; N65-E69 PolarHBondContact O-N 3.15Å; N65-Y152 WeakPolarHBondContact OD1-CD2 3.49Å; N65-Y152 WeakPolarHBondContact OD1-CE2 3.26Å
66A92.8Very high92Very high15 Ų1551.5 Ų51.512%0.12429%0.285CS..Hα-helixtrans-60.3-49.4177.900000111.8E62 N63 S68 E69 G70 V71 H73E62-A66 PolarHBondContact O-N 3.1Å; N63-A66 PolarHBondContact O-N 2.74Å; A66-S68 PolarHBondContact O-N 2.97Å; A66-E69 CarbonylContact O-C 3.36Å; A66-E69 PolarHBondContact O-N 2.74Å; A66-E69 VanDerWaalsContact O-N 3.09Å; A66-G70 PolarHBondContact O-N 3.25Å; A66-V71 CarbonylContact C-O 3.42Å; A66-V71 HydrophobicContact CB-CB 4.5Å; A66-V71 PolarHBondContact O-N 3.07Å; A66-H73 HydrophobicContact CB-CB 4.16Å
67V92.5Very high91.9Very high22 Ų2253.7 Ų53.713%0.13329%0.287CS..Hα-helixtrans-53.2-50.6171.1163.50000110.9E9 Y14 N63 E69 G70 I100E9-V67 WeakPolarHBondContact OE2-CG1 3.23Å; Y14-V67 HydrophobicContact CE1-CG2 4.1Å; Y14-V67 WeakPolarHBondContact OH-CG2 3.44Å; N63-V67 WeakPolarHBondContact O-CB 3.28Å; N63-V67 VanDerWaalsContact O-CG2 3.29Å; N63-V67 WeakPolarHBondContact O-CG2 3.42Å; N63-V67 PolarHBondContact O-N 2.94Å; V67-E69 PolarHBondContact O-N 3.09Å; V67-G70 PolarHBondContact O-N 3.2Å; V67-G70 VanDerWaalsContact O-N 3.15Å; V67-I100 HydrophobicContact CB-CD1 4.11Å; V67-I100 HydrophobicContact CG1-CD1 3.7Å; V67-I100 HydrophobicContact CG2-CD1 4.26Å
68S91.3Very high92Very high55 Ų5554.6 Ų54.639%0.38528%0.284SS..Hα-helixtrans-63.3-23.7178.7176.90000114.4A64 N65 A66 Y152A64-S68 VanDerWaalsContact O-CB 3.22Å; A64-S68 WeakPolarHBondContact O-CB 3.48Å; A64-S68 PolarHBondContact O-N 2.87Å; N65-S68 PolarHBondContact O-N 3.14Å; A66-S68 PolarHBondContact O-N 2.97Å; S68-Y152 PolarHBondContact OG-OH 3.03Å
69E90.4Very high91.9Very high123 Ų12348.2 Ų48.258%0.57526%0.255SS*.Hα-helixtrans-97.3-10.5-179.8-72.7168.9-164.300112N65 A66 V67 V71 K156N65-E69 WeakPolarHBondContact O-CB 3.38Å; N65-E69 WeakPolarHBondContact O-CG 3.5Å; N65-E69 PolarHBondContact O-N 3.15Å; A66-E69 CarbonylContact O-C 3.36Å; A66-E69 PolarHBondContact O-N 2.74Å; A66-E69 VanDerWaalsContact O-N 3.09Å; V67-E69 PolarHBondContact O-N 3.09Å; E69-V71 HydrophobicContact CB-CG2 4.49Å; E69-K156 IonicContact OE1-NZ 3.1Å; E69-K156 PolarHBondContact OE1-NZ 2.92Å
70G89.8Confident91.7Very high11 Ų1146.6 Ų46.611%0.11324%0.244CC..THydrogen-bonded Turntrans86.118.7179.900000114.2A66 V67 A103A66-G70 PolarHBondContact O-N 3.25Å; V67-G70 PolarHBondContact O-N 3.2Å; V67-G70 VanDerWaalsContact O-N 3.15Å; G70-A103 VanDerWaalsContact O-CB 3.3Å; G70-A103 WeakPolarHBondContact O-CB 3.49Å
71V91.5Very high91.4Very high80 Ų8051.5 Ų51.549%0.48527%0.266SS..PPolyproline II helixtrans-101.7138.6-177.1-177.20000110.3A66 E69 H73A66-V71 CarbonylContact C-O 3.42Å; A66-V71 HydrophobicContact CB-CB 4.5Å; A66-V71 PolarHBondContact O-N 3.07Å; E69-V71 HydrophobicContact CB-CG2 4.49Å; V71-H73 PolarHBondContact O-N 3.15Å
72V90.5Very high91.2Very high9 Ų953.9 Ų53.96%0.05528%0.283CS..PPolyproline II helixtrans-78.3117.1176.6-179.10000109.7L76 R77 A103 I104 E107V72-L76 HydrophobicContact CG1-CB 4.31Å; V72-L76 HydrophobicContact CG1-CD2 4.3Å; V72-L76 HydrophobicContact CG1-CG 4.28Å; V72-R77 HydrophobicContact CG1-CB 4.15Å; V72-A103 HydrophobicContact CG2-CB 3.89Å; V72-I104 HydrophobicContact CG2-CG1 3.76Å; V72-E107 WeakPolarHBondContact CB-OE2 3.49Å
73H92.1Very high90.9Very high43 Ų4352.6 Ų52.620%0.19928%0.276CS..PPolyproline II helixtrans-76.5155.4174.2-166.9-106.6000111.8N63 A66 V71 D75 L76 R77N63-H73 PolarHBondContact ND2-CE1 3.17Å; N63-H73 PolarHBondContact ND2-ND1 2.9Å; N63-H73 VanDerWaalsContact OD1-CB 3.3Å; N63-H73 WeakPolarHBondContact OD1-CB 3.46Å; N63-H73 VanDerWaalsContact OD1-CG 3.31Å; N63-H73 PolarHBondContact OD1-ND1 2.91Å; A66-H73 HydrophobicContact CB-CB 4.16Å; V71-H73 PolarHBondContact O-N 3.15Å; H73-D75 VanDerWaalsContact C-N 3.3Å; H73-D75 IonicContact CE1-OD2 3.84Å; H73-D75 PolarHBondContact CE1-OD2 3.47Å; H73-D75 PolarHBondContact ND1-N 2.87Å; H73-D75 IonicContact ND1-OD2 3.07Å; H73-D75 PolarHBondContact ND1-OD2 3.37Å; H73-D75 PolarHBondContact O-N 3.18Å; H73-L76 WeakPolarHBondContact O-CB 3.47Å; H73-L76 PolarHBondContact O-N 3.39Å; H73-R77 PolarHBondContact O-N 3.08Å
74E90.8Very high90.4Very high154 Ų15453 Ų5372%0.7228%0.278SS*.Hα-helixtrans-57.4-40.1-179.1-64.1-173.8169.300112.6L76 R77 L78E74-L76 VanDerWaalsContact C-N 3.31Å; E74-L76 PolarHBondContact O-N 2.89Å; E74-R77 PolarHBondContact O-N 3.17Å; E74-L78 WeakPolarHBondContact O-CB 3.11Å; E74-L78 PolarHBondContact O-N 3.03Å
75D91Very high89.5Confident46 Ų4653.9 Ų53.925%0.24628%0.282CS..Hα-helixtrans-60.4-39.1175.2-60.7-47.7000112.7Y14 V59 N63 H73 L79Y14-D75 HydrophobicContact CE2-CB 4.46Å; V59-D75 VanDerWaalsContact CG1-OD2 3.24Å; V59-D75 WeakPolarHBondContact CG1-OD2 3.41Å; N63-D75 PolarHBondContact ND2-OD2 3.36Å; H73-D75 VanDerWaalsContact C-N 3.3Å; H73-D75 IonicContact CE1-OD2 3.84Å; H73-D75 PolarHBondContact CE1-OD2 3.47Å; H73-D75 PolarHBondContact ND1-N 2.87Å; H73-D75 IonicContact ND1-OD2 3.07Å; H73-D75 PolarHBondContact ND1-OD2 3.37Å; H73-D75 PolarHBondContact O-N 3.18Å; D75-L79 WeakPolarHBondContact O-CB 3.41Å; D75-L79 PolarHBondContact O-N 3.14Å
76L91Very high88.3Confident2 Ų256.5 Ų56.51%0.0130%0.303CS..Hα-helixtrans-71.6-41.4179.3179.657.3000110.3L7 Y14 V72 H73 E74 L79 L80 I100 I104L7-L76 HydrophobicContact CD1-CD1 3.73Å; L7-L76 HydrophobicContact CD2-CD1 3.73Å; L7-L76 HydrophobicContact CD2-CD2 4.3Å; L7-L76 HydrophobicContact CG-CD1 4.37Å; Y14-L76 HydrophobicContact CD1-CD1 4.16Å; Y14-L76 HydrophobicContact CD2-CB 4.29Å; Y14-L76 HydrophobicContact CD2-CD1 4.2Å; Y14-L76 HydrophobicContact CE1-CD1 4.33Å; Y14-L76 HydrophobicContact CE1-CD2 4.5Å; Y14-L76 HydrophobicContact CE2-CB 3.78Å; Y14-L76 HydrophobicContact CE2-CD1 4.34Å; Y14-L76 HydrophobicContact CG-CD1 4.11Å; V72-L76 HydrophobicContact CG1-CB 4.31Å; V72-L76 HydrophobicContact CG1-CD2 4.3Å; V72-L76 HydrophobicContact CG1-CG 4.28Å; H73-L76 WeakPolarHBondContact O-CB 3.47Å; H73-L76 PolarHBondContact O-N 3.39Å; E74-L76 VanDerWaalsContact C-N 3.31Å; E74-L76 PolarHBondContact O-N 2.89Å; L76-L79 HydrophobicContact CD1-CD2 4.34Å; L76-L79 PolarHBondContact O-N 3.45Å; L76-L80 HydrophobicContact CD1-CD1 4.01Å; L76-L80 HydrophobicContact CD1-CG 4.15Å; L76-L80 HydrophobicContact CG-CD1 4Å; L76-L80 VanDerWaalsContact O-CG 3.25Å; L76-L80 WeakPolarHBondContact O-CG 3.21Å; L76-L80 PolarHBondContact O-N 2.88Å; L76-I100 HydrophobicContact CD2-CG2 4.41Å; L76-I104 HydrophobicContact CD2-CD1 4.44Å
77R90.3Very high87Confident92 Ų9262.4 Ų62.435%0.34733%0.326SS..Hα-helixtrans-58.4-49.2173.7-165.5-177.5-69.81621110.7V72 H73 E74 L79 L80 E81 E107 L108V72-R77 HydrophobicContact CG1-CB 4.15Å; H73-R77 PolarHBondContact O-N 3.08Å; E74-R77 PolarHBondContact O-N 3.17Å; R77-L79 PolarHBondContact O-N 3.3Å; R77-L80 PolarHBondContact O-N 3.08Å; R77-E81 HydrophobicContact CG-CG 4.45Å; R77-E81 WeakPolarHBondContact O-CB 3.48Å; R77-E81 WeakPolarHBondContact O-CG 3.25Å; R77-E81 PolarHBondContact O-N 2.84Å; R77-E107 IonicContact CZ-OE2 2.71Å; R77-E107 IonicContact NE-OE2 3.69Å; R77-E107 PolarHBondContact NE-OE2 2.97Å; R77-E107 VanDerWaalsContact NE-OE2 3.13Å; R77-E107 IonicContact NH2-OE1 2.73Å; R77-E107 PolarHBondContact NH2-OE1 2.95Å; R77-E107 VanDerWaalsContact NH2-OE1 3.07Å; R77-E107 IonicContact NH2-OE2 3.5Å; R77-E107 PolarHBondContact NH2-OE2 3Å; R77-L108 HydrophobicContact CG-CD1 4.34Å; R77-L108 HydrophobicContact CG-CD2 3.95Å; R77-L108 HydrophobicContact CG-CG 4.44Å
78L90.8Very high85.4Confident107 Ų10771 Ų7156%0.5636%0.362SS*.Hα-helixtrans-60.1-43.3178.7-178.563.7000112.5E74 T82E74-L78 WeakPolarHBondContact O-CB 3.11Å; E74-L78 PolarHBondContact O-N 3.03Å; L78-T82 WeakPolarHBondContact O-CB 3.5Å; L78-T82 PolarHBondContact O-N 2.85Å; L78-T82 PolarHBondContact O-OG1 2.89Å
79L90.1Very high84.1Confident7 Ų775 Ų754%0.03737%0.372CS..Hα-helixtrans-58.8-49.4175178.384000111.4L7 A50 C52 D75 L76 R77 T82 H83L7-L79 HydrophobicContact CD1-CD2 4.07Å; A50-L79 HydrophobicContact CB-CD1 4.19Å; C52-L79 HydrophobicContact CB-CD1 3.71Å; D75-L79 WeakPolarHBondContact O-CB 3.41Å; D75-L79 PolarHBondContact O-N 3.14Å; L76-L79 HydrophobicContact CD1-CD2 4.34Å; L76-L79 PolarHBondContact O-N 3.45Å; R77-L79 PolarHBondContact O-N 3.3Å; L79-T82 PolarHBondContact O-N 3.03Å; L79-H83 PolarHBondContact O-CD2 3.06Å; L79-H83 PolarHBondContact O-N 3.48Å; L79-H83 VanDerWaalsContact O-N 3.09Å
80L88.9Confident83Confident0 Ų077.6 Ų77.60%038%0.381CS..Hα-helixtrans-66.7-44.5-175.9-66.9170.6000111L16 L76 R77 T82 L84 L93 I104 L108L16-L80 HydrophobicContact CD1-CD2 4.48Å; L76-L80 HydrophobicContact CD1-CD1 4.01Å; L76-L80 HydrophobicContact CD1-CG 4.15Å; L76-L80 HydrophobicContact CG-CD1 4Å; L76-L80 VanDerWaalsContact O-CG 3.25Å; L76-L80 WeakPolarHBondContact O-CG 3.21Å; L76-L80 PolarHBondContact O-N 2.88Å; R77-L80 PolarHBondContact O-N 3.08Å; L80-T82 PolarHBondContact O-N 3.4Å; L80-L84 HydrophobicContact CB-CD1 4.16Å; L80-L84 HydrophobicContact CD2-CD1 3.71Å; L80-L84 HydrophobicContact CD2-CG 4.39Å; L80-L84 VanDerWaalsContact O-CB 3.25Å; L80-L84 WeakPolarHBondContact O-CB 3.44Å; L80-L84 PolarHBondContact O-N 3.23Å; L80-L93 HydrophobicContact CD2-CD1 4.48Å; L80-L93 HydrophobicContact CD2-CD2 3.95Å; L80-I104 HydrophobicContact CD1-CD1 3.87Å; L80-I104 HydrophobicContact CD1-CG1 4.04Å; L80-I104 HydrophobicContact CD1-CG2 4.13Å; L80-L108 HydrophobicContact CB-CD1 3.81Å; L80-L108 HydrophobicContact CD1-CD1 3.65Å; L80-L108 HydrophobicContact CG-CD1 4.39Å
81E87.8Confident82.5Confident111 Ų11177.6 Ų77.652%0.51938%0.379SS..Hα-helixtrans-64.7-35.8176.2-71.518017500113.2R77 L108R77-E81 HydrophobicContact CG-CG 4.45Å; R77-E81 WeakPolarHBondContact O-CB 3.48Å; R77-E81 WeakPolarHBondContact O-CG 3.25Å; R77-E81 PolarHBondContact O-N 2.84Å; E81-L108 HydrophobicContact CG-CD2 3.76Å; E81-L108 WeakPolarHBondContact OE1-CD2 3.18Å
82T89.5Confident82.2Confident88 Ų8876 Ų7654%0.5437%0.368SS..Hα-helixtrans-74.4-36-178.9-58.70000112.6L78 L79 L80L78-T82 WeakPolarHBondContact O-CB 3.5Å; L78-T82 PolarHBondContact O-N 2.85Å; L78-T82 PolarHBondContact O-OG1 2.89Å; L79-T82 PolarHBondContact O-N 3.03Å; L80-T82 PolarHBondContact O-N 3.4Å
83H86.4Confident82.2Confident80 Ų8075.5 Ų75.537%0.3737%0.365SS..Hα-helixtrans-112.5-18.8-168.5-65.1-67000115.8L16 A50 L79L16-H83 HydrophobicContact CD2-CB 3.64Å; A50-H83 HydrophobicContact CB-CB 4.28Å; A50-H83 WeakPolarHBondContact CB-CD2 3.39Å; A50-H83 WeakPolarHBondContact CB-NE2 3.48Å; L79-H83 PolarHBondContact O-CD2 3.06Å; L79-H83 PolarHBondContact O-N 3.48Å; L79-H83 VanDerWaalsContact O-N 3.09Å
84L83.4Confident82Confident9 Ų973.5 Ų73.55%0.04736%0.356CS..SBendtrans-87133.2174.4-64.5176.6000111.1H5 L16 L80 V91 L93 Y110H5-L84 HydrophobicContact CB-CD2 3.99Å; L16-L84 HydrophobicContact CD1-CD2 4.3Å; L16-L84 HydrophobicContact CD2-CD2 3.88Å; L16-L84 HydrophobicContact CD2-CG 4.25Å; L80-L84 HydrophobicContact CB-CD1 4.16Å; L80-L84 HydrophobicContact CD2-CD1 3.71Å; L80-L84 HydrophobicContact CD2-CG 4.39Å; L80-L84 VanDerWaalsContact O-CB 3.25Å; L80-L84 WeakPolarHBondContact O-CB 3.44Å; L80-L84 PolarHBondContact O-N 3.23Å; L84-V91 HydrophobicContact CD2-CG1 4.2Å; L84-L93 HydrophobicContact CD1-CD1 4.44Å; L84-L93 HydrophobicContact CD1-CD2 4.47Å; L84-Y110 HydrophobicContact CB-CE1 3.82Å; L84-Y110 HydrophobicContact CB-CE2 4.43Å; L84-Y110 HydrophobicContact CD1-CD1 4.06Å; L84-Y110 HydrophobicContact CD1-CD2 3.87Å; L84-Y110 HydrophobicContact CD1-CE1 3.93Å; L84-Y110 HydrophobicContact CD1-CE2 3.74Å; L84-Y110 HydrophobicContact CD1-CG 4.05Å
85P75.1Confident82Confident42 Ų4266.2 Ų66.227%0.27332%0.322SS..PPolyproline II helixtrans-68.3151-179.727-31.7000111.7V91P85-V91 HydrophobicContact CG-CG2 3.68Å
86S68.9Low81.8Confident90 Ų9066.4 Ų66.463%0.62933%0.334SS*.PPolyproline II helixtrans-49.3143.3-175.5-173.50000114K88 K89S86-K88 PolarHBondContact O-N 3.38Å; S86-K89 PolarHBondContact O-N 3.09Å; S86-K89 VanDerWaalsContact O-N 3.15Å
87K64.7Low81.7Confident140 Ų14068.7 Ų68.761%0.60935%0.347SS*.THydrogen-bonded Turntrans-49.9-11.8-168.7-50.2-169.9-171.3-165.40116.8K89 L108K87-K89 VanDerWaalsContact C-N 3.32Å; K87-L108 WeakPolarHBondContact CE-O 3.42Å; K87-L108 PolarHBondContact NZ-O 3.48Å
88K58.7Low81.7Confident203 Ų20368.2 Ų68.288%0.88336%0.355SS*.THydrogen-bonded Turntrans-70.8-21.6176.2-63.1-175.2179.9-178.70113.8S86S86-K88 PolarHBondContact O-N 3.38Å
89K63.9Low81.7Confident138 Ų13869.3 Ų69.360%0.636%0.355SS*.SBendtrans-91.3137.8171.9-68-176.8179.2179.70109.2S86 K87 V91S86-K89 PolarHBondContact O-N 3.09Å; S86-K89 VanDerWaalsContact O-N 3.15Å; K87-K89 VanDerWaalsContact C-N 3.32Å; K89-V91 VanDerWaalsContact C-N 3.27Å; K89-V91 HydrophobicContact CB-CG2 4.36Å; K89-V91 PolarHBondContact O-N 2.69Å
90K68Low81.7Confident177 Ų17769 Ų6977%0.7735%0.354SS*.  trans-68.586.2171-68.7-173.8179.6-176.40109.3
91V79.2Confident81.7Confident11 Ų1169.1 Ų69.17%0.06736%0.355CS..EExtended strand (participates in β ladder)trans-90.9137170.3-176.40000107.8L84 P85 K89L84-V91 HydrophobicContact CD2-CG1 4.2Å; P85-V91 HydrophobicContact CG-CG2 3.68Å; K89-V91 VanDerWaalsContact C-N 3.27Å; K89-V91 HydrophobicContact CB-CG2 4.36Å; K89-V91 PolarHBondContact O-N 2.69Å
92L85.7Confident81.9Confident46 Ų4666.5 Ų66.524%0.24135%0.352CS..EExtended strand (participates in β ladder)trans-114.5133.7171.9-160.966000107.3V2 L3 L4 H5 N111 Q113V2-L92 HydrophobicContact CG1-CB 3.94Å; L3-L92 PolarHBondContact O-N 3.36Å; L4-L92 WeakPolarHBondContact CA-O 3.37Å; L4-L92 HydrophobicContact CD1-CB 3.85Å; L4-L92 HydrophobicContact CD1-CD2 4.09Å; L4-L92 HydrophobicContact CD1-CG 3.98Å; H5-L92 PolarHBondContact N-O 3.31Å; L92-N111 HydrophobicContact CD1-CB 3.88Å; L92-Q113 HydrophobicContact CD1-CB 4.35Å; L92-Q113 HydrophobicContact CD2-CB 4.26Å; L92-Q113 HydrophobicContact CG-CB 4.16Å
93L88.9Confident82Confident0 Ų063.1 Ų63.10%033%0.333CS..EExtended strand (participates in β ladder)trans-112.7114.5179.9-17467.8000109.9H5 L7 L16 L80 L84 V95 I104 N111 C112 Q113H5-L93 HydrophobicContact CB-CD1 4.07Å; H5-L93 CarbonylContact O-C 3.53Å; H5-L93 WeakPolarHBondContact O-CA 3.34Å; L7-L93 HydrophobicContact CB-CD1 4.31Å; L16-L93 HydrophobicContact CD1-CD1 3.96Å; L80-L93 HydrophobicContact CD2-CD1 4.48Å; L80-L93 HydrophobicContact CD2-CD2 3.95Å; L84-L93 HydrophobicContact CD1-CD1 4.44Å; L84-L93 HydrophobicContact CD1-CD2 4.47Å; L93-V95 HydrophobicContact CD2-CG2 3.99Å; L93-V95 HydrophobicContact CG-CG2 3.95Å; L93-I104 HydrophobicContact CD2-CD1 4.21Å; L93-I104 HydrophobicContact CD2-CG2 3.96Å; L93-N111 PolarHBondContact N-O 3.42Å; L93-C112 CarbonylContact O-C 3.53Å; L93-C112 VanDerWaalsContact O-CA 3.24Å; L93-C112 WeakPolarHBondContact O-CA 3.41Å; L93-Q113 PolarHBondContact O-N 2.98Å
94G88.9Confident82.1Confident0 Ų059.3 Ų59.30%032%0.316CS..EExtended strand (participates in β ladder)trans-77122.1169.500000110.8H5 V6 L7 Q113H5-G94 PolarHBondContact O-N 2.91Å; V6-G94 WeakPolarHBondContact CA-O 3.35Å; L7-G94 PolarHBondContact N-O 3.47Å; G94-Q113 WeakPolarHBondContact CA-O 3.42Å
95V91.1Very high82.4Confident2 Ų263.2 Ų63.21%0.01233%0.334CS..  trans-123.4147.2177.7-173.20000109.3L93 D97 I100 I104 C112 Q113 T114L93-V95 HydrophobicContact CD2-CG2 3.99Å; L93-V95 HydrophobicContact CG-CG2 3.95Å; V95-D97 WeakPolarHBondContact CG1-O 3.28Å; V95-I100 HydrophobicContact CG1-CB 4.11Å; V95-I100 HydrophobicContact CG1-CG2 4.1Å; V95-I104 HydrophobicContact CG2-CD1 4.29Å; V95-C112 HydrophobicContact CG2-CB 4.4Å; V95-Q113 PolarHBondContact N-O 3.03Å; V95-Q113 VanDerWaalsContact N-O 3.15Å; V95-T114 HydrophobicContact CB-CG2 4.25Å; V95-T114 WeakPolarHBondContact O-CG2 3.4Å
96G87.4Confident83.1Confident49 Ų4969.5 Ų69.551%0.50536%0.359SS..SBendtrans-74.1-45.9179.200000113.8L122G96-L122 VanDerWaalsContact CA-CD1 3.49Å
97D89Confident83.9Confident51 Ų5169.2 Ų69.227%0.27335%0.348SS..SBendtrans-97.8125.4178-167.4-38.3000111V95 K99 I100 G101V95-D97 WeakPolarHBondContact CG1-O 3.28Å; D97-K99 PolarHBondContact O-N 2.93Å; D97-K99 VanDerWaalsContact OD1-CB 3.31Å; D97-K99 WeakPolarHBondContact OD1-CB 3.44Å; D97-K99 WeakPolarHBondContact OD1-CG 3.33Å; D97-K99 PolarHBondContact OD1-N 2.94Å; D97-I100 HydrophobicContact CB-CB 4.42Å; D97-I100 HydrophobicContact CB-CD1 4.02Å; D97-I100 HydrophobicContact CB-CG1 4.15Å; D97-I100 PolarHBondContact O-N 3.28Å; D97-G101 PolarHBondContact O-N 3.36Å; D97-G101 VanDerWaalsContact O-N 3.07Å
98P89.7Confident84.9Confident81 Ų8163 Ų6353%0.52632%0.321SS..Hα-helixtrans-60.2-26.8175.325.5-35.4000114.4G101 A102 T114P98-G101 PolarHBondContact O-N 3.07Å; P98-A102 PolarHBondContact O-N 3.47Å; P98-T114 HydrophobicContact CB-CG2 4.37Å
99K91.3Very high86Confident130 Ų13055.3 Ų55.357%0.56530%0.301SS*.Hα-helixtrans-67.7-47.2177.4-64.7177.8178.8178.20111.7D97 G101 A102 A103D97-K99 PolarHBondContact O-N 2.93Å; D97-K99 VanDerWaalsContact OD1-CB 3.31Å; D97-K99 WeakPolarHBondContact OD1-CB 3.44Å; D97-K99 WeakPolarHBondContact OD1-CG 3.33Å; D97-K99 PolarHBondContact OD1-N 2.94Å; K99-G101 VanDerWaalsContact C-N 3.29Å; K99-G101 PolarHBondContact O-N 2.88Å; K99-A102 PolarHBondContact O-N 3.21Å; K99-A103 PolarHBondContact O-N 3.37Å
100I90.1Very high86.9Confident1 Ų149.7 Ų49.71%0.00528%0.275CS..Hα-helixtrans-65.2-38.8176.5-59.4173.6000109.5V67 L76 V95 D97 A102 A103 I104V67-I100 HydrophobicContact CB-CD1 4.11Å; V67-I100 HydrophobicContact CG1-CD1 3.7Å; V67-I100 HydrophobicContact CG2-CD1 4.26Å; L76-I100 HydrophobicContact CD2-CG2 4.41Å; V95-I100 HydrophobicContact CG1-CB 4.11Å; V95-I100 HydrophobicContact CG1-CG2 4.1Å; D97-I100 HydrophobicContact CB-CB 4.42Å; D97-I100 HydrophobicContact CB-CD1 4.02Å; D97-I100 HydrophobicContact CB-CG1 4.15Å; D97-I100 PolarHBondContact O-N 3.28Å; I100-A102 PolarHBondContact O-N 2.95Å; I100-A103 PolarHBondContact O-N 3.49Å; I100-I104 HydrophobicContact CG2-CD1 3.73Å; I100-I104 HydrophobicContact CG2-CG1 4.26Å; I100-I104 WeakPolarHBondContact O-CB 3.45Å; I100-I104 VanDerWaalsContact O-CG1 3.28Å; I100-I104 WeakPolarHBondContact O-CG1 3.49Å; I100-I104 PolarHBondContact O-N 3.32Å
101G89.1Confident87.7Confident3 Ų345.8 Ų45.83%0.03126%0.263CS..Hα-helixtrans-57.1-45.2171.700000113.1D97 P98 K99 Q105 C112D97-G101 PolarHBondContact O-N 3.36Å; D97-G101 VanDerWaalsContact O-N 3.07Å; P98-G101 PolarHBondContact O-N 3.07Å; K99-G101 VanDerWaalsContact C-N 3.29Å; K99-G101 PolarHBondContact O-N 2.88Å; G101-Q105 WeakPolarHBondContact O-CB 3.21Å; G101-Q105 PolarHBondContact O-N 3.47Å; G101-C112 PolarHBondContact O-SG 3.34Å; G101-C112 VanDerWaalsContact O-SG 3.37Å
102A90.5Very high88.1Confident55 Ų5546.4 Ų46.446%0.45527%0.268SS..Hα-helixtrans-64.4-44.5175.900000112.3P98 K99 I100 Q105 E106P98-A102 PolarHBondContact O-N 3.47Å; K99-A102 PolarHBondContact O-N 3.21Å; I100-A102 PolarHBondContact O-N 2.95Å; A102-Q105 PolarHBondContact O-N 2.98Å; A102-E106 PolarHBondContact O-N 2.97Å
103A91.2Very high88.1Confident17 Ų1747 Ų4714%0.1427%0.269CS..Hα-helixtrans-65.4-40.5178.500000112.8G70 V72 K99 I100 Q105 E106 E107G70-A103 VanDerWaalsContact O-CB 3.3Å; G70-A103 WeakPolarHBondContact O-CB 3.49Å; V72-A103 HydrophobicContact CG2-CB 3.89Å; K99-A103 PolarHBondContact O-N 3.37Å; I100-A103 PolarHBondContact O-N 3.49Å; A103-Q105 VanDerWaalsContact C-N 3.31Å; A103-Q105 PolarHBondContact O-N 3.43Å; A103-E106 PolarHBondContact O-N 3.47Å; A103-E107 WeakPolarHBondContact O-CG 3.3Å; A103-E107 PolarHBondContact O-N 2.94Å
104I90.3Very high87.9Confident0 Ų049.8 Ų49.80%029%0.286CS..Hα-helixtrans-63.3-39172.3-68.9168.6000110.8L7 V72 L76 L80 L93 V95 I100 L108 G109 Y110L7-I104 HydrophobicContact CD2-CD1 3.99Å; V72-I104 HydrophobicContact CG2-CG1 3.76Å; L76-I104 HydrophobicContact CD2-CD1 4.44Å; L80-I104 HydrophobicContact CD1-CD1 3.87Å; L80-I104 HydrophobicContact CD1-CG1 4.04Å; L80-I104 HydrophobicContact CD1-CG2 4.13Å; L93-I104 HydrophobicContact CD2-CD1 4.21Å; L93-I104 HydrophobicContact CD2-CG2 3.96Å; V95-I104 HydrophobicContact CG2-CD1 4.29Å; I100-I104 HydrophobicContact CG2-CD1 3.73Å; I100-I104 HydrophobicContact CG2-CG1 4.26Å; I100-I104 WeakPolarHBondContact O-CB 3.45Å; I100-I104 VanDerWaalsContact O-CG1 3.28Å; I100-I104 WeakPolarHBondContact O-CG1 3.49Å; I100-I104 PolarHBondContact O-N 3.32Å; I104-L108 HydrophobicContact CG2-CB 4.49Å; I104-L108 HydrophobicContact CG2-CD1 4.33Å; I104-L108 WeakPolarHBondContact O-CA 3.37Å; I104-L108 WeakPolarHBondContact O-CB 3.46Å; I104-L108 PolarHBondContact O-N 2.94Å; I104-G109 PolarHBondContact O-N 3.24Å; I104-Y110 HydrophobicContact CG2-CD2 4.42Å
105Q89.1Confident87.5Confident92 Ų9251.6 Ų51.643%0.4331%0.305SS..Hα-helixtrans-67.4-37177.4-173.6170.27.900112.2G101 A102 A103 G109 Y110G101-Q105 WeakPolarHBondContact O-CB 3.21Å; G101-Q105 PolarHBondContact O-N 3.47Å; A102-Q105 PolarHBondContact O-N 2.98Å; A103-Q105 VanDerWaalsContact C-N 3.31Å; A103-Q105 PolarHBondContact O-N 3.43Å; Q105-G109 WeakPolarHBondContact O-CA 3.46Å; Q105-G109 PolarHBondContact O-N 3.35Å; Q105-G109 VanDerWaalsContact O-N 3.13Å; Q105-Y110 WeakPolarHBondContact CA-O 3.17Å
106E88.8Confident87Confident173 Ų17354.6 Ų54.681%0.80834%0.336SS*.Hα-helixtrans-70.7-51176.2-173.1173.5179.100112.3A102 A103A102-E106 PolarHBondContact O-N 2.97Å; A103-E106 PolarHBondContact O-N 3.47Å
107E86.9Confident86.8Confident84 Ų8453.5 Ų53.539%0.39332%0.32SS..Hα-helixtrans-75.4-46-175.9-66.8-166.5166.100113.5V72 R77 A103V72-E107 WeakPolarHBondContact CB-OE2 3.49Å; R77-E107 IonicContact CZ-OE2 2.71Å; R77-E107 IonicContact NE-OE2 3.69Å; R77-E107 PolarHBondContact NE-OE2 2.97Å; R77-E107 VanDerWaalsContact NE-OE2 3.13Å; R77-E107 IonicContact NH2-OE1 2.73Å; R77-E107 PolarHBondContact NH2-OE1 2.95Å; R77-E107 VanDerWaalsContact NH2-OE1 3.07Å; R77-E107 IonicContact NH2-OE2 3.5Å; R77-E107 PolarHBondContact NH2-OE2 3Å; A103-E107 WeakPolarHBondContact O-CG 3.3Å; A103-E107 PolarHBondContact O-N 2.94Å
108L84.8Confident86.6Confident9 Ų951.1 Ų51.15%0.04731%0.307CS..Hα-helixtrans-104-17.8-170.7-69.2170.2000112.9R77 L80 E81 K87 I104 Y110R77-L108 HydrophobicContact CG-CD1 4.34Å; R77-L108 HydrophobicContact CG-CD2 3.95Å; R77-L108 HydrophobicContact CG-CG 4.44Å; L80-L108 HydrophobicContact CB-CD1 3.81Å; L80-L108 HydrophobicContact CD1-CD1 3.65Å; L80-L108 HydrophobicContact CG-CD1 4.39Å; E81-L108 HydrophobicContact CG-CD2 3.76Å; E81-L108 WeakPolarHBondContact OE1-CD2 3.18Å; K87-L108 WeakPolarHBondContact CE-O 3.42Å; K87-L108 PolarHBondContact NZ-O 3.48Å; I104-L108 HydrophobicContact CG2-CB 4.49Å; I104-L108 HydrophobicContact CG2-CD1 4.33Å; I104-L108 WeakPolarHBondContact O-CA 3.37Å; I104-L108 WeakPolarHBondContact O-CB 3.46Å; I104-L108 PolarHBondContact O-N 2.94Å; L108-Y110 VanDerWaalsContact C-N 3.33Å; L108-Y110 HydrophobicContact CB-CD2 3.52Å; L108-Y110 HydrophobicContact CB-CE2 3.73Å; L108-Y110 HydrophobicContact CD1-CD2 4.29Å; L108-Y110 HydrophobicContact CD1-CE2 4.21Å; L108-Y110 HydrophobicContact CG-CD2 4.49Å; L108-Y110 HydrophobicContact CG-CE2 4.41Å
109G82.2Confident86.4Confident43 Ų4349.5 Ų49.544%0.44330%0.3SS..  trans71.523.6178.900000114.3I104 Q105I104-G109 PolarHBondContact O-N 3.24Å; Q105-G109 WeakPolarHBondContact O-CA 3.46Å; Q105-G109 PolarHBondContact O-N 3.35Å; Q105-G109 VanDerWaalsContact O-N 3.13Å
110Y83Confident86Confident19 Ų1946.4 Ų46.48%0.07529%0.288CS..  trans-86135.8170.3-65.8-70.4000110.3L84 I104 Q105 L108 C112L84-Y110 HydrophobicContact CB-CE1 3.82Å; L84-Y110 HydrophobicContact CB-CE2 4.43Å; L84-Y110 HydrophobicContact CD1-CD1 4.06Å; L84-Y110 HydrophobicContact CD1-CD2 3.87Å; L84-Y110 HydrophobicContact CD1-CE1 3.93Å; L84-Y110 HydrophobicContact CD1-CE2 3.74Å; L84-Y110 HydrophobicContact CD1-CG 4.05Å; I104-Y110 HydrophobicContact CG2-CD2 4.42Å; Q105-Y110 WeakPolarHBondContact CA-O 3.17Å; L108-Y110 VanDerWaalsContact C-N 3.33Å; L108-Y110 HydrophobicContact CB-CD2 3.52Å; L108-Y110 HydrophobicContact CB-CE2 3.73Å; L108-Y110 HydrophobicContact CD1-CD2 4.29Å; L108-Y110 HydrophobicContact CD1-CE2 4.21Å; L108-Y110 HydrophobicContact CG-CD2 4.49Å; L108-Y110 HydrophobicContact CG-CE2 4.41Å; Y110-C112 PolarHBondContact O-N 3.13Å; Y110-C112 VanDerWaalsContact O-N 3.14Å; Y110-C112 PolarHBondContact O-SG 2.83Å
111N85.4Confident85.9Confident95 Ų9546.5 Ų46.551%0.50829%0.288SS..EExtended strand (participates in β ladder)trans-69.5112173.5-72.6-21.2000109.1L92 L93L92-N111 HydrophobicContact CD1-CB 3.88Å; L93-N111 PolarHBondContact N-O 3.42Å
112C86.1Confident85.9Confident24 Ų2447.2 Ų47.216%0.16229%0.291CS..EExtended strand (participates in β ladder)trans-96.6133.9178.7-63.50000110.4L93 V95 G101 Y110L93-C112 CarbonylContact O-C 3.53Å; L93-C112 VanDerWaalsContact O-CA 3.24Å; L93-C112 WeakPolarHBondContact O-CA 3.41Å; V95-C112 HydrophobicContact CG2-CB 4.4Å; G101-C112 PolarHBondContact O-SG 3.34Å; G101-C112 VanDerWaalsContact O-SG 3.37Å; Y110-C112 PolarHBondContact O-N 3.13Å; Y110-C112 VanDerWaalsContact O-N 3.14Å; Y110-C112 PolarHBondContact O-SG 2.83Å
113Q86Confident85.7Confident60 Ų6052.2 Ų52.228%0.2830%0.298SS..EExtended strand (participates in β ladder)trans-113.1140.9171.6-172.5-17412.800108.2L92 L93 G94 V95 I118L92-Q113 HydrophobicContact CD1-CB 4.35Å; L92-Q113 HydrophobicContact CD2-CB 4.26Å; L92-Q113 HydrophobicContact CG-CB 4.16Å; L93-Q113 PolarHBondContact O-N 2.98Å; G94-Q113 WeakPolarHBondContact CA-O 3.42Å; V95-Q113 PolarHBondContact N-O 3.03Å; V95-Q113 VanDerWaalsContact N-O 3.15Å; Q113-I118 HydrophobicContact CB-CD1 3.53Å; Q113-I118 HydrophobicContact CG-CD1 3.53Å
114T84.4Confident85.6Confident58 Ų5851.4 Ų51.436%0.35629%0.292SS..  trans-134.2151.5176.960.80000110V95 P98V95-T114 HydrophobicContact CB-CG2 4.25Å; V95-T114 WeakPolarHBondContact O-CG2 3.4Å; P98-T114 HydrophobicContact CB-CG2 4.37Å
115G81.5Confident85.6Confident38 Ų3851.4 Ų51.439%0.39229%0.292SS..SBendtrans79.4-177.3-177.800000115.3V117 I118G115-V117 PolarHBondContact O-N 2.97Å; G115-I118 PolarHBondContact O-N 3.02Å
116G81.1Confident85.6Confident64 Ų6456 Ų5666%0.6631%0.305SS*.THydrogen-bonded Turntrans54.9-130.1-179.300000113I118 A119G116-I118 PolarHBondContact O-N 3.39Å; G116-I118 VanDerWaalsContact O-N 3.13Å; G116-A119 WeakPolarHBondContact O-CB 3.49Å; G116-A119 PolarHBondContact O-N 3.01Å
117V81.5Confident85.7Confident27 Ų2752 Ų5216%0.16429%0.289CS..Hα-helixtrans-46.3-41.9178.2169.40000113.4E24 L27 G115 A119 E120 I121E24-V117 HydrophobicContact CB-CG2 3.98Å; E24-V117 HydrophobicContact CG-CG2 4.14Å; L27-V117 HydrophobicContact CD1-CB 4.21Å; L27-V117 HydrophobicContact CD1-CG1 3.5Å; L27-V117 HydrophobicContact CD1-CG2 3.81Å; G115-V117 PolarHBondContact O-N 2.97Å; V117-A119 VanDerWaalsContact C-N 3.29Å; V117-A119 PolarHBondContact O-N 3.28Å; V117-E120 PolarHBondContact O-N 3.4Å; V117-I121 HydrophobicContact CG1-CD1 3.61Å; V117-I121 HydrophobicContact CG1-CG1 4.39Å; V117-I121 WeakPolarHBondContact O-CG1 3.5Å; V117-I121 PolarHBondContact O-N 2.71Å; V117-I121 VanDerWaalsContact O-N 3.08Å
118I85.4Confident85.7Confident0 Ų048.7 Ų48.70%027%0.274CS..Hα-helixtrans-68.2-31-176.5-71.6149.5000111.5L4 Q113 G115 G116 L122L4-I118 HydrophobicContact CD1-CD1 4.41Å; Q113-I118 HydrophobicContact CB-CD1 3.53Å; Q113-I118 HydrophobicContact CG-CD1 3.53Å; G115-I118 PolarHBondContact O-N 3.02Å; G116-I118 PolarHBondContact O-N 3.39Å; G116-I118 VanDerWaalsContact O-N 3.13Å; I118-L122 HydrophobicContact CG2-CD1 3.73Å; I118-L122 HydrophobicContact CG2-CG 4.25Å; I118-L122 VanDerWaalsContact O-CB 3.29Å; I118-L122 WeakPolarHBondContact O-CB 3.43Å; I118-L122 WeakPolarHBondContact O-CD1 3.48Å; I118-L122 WeakPolarHBondContact O-CG 3.41Å; I118-L122 PolarHBondContact O-N 3.47Å
119A86.3Confident85.9Confident47 Ų4748.6 Ų48.639%0.38827%0.273SS..Hα-helixtrans-67.7-45.4177.600000112G116 V117 L122 R123G116-A119 WeakPolarHBondContact O-CB 3.49Å; G116-A119 PolarHBondContact O-N 3.01Å; V117-A119 VanDerWaalsContact C-N 3.29Å; V117-A119 PolarHBondContact O-N 3.28Å; A119-L122 PolarHBondContact O-N 3.44Å; A119-R123 WeakPolarHBondContact O-CB 3.44Å; A119-R123 PolarHBondContact O-N 3.43Å
120E83.3Confident86.1Confident66 Ų6648.8 Ų48.831%0.30826%0.262SS..Hα-helixtrans-68.5-34.9176.8-69.4-52.9137.900112.2V117 R123 G124V117-E120 PolarHBondContact O-N 3.4Å; E120-R123 WeakPolarHBondContact O-CB 3.23Å; E120-R123 PolarHBondContact O-N 3.01Å; E120-R123 IonicContact OE1-NH1 3.34Å; E120-R123 PolarHBondContact OE1-NH1 3.49Å; E120-R123 WeakPolarHBondContact OE2-CD 3.45Å; E120-R123 IonicContact OE2-CZ 3.79Å; E120-R123 IonicContact OE2-NE 3.9Å; E120-R123 IonicContact OE2-NH1 2.91Å; E120-R123 PolarHBondContact OE2-NH1 3.48Å; E120-G124 PolarHBondContact O-N 3.44Å
121I86.3Confident86.3Confident3 Ų352.2 Ų52.22%0.01528%0.282CS..Hα-helixtrans-66.4-45.5173.5-69.8176.8000111.1V6 L19 V46 V117 R123 G124 V125V6-I121 HydrophobicContact CG2-CG2 4.25Å; L19-I121 HydrophobicContact CD1-CD1 3.39Å; L19-I121 HydrophobicContact CD1-CG2 4.21Å; L19-I121 HydrophobicContact CD2-CD1 3.99Å; L19-I121 HydrophobicContact CD2-CG2 3.77Å; L19-I121 HydrophobicContact CG-CD1 4.33Å; V46-I121 HydrophobicContact CG2-CG2 4.37Å; V117-I121 HydrophobicContact CG1-CD1 3.61Å; V117-I121 HydrophobicContact CG1-CG1 4.39Å; V117-I121 WeakPolarHBondContact O-CG1 3.5Å; V117-I121 PolarHBondContact O-N 2.71Å; V117-I121 VanDerWaalsContact O-N 3.08Å; I121-R123 VanDerWaalsContact C-N 3.26Å; I121-R123 PolarHBondContact O-N 2.83Å; I121-G124 PolarHBondContact O-N 3.23Å; I121-G124 VanDerWaalsContact O-N 3.16Å; I121-V125 WeakPolarHBondContact O-CG2 3.31Å; I121-V125 PolarHBondContact O-N 3.3Å
122L89.4Confident86.2Confident18 Ų1848.5 Ų48.59%0.09426%0.262CS..Hα-helixtrans-61.8-34.1174.7-76.3168.1000112.3V6 L7 F8 G96 I118 A119 V125 R126V6-L122 HydrophobicContact CG1-CD2 3.39Å; V6-L122 HydrophobicContact CG1-CG 3.82Å; L7-L122 WeakPolarHBondContact O-CD2 3.3Å; F8-L122 HydrophobicContact CB-CD2 4.27Å; F8-L122 HydrophobicContact CD2-CD2 3.83Å; G96-L122 VanDerWaalsContact CA-CD1 3.49Å; I118-L122 HydrophobicContact CG2-CD1 3.73Å; I118-L122 HydrophobicContact CG2-CG 4.25Å; I118-L122 VanDerWaalsContact O-CB 3.29Å; I118-L122 WeakPolarHBondContact O-CB 3.43Å; I118-L122 WeakPolarHBondContact O-CD1 3.48Å; I118-L122 WeakPolarHBondContact O-CG 3.41Å; I118-L122 PolarHBondContact O-N 3.47Å; A119-L122 PolarHBondContact O-N 3.44Å; L122-V125 PolarHBondContact O-N 2.89Å; L122-R126 WeakPolarHBondContact O-CB 3.34Å; L122-R126 PolarHBondContact O-N 2.78Å
123R87.6Confident86.2Confident159 Ų15947.8 Ų47.860%0.626%0.257SS*.Hα-helixtrans-64.7-44.3172.5-174.7-170.5-175.3-179.5-1.3111.5A119 E120 I121 R126 L127A119-R123 WeakPolarHBondContact O-CB 3.44Å; A119-R123 PolarHBondContact O-N 3.43Å; E120-R123 WeakPolarHBondContact O-CB 3.23Å; E120-R123 PolarHBondContact O-N 3.01Å; E120-R123 IonicContact OE1-NH1 3.34Å; E120-R123 PolarHBondContact OE1-NH1 3.49Å; E120-R123 WeakPolarHBondContact OE2-CD 3.45Å; E120-R123 IonicContact OE2-CZ 3.79Å; E120-R123 IonicContact OE2-NE 3.9Å; E120-R123 IonicContact OE2-NH1 2.91Å; E120-R123 PolarHBondContact OE2-NH1 3.48Å; I121-R123 VanDerWaalsContact C-N 3.26Å; I121-R123 PolarHBondContact O-N 2.83Å; R123-R126 WeakPolarHBondContact O-CB 3.29Å; R123-R126 PolarHBondContact O-N 3.45Å; R123-L127 PolarHBondContact O-N 3.15Å; R123-L127 VanDerWaalsContact O-N 3.07Å
124G88.4Confident85.9Confident1 Ų154.9 Ų54.91%0.0129%0.287CS..Hα-helixtrans-61.7-44.5172.400000113.4E120 I121 R126 L127 H128E120-G124 PolarHBondContact O-N 3.44Å; I121-G124 PolarHBondContact O-N 3.23Å; I121-G124 VanDerWaalsContact O-N 3.16Å; G124-R126 VanDerWaalsContact C-N 3.31Å; G124-R126 PolarHBondContact O-N 3.04Å; G124-L127 PolarHBondContact O-N 3.2Å; G124-H128 PolarHBondContact O-CD2 3.04Å; G124-H128 PolarHBondContact O-N 3.19Å; G124-H128 VanDerWaalsContact O-N 3.1Å
125V89.9Confident85.6Confident0 Ų056 Ų560%031%0.31CS..Hα-helixtrans-60.1-43.7175.1174.20000109.9F8 L17 F42 V46 I121 L122 L127 H128 F129 L132F8-V125 HydrophobicContact CB-CG1 3.94Å; F8-V125 HydrophobicContact CD1-CG1 3.8Å; F8-V125 HydrophobicContact CD2-CB 4.17Å; F8-V125 HydrophobicContact CD2-CG1 3.65Å; F8-V125 HydrophobicContact CE1-CG1 4.18Å; F8-V125 HydrophobicContact CE2-CB 4.46Å; F8-V125 HydrophobicContact CE2-CG1 4.06Å; F8-V125 HydrophobicContact CG-CB 4.47Å; F8-V125 HydrophobicContact CG-CG1 3.51Å; F8-V125 HydrophobicContact CZ-CG1 4.3Å; L17-V125 HydrophobicContact CD1-CG1 4.09Å; L17-V125 HydrophobicContact CD1-CG2 4.3Å; L17-V125 HydrophobicContact CD2-CG1 4.37Å; L17-V125 HydrophobicContact CD2-CG2 4.22Å; F42-V125 HydrophobicContact CE1-CG2 4.07Å; F42-V125 HydrophobicContact CZ-CB 4.49Å; F42-V125 HydrophobicContact CZ-CG2 3.82Å; V46-V125 HydrophobicContact CG1-CG2 4.32Å; I121-V125 WeakPolarHBondContact O-CG2 3.31Å; I121-V125 PolarHBondContact O-N 3.3Å; L122-V125 PolarHBondContact O-N 2.89Å; V125-L127 VanDerWaalsContact C-N 3.35Å; V125-L127 PolarHBondContact O-N 2.96Å; V125-H128 PolarHBondContact O-N 2.89Å; V125-F129 HydrophobicContact CG1-CD2 4.06Å; V125-F129 VanDerWaalsContact O-CA 3.26Å; V125-F129 WeakPolarHBondContact O-CA 3.45Å; V125-F129 VanDerWaalsContact O-CB 3.25Å; V125-F129 WeakPolarHBondContact O-CB 3.39Å; V125-F129 PolarHBondContact O-N 2.91Å; V125-L132 HydrophobicContact CG1-CD1 4.09Å
126R89.7Confident85.7Confident188 Ų18855.3 Ų55.371%0.70930%0.297SS*.Hα-helixtrans-60.8-40.4177.9-171.1178.8-64.5-174.5-0.3112.9F8 L122 R123 G124F8-R126 HydrophobicContact CE2-CB 3.93Å; F8-R126 HydrophobicContact CZ-CB 4.04Å; F8-R126 HydrophobicContact CZ-CG 4.31Å; L122-R126 WeakPolarHBondContact O-CB 3.34Å; L122-R126 PolarHBondContact O-N 2.78Å; R123-R126 WeakPolarHBondContact O-CB 3.29Å; R123-R126 PolarHBondContact O-N 3.45Å; G124-R126 VanDerWaalsContact C-N 3.31Å; G124-R126 PolarHBondContact O-N 3.04Å
127L89.4Confident86Confident89 Ų8956 Ų5647%0.46629%0.288SS..Hα-helixtrans-66.3-43.8178.5-179.961.6000112L37 R123 G124 V125L37-L127 HydrophobicContact CD2-CD2 3.95Å; R123-L127 PolarHBondContact O-N 3.15Å; R123-L127 VanDerWaalsContact O-N 3.07Å; G124-L127 PolarHBondContact O-N 3.2Å; V125-L127 VanDerWaalsContact C-N 3.35Å; V125-L127 PolarHBondContact O-N 2.96Å
128H88.6Confident86.2Confident15 Ų1558.8 Ų58.87%0.06930%0.302CS..Hα-helixtrans-100.17-173.1-63-61.3000114.5V36 L37 L39 F42 G124 V125 H130 N131 L132V36-H128 PolarHBondContact O-CD2 3.05Å; V36-H128 PolarHBondContact O-NE2 3.28Å; L37-H128 PolarHBondContact O-CE1 3.06Å; L37-H128 VanDerWaalsContact O-CE1 3.23Å; L37-H128 PolarHBondContact O-NE2 3.05Å; L39-H128 HydrophobicContact CD1-CB 3.84Å; F42-H128 HydrophobicContact CD1-CB 4.23Å; F42-H128 AromaticContact CD1-CD2 3.68Å; F42-H128 AromaticContact CG-CD2 3.87Å; G124-H128 PolarHBondContact O-CD2 3.04Å; G124-H128 PolarHBondContact O-N 3.19Å; G124-H128 VanDerWaalsContact O-N 3.1Å; V125-H128 PolarHBondContact O-N 2.89Å; H128-H130 VanDerWaalsContact C-N 3.3Å; H128-H130 PolarHBondContact O-N 3.46Å; H128-H130 VanDerWaalsContact O-N 3.17Å; H128-N131 PolarHBondContact O-N 3.38Å; H128-L132 PolarHBondContact O-N 2.86Å
129F87.6Confident86.4Confident6 Ų665 Ų653%0.02633%0.334CS..Hα-helixtrans-55.6-41.2-167.1-170.7-110.7000113.8F8 H10 A15 F51 V125 N131 L132 V133 L136F8-F129 AromaticContact CD1-CD2 3.53Å; F8-F129 HydrophobicContact CD1-CD2 3.53Å; F8-F129 AromaticContact CD1-CE2 3.44Å; F8-F129 HydrophobicContact CD1-CE2 3.44Å; F8-F129 VanDerWaalsContact CD1-CE2 3.44Å; F8-F129 HydrophobicContact CD1-CG 4.3Å; F8-F129 HydrophobicContact CD1-CZ 4.15Å; F8-F129 HydrophobicContact CE1-CB 4.27Å; F8-F129 HydrophobicContact CE1-CD1 4.19Å; F8-F129 AromaticContact CE1-CD2 3.35Å; F8-F129 HydrophobicContact CE1-CD2 3.35Å; F8-F129 HydrophobicContact CE1-CE1 4.43Å; F8-F129 AromaticContact CE1-CE2 3.64Å; F8-F129 HydrophobicContact CE1-CE2 3.64Å; F8-F129 AromaticContact CE1-CG 3.66Å; F8-F129 HydrophobicContact CE1-CG 3.66Å; F8-F129 HydrophobicContact CE1-CZ 4.17Å; F8-F129 HydrophobicContact CZ-CD2 4.36Å; F8-F129 HydrophobicContact CZ-CG 4.47Å; H10-F129 HydrophobicContact CB-CD1 4.35Å; H10-F129 HydrophobicContact CB-CE1 3.68Å; H10-F129 HydrophobicContact CB-CZ 3.81Å; H10-F129 AromaticContact CD2-CD1 3.79Å; H10-F129 AromaticContact CD2-CE1 3.92Å; H10-F129 AromaticContact CE1-CE1 3.96Å; H10-F129 AromaticContact CG-CD1 3.72Å; H10-F129 AromaticContact CG-CE1 3.34Å; H10-F129 AromaticContact ND1-CD1 3.86Å; H10-F129 AromaticContact ND1-CE1 3.38Å; H10-F129 WeakPolarHBondContact ND1-CE1 3.49Å; A15-F129 HydrophobicContact CB-CE2 3.83Å; A15-F129 HydrophobicContact CB-CZ 4.33Å; F51-F129 HydrophobicContact CD2-CZ 4.45Å; F51-F129 AromaticContact CE2-CZ 3.99Å; F51-F129 HydrophobicContact CE2-CZ 3.99Å; V125-F129 HydrophobicContact CG1-CD2 4.06Å; V125-F129 VanDerWaalsContact O-CA 3.26Å; V125-F129 WeakPolarHBondContact O-CA 3.45Å; V125-F129 VanDerWaalsContact O-CB 3.25Å; V125-F129 WeakPolarHBondContact O-CB 3.39Å; V125-F129 PolarHBondContact O-N 2.91Å; F129-N131 PolarHBondContact O-N 3.23Å; F129-L132 PolarHBondContact O-N 2.76Å; F129-L132 VanDerWaalsContact O-N 3.15Å; F129-V133 HydrophobicContact CE1-CG2 4.2Å; F129-V133 HydrophobicContact CE2-CG2 3.86Å; F129-V133 HydrophobicContact CZ-CG2 3.69Å; F129-V133 PolarHBondContact O-N 2.95Å; F129-L136 HydrophobicContact CD1-CD2 3.58Å; F129-L136 HydrophobicContact CE1-CD2 3.45Å; F129-L136 VanDerWaalsContact CE1-CD2 3.45Å
130H87.4Confident86.6Confident48 Ų4864.9 Ų64.922%0.22233%0.331CS..Hα-helixtrans-61.8-28.7178.157.8-103.1000112.8H128 L136 D138H128-H130 VanDerWaalsContact C-N 3.3Å; H128-H130 PolarHBondContact O-N 3.46Å; H128-H130 VanDerWaalsContact O-N 3.17Å; H130-L136 VanDerWaalsContact O-O 3.1Å; H130-D138 HydrophobicContact CB-CB 4.23Å; H130-D138 IonicContact CE1-OD1 3.81Å; H130-D138 IonicContact CG-OD1 2.67Å; H130-D138 IonicContact ND1-OD1 3.12Å; H130-D138 PolarHBondContact ND1-OD1 3.39Å; H130-D138 VanDerWaalsContact ND1-OD1 3.12Å
131N86.4Confident86.8Confident90 Ų9062 Ų6248%0.48132%0.318SS..Hα-helixtrans-86.6-21.8176.5-64.9-44.2000113.3L39 H128 F129L39-N131 HydrophobicContact CD1-CB 3.75Å; L39-N131 HydrophobicContact CD2-CB 3.97Å; H128-N131 PolarHBondContact O-N 3.38Å; F129-N131 PolarHBondContact O-N 3.23Å
132L84.8Confident87Confident17 Ų1764.5 Ų64.59%0.08934%0.336CS..Hα-helixtrans-77.1-33.8-179.6-66.9172.6000112.5L17 F42 L48 V125 H128 F129L17-L132 HydrophobicContact CD2-CD1 4.04Å; F42-L132 HydrophobicContact CE1-CD1 4.28Å; L48-L132 WeakPolarHBondContact CD2-O 3.48Å; V125-L132 HydrophobicContact CG1-CD1 4.09Å; H128-L132 PolarHBondContact O-N 2.86Å; F129-L132 PolarHBondContact O-N 2.76Å; F129-L132 VanDerWaalsContact O-N 3.15Å
133V84.2Confident87.2Confident10 Ų1071.2 Ų71.26%0.06136%0.364CS..SBendtrans-98.4112.4-178.7-178.60000110.2L48 F51 F129 G135 L136L48-V133 HydrophobicContact CD2-CG2 4.27Å; F51-V133 HydrophobicContact CD1-CG1 3.64Å; F51-V133 HydrophobicContact CD2-CG2 4.22Å; F51-V133 HydrophobicContact CE1-CG1 3.68Å; F51-V133 HydrophobicContact CE2-CG2 4.43Å; F51-V133 HydrophobicContact CG-CG1 4.14Å; F51-V133 HydrophobicContact CG-CG2 4.29Å; F51-V133 HydrophobicContact CZ-CG1 4.23Å; F129-V133 HydrophobicContact CE1-CG2 4.2Å; F129-V133 HydrophobicContact CE2-CG2 3.86Å; F129-V133 HydrophobicContact CZ-CG2 3.69Å; F129-V133 PolarHBondContact O-N 2.95Å; V133-G135 PolarHBondContact O-N 3.43Å; V133-L136 HydrophobicContact CB-CB 3.99Å; V133-L136 HydrophobicContact CB-CD2 4.28Å; V133-L136 HydrophobicContact CG1-CB 4.13Å; V133-L136 PolarHBondContact O-N 3.07Å; V133-L136 VanDerWaalsContact O-N 3.09Å
134K80.9Confident87.4Confident209 Ų20965.1 Ų65.191%0.90935%0.348SS*.THydrogen-bonded Turntrans-56.9122.4178.2-65.5-174.8179.7-176.40111.1
135G78.7Confident87.6Confident81 Ų8169.7 Ų69.784%0.83537%0.369SS*.THydrogen-bonded Turntrans88.9-3.5178.500000115.2V133V133-G135 PolarHBondContact O-N 3.43Å
136L82.6Confident87.8Confident24 Ų2474.7 Ų74.713%0.12640%0.395CS..  trans-81.2135.2166.7-169.662.5000108.9V12 F129 H130 V133 A141V12-L136 HydrophobicContact CG2-CD1 4.15Å; F129-L136 HydrophobicContact CD1-CD2 3.58Å; F129-L136 HydrophobicContact CE1-CD2 3.45Å; F129-L136 VanDerWaalsContact CE1-CD2 3.45Å; H130-L136 VanDerWaalsContact O-O 3.1Å; V133-L136 HydrophobicContact CB-CB 3.99Å; V133-L136 HydrophobicContact CB-CD2 4.28Å; V133-L136 HydrophobicContact CG1-CB 4.13Å; V133-L136 PolarHBondContact O-N 3.07Å; V133-L136 VanDerWaalsContact O-N 3.09Å; L136-A141 HydrophobicContact CD1-CB 4.15Å; L136-A141 HydrophobicContact CD2-CB 4.25Å; L136-A141 HydrophobicContact CG-CB 4.22Å
137T87.2Confident88Confident77 Ų7767.4 Ų67.447%0.47238%0.378SS..  trans-112154.3170.464.30000108.4L139 S140 A141T137-L139 PolarHBondContact O-N 3.24Å; T137-S140 PolarHBondContact N-OG 2.92Å; T137-S140 PolarHBondContact O-N 2.82Å; T137-S140 VanDerWaalsContact O-N 3.08Å; T137-S140 PolarHBondContact O-OG 2.96Å; T137-S140 VanDerWaalsContact O-OG 3.08Å; T137-S140 WeakPolarHBondContact OG1-CB 3.24Å; T137-S140 PolarHBondContact OG1-N 2.78Å; T137-S140 PolarHBondContact OG1-OG 3.23Å; T137-A141 WeakPolarHBondContact O-CB 3.36Å; T137-A141 PolarHBondContact O-N 2.9Å
138D86.5Confident88.2Confident86 Ų8664.5 Ų64.546%0.4636%0.363SS..Hα-helixtrans-59.2-38.7178.3-16655.1000111.4H130 S140 A141 C142H130-D138 HydrophobicContact CB-CB 4.23Å; H130-D138 IonicContact CE1-OD1 3.81Å; H130-D138 IonicContact CG-OD1 2.67Å; H130-D138 IonicContact ND1-OD1 3.12Å; H130-D138 PolarHBondContact ND1-OD1 3.39Å; H130-D138 VanDerWaalsContact ND1-OD1 3.12Å; D138-S140 PolarHBondContact O-N 3.5Å; D138-A141 PolarHBondContact O-N 3.32Å; D138-C142 WeakPolarHBondContact O-CB 3.44Å; D138-C142 PolarHBondContact O-N 3.37Å; D138-C142 PolarHBondContact O-SG 3.44Å
139L89.8Confident88.5Confident130 Ų13065.3 Ų65.368%0.68138%0.376SS*.Hα-helixtrans-61.7-40.1173.5-64.9176.2000113.4T137 K143T137-L139 PolarHBondContact O-N 3.24Å; L139-K143 WeakPolarHBondContact O-CB 3.37Å; L139-K143 VanDerWaalsContact O-CG 3.28Å; L139-K143 WeakPolarHBondContact O-CG 3.3Å; L139-K143 PolarHBondContact O-N 3.27Å
140S89.5Confident88.7Confident46 Ų4669.5 Ų69.532%0.32240%0.395SS..Hα-helixtrans-76.4-34.6178.564.50000112.1T137 D138 K143 A144T137-S140 PolarHBondContact N-OG 2.92Å; T137-S140 PolarHBondContact O-N 2.82Å; T137-S140 VanDerWaalsContact O-N 3.08Å; T137-S140 PolarHBondContact O-OG 2.96Å; T137-S140 VanDerWaalsContact O-OG 3.08Å; T137-S140 WeakPolarHBondContact OG1-CB 3.24Å; T137-S140 PolarHBondContact OG1-N 2.78Å; T137-S140 PolarHBondContact OG1-OG 3.23Å; D138-S140 PolarHBondContact O-N 3.5Å; S140-K143 PolarHBondContact O-N 2.95Å; S140-A144 WeakPolarHBondContact O-CB 3.4Å; S140-A144 PolarHBondContact O-N 2.7Å
141A88.3Confident88.9Confident4 Ų469.1 Ų69.13%0.03340%0.398CS..Hα-helixtrans-59.4-49.8169.200000111.7L136 T137 D138 K143 A144 Q145L136-A141 HydrophobicContact CD1-CB 4.15Å; L136-A141 HydrophobicContact CD2-CB 4.25Å; L136-A141 HydrophobicContact CG-CB 4.22Å; T137-A141 WeakPolarHBondContact O-CB 3.36Å; T137-A141 PolarHBondContact O-N 2.9Å; D138-A141 PolarHBondContact O-N 3.32Å; A141-K143 PolarHBondContact O-N 3.29Å; A141-A144 PolarHBondContact O-N 3.13Å; A141-Q145 WeakPolarHBondContact O-CG 3.29Å; A141-Q145 PolarHBondContact O-N 3.04Å
142C91.2Very high89.3Confident57 Ų5768 Ų6839%0.38539%0.388SS..Hα-helixtrans-60.9-42.8176.4-68.40000112.5D138 A144 Q145 L146D138-C142 WeakPolarHBondContact O-CB 3.44Å; D138-C142 PolarHBondContact O-N 3.37Å; D138-C142 PolarHBondContact O-SG 3.44Å; C142-A144 VanDerWaalsContact C-N 3.35Å; C142-A144 PolarHBondContact O-N 3.4Å; C142-Q145 PolarHBondContact O-N 3.1Å; C142-L146 WeakPolarHBondContact O-CB 3.34Å; C142-L146 PolarHBondContact O-N 3.06Å
143K92.6Very high89.7Confident158 Ų15870.5 Ų70.569%0.68741%0.406SS*.Hα-helixtrans-61.4-41.3175.7-77.2173.9-178.9179.50111.7L139 S140 A141 L146 G147L139-K143 WeakPolarHBondContact O-CB 3.37Å; L139-K143 VanDerWaalsContact O-CG 3.28Å; L139-K143 WeakPolarHBondContact O-CG 3.3Å; L139-K143 PolarHBondContact O-N 3.27Å; S140-K143 PolarHBondContact O-N 2.95Å; A141-K143 PolarHBondContact O-N 3.29Å; K143-L146 PolarHBondContact O-N 3.41Å; K143-G147 PolarHBondContact O-N 2.95Å
144A91.4Very high90Very high32 Ų3277.1 Ų77.126%0.26443%0.43SS..Hα-helixtrans-66-44.8176.400000112.2V12 S140 A141 C142 L146 G147 L148V12-A144 HydrophobicContact CG2-CB 3.62Å; S140-A144 WeakPolarHBondContact O-CB 3.4Å; S140-A144 PolarHBondContact O-N 2.7Å; A141-A144 PolarHBondContact O-N 3.13Å; C142-A144 VanDerWaalsContact C-N 3.35Å; C142-A144 PolarHBondContact O-N 3.4Å; A144-L146 PolarHBondContact O-N 2.93Å; A144-G147 PolarHBondContact O-N 2.9Å; A144-L148 WeakPolarHBondContact O-CB 3.44Å; A144-L148 PolarHBondContact O-N 2.74Å
145Q93.1Very high90.3Very high96 Ų9669.3 Ų69.345%0.44940%0.404SS..Hα-helixtrans-58.4-44.6174.7-71.2173.17.600112H10 A11 A141 C142 L148 G149H10-Q145 PolarHBondContact NE2-NE2 3.45Å; A11-Q145 HydrophobicContact CB-CB 4.29Å; A11-Q145 HydrophobicContact CB-CG 3.73Å; A141-Q145 WeakPolarHBondContact O-CG 3.29Å; A141-Q145 PolarHBondContact O-N 3.04Å; C142-Q145 PolarHBondContact O-N 3.1Å; Q145-L148 PolarHBondContact O-N 2.95Å; Q145-G149 PolarHBondContact O-N 3.11Å
146L94Very high90.9Very high106 Ų10670 Ų7056%0.55539%0.385SS*.Hα-helixtrans-62.3-44.5176.6-178.165.5000112C142 K143 A144 H150C142-L146 WeakPolarHBondContact O-CB 3.34Å; C142-L146 PolarHBondContact O-N 3.06Å; K143-L146 PolarHBondContact O-N 3.41Å; A144-L146 PolarHBondContact O-N 2.93Å; L146-H150 VanDerWaalsContact CD1-CE1 3.5Å; L146-H150 WeakPolarHBondContact CD1-CE1 3.22Å; L146-H150 WeakPolarHBondContact O-CB 3.32Å; L146-H150 PolarHBondContact O-N 2.92Å; L146-H150 PolarHBondContact O-ND1 3.09Å
147G93.1Very high91.1Very high34 Ų3474.2 Ų74.235%0.35141%0.411SS..Hα-helixtrans-63.5-45.1178.100000112.8K143 A144 S151K143-G147 PolarHBondContact O-N 2.95Å; A144-G147 PolarHBondContact O-N 2.9Å; G147-S151 WeakPolarHBondContact O-CB 3.39Å; G147-S151 PolarHBondContact O-N 2.95Å; G147-S151 VanDerWaalsContact O-N 3.11Å; G147-S151 PolarHBondContact O-OG 2.95Å
148L94.2Very high91Very high28 Ų2879.2 Ų79.215%0.14743%0.426CS..Hα-helixtrans-67.7-45.8177.4-176.859.3000111.4A11 A60 L61 A64 A144 Q145 H150 S151 Y152A11-L148 HydrophobicContact CB-CB 4.29Å; A11-L148 HydrophobicContact CB-CD2 3.67Å; A60-L148 HydrophobicContact CB-CD1 4.12Å; L61-L148 HydrophobicContact CB-CD1 4.37Å; A64-L148 HydrophobicContact CB-CD1 4.08Å; A64-L148 HydrophobicContact CB-CD2 4.23Å; A64-L148 HydrophobicContact CB-CG 4.44Å; A144-L148 WeakPolarHBondContact O-CB 3.44Å; A144-L148 PolarHBondContact O-N 2.74Å; Q145-L148 PolarHBondContact O-N 2.95Å; L148-H150 PolarHBondContact O-N 3.23Å; L148-S151 PolarHBondContact O-N 2.93Å; L148-Y152 WeakPolarHBondContact O-CB 3.48Å; L148-Y152 PolarHBondContact O-N 3.07Å
149G94.5Very high90.5Very high33 Ų3380.9 Ų80.934%0.3443%0.429SS..Hα-helixtrans-58.2-46.9177.700000112.5Q145 S151 S153Q145-G149 PolarHBondContact O-N 3.11Å; G149-S151 VanDerWaalsContact C-N 3.33Å; G149-S151 PolarHBondContact O-N 2.81Å; G149-S153 WeakPolarHBondContact O-CB 3.43Å; G149-S153 PolarHBondContact O-N 3.1Å; G149-S153 PolarHBondContact O-OG 3.44Å
150H93.2Very high89.6Confident94 Ų9478.1 Ų78.144%0.43542%0.415SS..Hα-helixtrans-59.5-41.4172.6-76.2157.1000112.9L146 L148 R154L146-H150 VanDerWaalsContact CD1-CE1 3.5Å; L146-H150 WeakPolarHBondContact CD1-CE1 3.22Å; L146-H150 WeakPolarHBondContact O-CB 3.32Å; L146-H150 PolarHBondContact O-N 2.92Å; L146-H150 PolarHBondContact O-ND1 3.09Å; L148-H150 PolarHBondContact O-N 3.23Å; H150-R154 VanDerWaalsContact O-CB 3.31Å; H150-R154 WeakPolarHBondContact O-CB 3.31Å; H150-R154 WeakPolarHBondContact O-CD 3.42Å; H150-R154 WeakPolarHBondContact O-CG 3.37Å; H150-R154 PolarHBondContact O-N 3.42Å
151S91.8Very high88.7Confident39 Ų3981.1 Ų81.127%0.27343%0.431SS..Hα-helixtrans-69.2-45.2-177.9-57.50000111.6G147 L148 G149 R154 A155G147-S151 WeakPolarHBondContact O-CB 3.39Å; G147-S151 PolarHBondContact O-N 2.95Å; G147-S151 VanDerWaalsContact O-N 3.11Å; G147-S151 PolarHBondContact O-OG 2.95Å; L148-S151 PolarHBondContact O-N 2.93Å; G149-S151 VanDerWaalsContact C-N 3.33Å; G149-S151 PolarHBondContact O-N 2.81Å; S151-R154 PolarHBondContact O-N 3.01Å; S151-A155 WeakPolarHBondContact O-CB 3.42Å; S151-A155 PolarHBondContact O-N 3.44Å
152Y94Very high87.6Confident68 Ų6885.8 Ų85.827%0.26746%0.456SS..Hα-helixtrans-61.3-49.3175.8179.2-98.7000112L61 N65 S68 L148 R154 A155 K156L61-Y152 HydrophobicContact CD1-CD2 4.38Å; N65-Y152 WeakPolarHBondContact OD1-CD2 3.49Å; N65-Y152 WeakPolarHBondContact OD1-CE2 3.26Å; S68-Y152 PolarHBondContact OG-OH 3.03Å; L148-Y152 WeakPolarHBondContact O-CB 3.48Å; L148-Y152 PolarHBondContact O-N 3.07Å; Y152-R154 PolarHBondContact O-N 3.02Å; Y152-A155 PolarHBondContact O-N 2.99Å; Y152-K156 HydrophobicContact CD1-CG 4.48Å; Y152-K156 HydrophobicContact CE1-CG 4.12Å; Y152-K156 HydrophobicContact CE2-CD 4.47Å; Y152-K156 HydrophobicContact CE2-CG 4.13Å; Y152-K156 PolarHBondContact O-N 3.49Å; Y152-K156 VanDerWaalsContact OH-CE 3.29Å; Y152-K156 WeakPolarHBondContact OH-CE 3.13Å
153S92.7Very high86.6Confident69 Ų6986.6 Ų86.648%0.48345%0.451SS..Hα-helixtrans-62.1-41.9176.8-60.30000112.4G149 A155 V157G149-S153 WeakPolarHBondContact O-CB 3.43Å; G149-S153 PolarHBondContact O-N 3.1Å; G149-S153 PolarHBondContact O-OG 3.44Å; S153-A155 VanDerWaalsContact C-N 3.35Å; S153-A155 PolarHBondContact O-N 2.91Å; S153-V157 VanDerWaalsContact O-CB 3.31Å; S153-V157 WeakPolarHBondContact O-CB 3.39Å; S153-V157 VanDerWaalsContact O-CG2 3.26Å; S153-V157 WeakPolarHBondContact O-CG2 3.5Å; S153-V157 PolarHBondContact O-N 3.31Å
154R90.1Very high85.8Confident149 Ų14980.7 Ų80.756%0.56243%0.428SS*.Hα-helixtrans-63.9-39176.5-74.7169.1-172.7-177.83.8112.3H150 S151 Y152 K158 F159H150-R154 VanDerWaalsContact O-CB 3.31Å; H150-R154 WeakPolarHBondContact O-CB 3.31Å; H150-R154 WeakPolarHBondContact O-CD 3.42Å; H150-R154 WeakPolarHBondContact O-CG 3.37Å; H150-R154 PolarHBondContact O-N 3.42Å; S151-R154 PolarHBondContact O-N 3.01Å; Y152-R154 PolarHBondContact O-N 3.02Å; R154-K158 PolarHBondContact O-N 3.4Å; R154-K158 VanDerWaalsContact O-N 3.14Å; R154-F159 HydrophobicContact CB-CB 4.22Å; R154-F159 HydrophobicContact CG-CB 4.27Å; R154-F159 PolarHBondContact O-N 3.38Å
155A88.7Confident85.7Confident44 Ų4480.6 Ų80.636%0.36442%0.423SS..Hα-helixtrans-66.5-52.4176.600000111.5L61 S151 Y152 S153 V157 K158L61-A155 HydrophobicContact CD1-CB 4.38Å; L61-A155 HydrophobicContact CD2-CB 4.37Å; S151-A155 WeakPolarHBondContact O-CB 3.42Å; S151-A155 PolarHBondContact O-N 3.44Å; Y152-A155 PolarHBondContact O-N 2.99Å; S153-A155 VanDerWaalsContact C-N 3.35Å; S153-A155 PolarHBondContact O-N 2.91Å; A155-V157 VanDerWaalsContact C-N 3.34Å; A155-V157 PolarHBondContact O-N 3.26Å; A155-K158 PolarHBondContact O-N 2.95Å
156K89.7Confident85.5Confident97 Ų9779.6 Ų79.642%0.42242%0.42SS..Hα-helixtrans-61.4-37.7179.4-70.7-79.4177.7178.50112.6E69 Y152 K158E69-K156 IonicContact OE1-NZ 3.1Å; E69-K156 PolarHBondContact OE1-NZ 2.92Å; Y152-K156 HydrophobicContact CD1-CG 4.48Å; Y152-K156 HydrophobicContact CE1-CG 4.12Å; Y152-K156 HydrophobicContact CE2-CD 4.47Å; Y152-K156 HydrophobicContact CE2-CG 4.13Å; Y152-K156 PolarHBondContact O-N 3.49Å; Y152-K156 VanDerWaalsContact OH-CE 3.29Å; Y152-K156 WeakPolarHBondContact OH-CE 3.13Å; K156-K158 VanDerWaalsContact C-N 3.28Å; K156-K158 PolarHBondContact O-N 3Å
157V88.1Confident85.4Confident111 Ų11178.5 Ų78.567%0.67341%0.414SS*.THydrogen-bonded Turntrans-80-6.5176.7177.50000112.8S153 A155 F159S153-V157 VanDerWaalsContact O-CB 3.31Å; S153-V157 WeakPolarHBondContact O-CB 3.39Å; S153-V157 VanDerWaalsContact O-CG2 3.26Å; S153-V157 WeakPolarHBondContact O-CG2 3.5Å; S153-V157 PolarHBondContact O-N 3.31Å; A155-V157 VanDerWaalsContact C-N 3.34Å; A155-V157 PolarHBondContact O-N 3.26Å; V157-F159 VanDerWaalsContact C-N 3.28Å; V157-F159 PolarHBondContact O-N 2.91Å
158K83.9Confident85.4Confident182 Ų18277 Ų7779%0.79140%0.397SS*.THydrogen-bonded Turntrans50.346.8-171.9-59.8-179.3-179.6176.40112.2R154 A155 K156 N160R154-K158 PolarHBondContact O-N 3.4Å; R154-K158 VanDerWaalsContact O-N 3.14Å; A155-K158 PolarHBondContact O-N 2.95Å; K156-K158 VanDerWaalsContact C-N 3.28Å; K156-K158 PolarHBondContact O-N 3Å; K158-N160 PolarHBondContact O-N 3.1Å
159F77.7Confident85.3Confident122 Ų12276.9 Ų76.954%0.53540%0.397SS..  trans-60.2104.7-174.1-175.5-92.7000111.7R154 V157 V161 V164R154-F159 HydrophobicContact CB-CB 4.22Å; R154-F159 HydrophobicContact CG-CB 4.27Å; R154-F159 PolarHBondContact O-N 3.38Å; V157-F159 VanDerWaalsContact C-N 3.28Å; V157-F159 PolarHBondContact O-N 2.91Å; F159-V161 PolarHBondContact O-N 2.69Å; F159-V164 HydrophobicContact CE1-CG2 4.05Å; F159-V164 HydrophobicContact CZ-CG2 4.16Å
160N70.6Confident85.3Confident72 Ų7280.7 Ų80.739%0.38541%0.406SS..  trans-81.8107.3-173.8-172-16.3000111K158 N162 R163K158-N160 PolarHBondContact O-N 3.1Å; N160-N162 PolarHBondContact O-N 3.12Å; N160-N162 VanDerWaalsContact O-N 3.09Å; N160-N162 VanDerWaalsContact OD1-CB 3.3Å; N160-N162 WeakPolarHBondContact OD1-CB 3.46Å; N160-N162 PolarHBondContact OD1-N 3.1Å; N160-R163 HydrophobicContact CB-CB 4.45Å; N160-R163 HydrophobicContact CB-CG 4.13Å; N160-R163 WeakPolarHBondContact O-CB 3.37Å; N160-R163 PolarHBondContact O-N 3.25Å
161V70.2Confident85.3Confident109 Ų10976.8 Ų76.866%0.66139%0.389SS*.G310 helixtrans-57.7-24.5178.4-175.70000112.6F159 R163 V164F159-V161 PolarHBondContact O-N 2.69Å; V161-R163 VanDerWaalsContact C-N 3.27Å; V161-R163 PolarHBondContact O-N 3.09Å; V161-V164 VanDerWaalsContact O-CG2 3.23Å; V161-V164 WeakPolarHBondContact O-CG2 3.5Å; V161-V164 PolarHBondContact O-N 3.02Å
162N65.7Low85.5Confident101 Ų10175 Ų7554%0.5438%0.376SS..G310 helixtrans-74.6-15.8176.6-59.2-41.8000113.3N160 V164 V292N160-N162 PolarHBondContact O-N 3.12Å; N160-N162 VanDerWaalsContact O-N 3.09Å; N160-N162 VanDerWaalsContact OD1-CB 3.3Å; N160-N162 WeakPolarHBondContact OD1-CB 3.46Å; N160-N162 PolarHBondContact OD1-N 3.1Å; N162-V164 VanDerWaalsContact C-N 3.34Å; N162-V292 WeakPolarHBondContact O-CG2 3.44Å
163R68.9Low85.5Confident75 Ų7575.3 Ų75.328%0.28339%0.388SS..G310 helixtrans-91.912.6176.3-66.4-173.8173.4-130.7-12.3113.9N160 V161 D165 C384 S386 E387N160-R163 HydrophobicContact CB-CB 4.45Å; N160-R163 HydrophobicContact CB-CG 4.13Å; N160-R163 WeakPolarHBondContact O-CB 3.37Å; N160-R163 PolarHBondContact O-N 3.25Å; V161-R163 VanDerWaalsContact C-N 3.27Å; V161-R163 PolarHBondContact O-N 3.09Å; R163-D165 VanDerWaalsContact C-N 3.31Å; R163-D165 PolarHBondContact O-N 3.49Å; R163-C384 PolarHBondContact NH1-O 2.81Å; R163-S386 PolarHBondContact NH1-O 3.46Å; R163-S386 PolarHBondContact NH2-O 3.39Å; R163-E387 PolarHBondContact NH2-O 2.87Å
164V76.6Confident85.7Confident34 Ų3475.4 Ų75.421%0.20638%0.383CS..  trans-73.688-179.71790000109.9F159 V161 N162 N166 M167F159-V164 HydrophobicContact CE1-CG2 4.05Å; F159-V164 HydrophobicContact CZ-CG2 4.16Å; V161-V164 VanDerWaalsContact O-CG2 3.23Å; V161-V164 WeakPolarHBondContact O-CG2 3.5Å; V161-V164 PolarHBondContact O-N 3.02Å; N162-V164 VanDerWaalsContact C-N 3.34Å; V164-N166 HydrophobicContact CG1-CB 3.9Å; V164-N166 PolarHBondContact O-N 3.33Å; V164-M167 HydrophobicContact CB-CG 4.46Å; V164-M167 HydrophobicContact CG1-CE 4.25Å; V164-M167 HydrophobicContact CG1-CG 4.06Å; V164-M167 PolarHBondContact O-N 2.88Å
165D88.3Confident85.9Confident29 Ų2968.8 Ų68.816%0.15536%0.359CS..THydrogen-bonded Turntrans-56.1-29.3172.760.6-10.8000113.2R163 M167 I168 I169 I309 S314 L315R163-D165 VanDerWaalsContact C-N 3.31Å; R163-D165 PolarHBondContact O-N 3.49Å; D165-M167 PolarHBondContact O-N 3.37Å; D165-M167 VanDerWaalsContact O-N 3.12Å; D165-I168 WeakPolarHBondContact O-CA 3.48Å; D165-I168 VanDerWaalsContact O-CB 3.32Å; D165-I168 WeakPolarHBondContact O-CB 3.31Å; D165-I168 PolarHBondContact O-N 3.25Å; D165-I169 WeakPolarHBondContact O-CG1 3.31Å; D165-I169 PolarHBondContact O-N 3.47Å; D165-I169 VanDerWaalsContact O-N 3.08Å; D165-I309 HydrophobicContact CB-CG2 4.39Å; D165-S314 WeakPolarHBondContact OD2-CA 3.4Å; D165-S314 VanDerWaalsContact OD2-CB 3.27Å; D165-S314 WeakPolarHBondContact OD2-CB 3.39Å; D165-S314 PolarHBondContact OD2-OG 3.26Å; D165-L315 HydrophobicContact CB-CB 4.22Å; D165-L315 PolarHBondContact OD2-N 3.45Å
166N89.7Confident86.1Confident75 Ų7568.9 Ų68.940%0.40135%0.353SS..Hα-helixtrans-51.3-35.8173-169.19.1000112.6V164 I168 I169 Q170V164-N166 HydrophobicContact CG1-CB 3.9Å; V164-N166 PolarHBondContact O-N 3.33Å; N166-I168 VanDerWaalsContact C-N 3.29Å; N166-I168 PolarHBondContact O-N 3.29Å; N166-I169 PolarHBondContact O-N 3.02Å; N166-Q170 WeakPolarHBondContact O-CG 3.49Å; N166-Q170 PolarHBondContact O-N 3.28Å; N166-Q170 PolarHBondContact OD1-NE2 2.92Å
167M91.2Very high86.4Confident84 Ų8468.2 Ų68.241%0.41435%0.351SS..Hα-helixtrans-63-35.6175.8-62.4-62.1102.300112.3V164 D165 S171V164-M167 HydrophobicContact CB-CG 4.46Å; V164-M167 HydrophobicContact CG1-CE 4.25Å; V164-M167 HydrophobicContact CG1-CG 4.06Å; V164-M167 PolarHBondContact O-N 2.88Å; D165-M167 PolarHBondContact O-N 3.37Å; D165-M167 VanDerWaalsContact O-N 3.12Å; M167-S171 VanDerWaalsContact O-CB 3.27Å; M167-S171 WeakPolarHBondContact O-CB 3.43Å; M167-S171 PolarHBondContact O-N 3.3Å; M167-S171 PolarHBondContact O-OG 2.95Å
168I92.7Very high86.8Confident1 Ų163.5 Ų63.51%0.00532%0.323CS..Hα-helixtrans-69.6-43.9175.7-66.3174.6000109.9D165 N166 S171 I172 L285 K288 M289 V292 A306D165-I168 WeakPolarHBondContact O-CA 3.48Å; D165-I168 VanDerWaalsContact O-CB 3.32Å; D165-I168 WeakPolarHBondContact O-CB 3.31Å; D165-I168 PolarHBondContact O-N 3.25Å; N166-I168 VanDerWaalsContact C-N 3.29Å; N166-I168 PolarHBondContact O-N 3.29Å; I168-S171 PolarHBondContact O-N 3.38Å; I168-I172 WeakPolarHBondContact O-CG2 3.29Å; I168-I172 PolarHBondContact O-N 3.14Å; I168-L285 HydrophobicContact CG2-CD1 3.94Å; I168-K288 HydrophobicContact CG1-CB 4.29Å; I168-M289 HydrophobicContact CD1-CE 4.18Å; I168-M289 HydrophobicContact CD1-SD 4.26Å; I168-M289 HydrophobicContact CG2-CE 3.65Å; I168-V292 HydrophobicContact CD1-CB 3.69Å; I168-V292 HydrophobicContact CD1-CG1 3.99Å; I168-V292 HydrophobicContact CD1-CG2 3.85Å; I168-A306 HydrophobicContact CG2-CB 3.86Å
169I93.4Very high87.2Confident27 Ų2757.2 Ų57.214%0.13830%0.297CS..Hα-helixtrans-60-48.4179.6-59.8176.8000111D165 N166 I172 S173 I309 A310 G313D165-I169 WeakPolarHBondContact O-CG1 3.31Å; D165-I169 PolarHBondContact O-N 3.47Å; D165-I169 VanDerWaalsContact O-N 3.08Å; N166-I169 PolarHBondContact O-N 3.02Å; I169-I172 WeakPolarHBondContact O-CG2 3.31Å; I169-S173 WeakPolarHBondContact O-CB 3.25Å; I169-S173 PolarHBondContact O-N 3.37Å; I169-S173 VanDerWaalsContact O-N 3.12Å; I169-I309 HydrophobicContact CD1-CG2 4.34Å; I169-I309 HydrophobicContact CG1-CG2 4.03Å; I169-A310 HydrophobicContact CG1-CB 4.47Å; I169-A310 HydrophobicContact CG2-CB 4.1Å; I169-G313 WeakPolarHBondContact CD1-O 3.44Å
170Q93.7Very high88.1Confident113 Ų11357.3 Ų57.353%0.52830%0.298SS..Hα-helixtrans-65.8-40.9176.6-59.8-53.3-34.900111.8N166 I172 S173 L174N166-Q170 WeakPolarHBondContact O-CG 3.49Å; N166-Q170 PolarHBondContact O-N 3.28Å; N166-Q170 PolarHBondContact OD1-NE2 2.92Å; Q170-I172 PolarHBondContact O-N 2.88Å; Q170-S173 PolarHBondContact O-N 3Å; Q170-L174 VanDerWaalsContact O-CB 3.29Å; Q170-L174 WeakPolarHBondContact O-CB 3.21Å; Q170-L174 PolarHBondContact O-N 3.13Å
171S94.4Very high89.2Confident11 Ų1156.1 Ų56.18%0.07729%0.291CS..Hα-helixtrans-63.6-42.2-179.5-61.30000112.9M167 I168 L175 Y284M167-S171 VanDerWaalsContact O-CB 3.27Å; M167-S171 WeakPolarHBondContact O-CB 3.43Å; M167-S171 PolarHBondContact O-N 3.3Å; M167-S171 PolarHBondContact O-OG 2.95Å; I168-S171 PolarHBondContact O-N 3.38Å; S171-L175 WeakPolarHBondContact O-CB 3.43Å; S171-L175 PolarHBondContact O-N 3.01Å; S171-Y284 WeakPolarHBondContact OG-CE1 3.08Å
172I94.7Very high90.4Very high3 Ų352 Ų522%0.01527%0.265CS..Hα-helixtrans-73.6-36.8178.2-169.260.3000112I168 I169 Q170 L174 L175 D176 L285 A306 R307 A310I168-I172 WeakPolarHBondContact O-CG2 3.29Å; I168-I172 PolarHBondContact O-N 3.14Å; I169-I172 WeakPolarHBondContact O-CG2 3.31Å; Q170-I172 PolarHBondContact O-N 2.88Å; I172-L174 VanDerWaalsContact C-N 3.3Å; I172-L174 PolarHBondContact O-N 3.27Å; I172-L175 PolarHBondContact O-N 3.45Å; I172-D176 WeakPolarHBondContact O-CB 3.4Å; I172-D176 PolarHBondContact O-N 3.07Å; I172-L285 HydrophobicContact CD1-CD2 4.01Å; I172-A306 HydrophobicContact CB-CB 3.9Å; I172-A306 HydrophobicContact CD1-CB 4.22Å; I172-A306 HydrophobicContact CG1-CB 3.94Å; I172-A306 HydrophobicContact CG2-CB 4.26Å; I172-R307 HydrophobicContact CD1-CG 4.03Å; I172-R307 HydrophobicContact CG1-CG 3.65Å; I172-A310 HydrophobicContact CG2-CB 3.64Å
173S94.8Very high91.7Very high74 Ų7451.1 Ų51.152%0.51726%0.26SS..Hα-helixtrans-64.6-36.3174.2-169.70000112I169 Q170 Q177I169-S173 WeakPolarHBondContact O-CB 3.25Å; I169-S173 PolarHBondContact O-N 3.37Å; I169-S173 VanDerWaalsContact O-N 3.12Å; Q170-S173 PolarHBondContact O-N 3Å; S173-Q177 WeakPolarHBondContact O-CB 3.18Å; S173-Q177 PolarHBondContact O-N 3.03Å
174L96.1Very high93Very high71 Ų7151.4 Ų51.437%0.37227%0.271SS..Hα-helixtrans-69.7-41.3174.2179.759.9000111.4Q170 I172 Q177 L178 Y277 L281Q170-L174 VanDerWaalsContact O-CB 3.29Å; Q170-L174 WeakPolarHBondContact O-CB 3.21Å; Q170-L174 PolarHBondContact O-N 3.13Å; I172-L174 VanDerWaalsContact C-N 3.3Å; I172-L174 PolarHBondContact O-N 3.27Å; L174-Q177 PolarHBondContact O-N 2.98Å; L174-L178 HydrophobicContact CD1-CD1 4.32Å; L174-L178 HydrophobicContact CD1-CG 4.2Å; L174-L178 HydrophobicContact CG-CD1 4.03Å; L174-L178 HydrophobicContact CG-CG 4.37Å; L174-L178 WeakPolarHBondContact O-CB 3.27Å; L174-L178 VanDerWaalsContact O-CG 3.29Å; L174-L178 WeakPolarHBondContact O-CG 3.42Å; L174-L178 PolarHBondContact O-N 3.36Å; L174-Y277 HydrophobicContact CD2-CE1 4.32Å; L174-L281 HydrophobicContact CB-CD2 4.12Å; L174-L281 HydrophobicContact CD2-CD2 3.8Å; L174-L281 HydrophobicContact CG-CD2 3.79Å
175L95Very high93.8Very high10 Ų1053.2 Ų53.25%0.05228%0.276CS..Hα-helixtrans-63.2-47.4176.7-167.4158.2000111.6S171 I172 Q177 L178 D179 L281 H282 L285S171-L175 WeakPolarHBondContact O-CB 3.43Å; S171-L175 PolarHBondContact O-N 3.01Å; I172-L175 PolarHBondContact O-N 3.45Å; L175-Q177 PolarHBondContact O-N 3.17Å; L175-L178 PolarHBondContact O-N 3.02Å; L175-D179 PolarHBondContact O-N 3.06Å; L175-L281 HydrophobicContact CB-CD2 4.17Å; L175-H282 HydrophobicContact CD1-CB 4.07Å; L175-L285 HydrophobicContact CD1-CD2 4.32Å
176D93.6Very high94Very high45 Ų4551.8 Ų51.824%0.24127%0.269CS..Hα-helixtrans-65.8-18.4177.4-74.3-11.7000113.2I172 K180 R307I172-D176 WeakPolarHBondContact O-CB 3.4Å; I172-D176 PolarHBondContact O-N 3.07Å; D176-K180 VanDerWaalsContact O-CE 3.29Å; D176-K180 WeakPolarHBondContact O-CE 3.43Å; D176-R307 IonicContact OD1-CZ 2.95Å; D176-R307 IonicContact OD1-NE 2.7Å; D176-R307 PolarHBondContact OD1-NE 2.82Å; D176-R307 IonicContact OD1-NH2 3.32Å; D176-R307 PolarHBondContact OD1-NH2 2.88Å; D176-R307 IonicContact OD2-CZ 3.93Å; D176-R307 IonicContact OD2-NE 2.81Å; D176-R307 PolarHBondContact OD2-NE 3.26Å; D176-R307 VanDerWaalsContact OD2-NE 3.11Å; D176-R307 IonicContact OD2-NH2 3.48Å
177Q95.7Very high94.1Very high83 Ų8352.1 Ų52.139%0.38827%0.269SS..Hα-helixtrans-86-47.6171.7-175.655.340.900111.5S173 L174 L175 D179 K180 D181S173-Q177 WeakPolarHBondContact O-CB 3.18Å; S173-Q177 PolarHBondContact O-N 3.03Å; L174-Q177 PolarHBondContact O-N 2.98Å; L175-Q177 PolarHBondContact O-N 3.17Å; Q177-D179 VanDerWaalsContact C-N 3.25Å; Q177-D179 PolarHBondContact O-N 3.17Å; Q177-K180 WeakPolarHBondContact O-CB 3.32Å; Q177-K180 PolarHBondContact O-N 3.49Å; Q177-D181 WeakPolarHBondContact CG-OD2 3.48Å; Q177-D181 VanDerWaalsContact NE2-CG 3.26Å; Q177-D181 PolarHBondContact NE2-OD1 3.23Å; Q177-D181 PolarHBondContact NE2-OD2 3.08Å; Q177-D181 PolarHBondContact O-N 3.23Å
178L95.1Very high94.2Very high13 Ų1355.9 Ų55.97%0.06828%0.278CS..Hα-helixtrans-55.7-38.9175.5-74.9171.4000112.1L174 L175 K180 D181 I182 L274 Y277 L281L174-L178 HydrophobicContact CD1-CD1 4.32Å; L174-L178 HydrophobicContact CD1-CG 4.2Å; L174-L178 HydrophobicContact CG-CD1 4.03Å; L174-L178 HydrophobicContact CG-CG 4.37Å; L174-L178 WeakPolarHBondContact O-CB 3.27Å; L174-L178 VanDerWaalsContact O-CG 3.29Å; L174-L178 WeakPolarHBondContact O-CG 3.42Å; L174-L178 PolarHBondContact O-N 3.36Å; L175-L178 PolarHBondContact O-N 3.02Å; L178-K180 VanDerWaalsContact C-N 3.29Å; L178-K180 PolarHBondContact O-N 2.81Å; L178-D181 PolarHBondContact O-N 2.97Å; L178-I182 HydrophobicContact CB-CD1 4.36Å; L178-I182 VanDerWaalsContact O-CB 3.26Å; L178-I182 WeakPolarHBondContact O-CB 3.49Å; L178-I182 WeakPolarHBondContact O-CD1 3.41Å; L178-I182 WeakPolarHBondContact O-CG1 3.47Å; L178-I182 PolarHBondContact O-N 3.36Å; L178-L274 HydrophobicContact CD2-CD2 4.06Å; L178-Y277 HydrophobicContact CD1-CD1 3.79Å; L178-Y277 HydrophobicContact CD1-CE1 3.88Å; L178-L281 HydrophobicContact CD1-CD2 3.9Å
179D93.4Very high94.2Very high49 Ų4955.8 Ų55.826%0.26228%0.278SS..Hα-helixtrans-61.2-36.5177.6-78.519.8000112.5L175 Q177 N183 R278L175-D179 PolarHBondContact O-N 3.06Å; Q177-D179 VanDerWaalsContact C-N 3.25Å; Q177-D179 PolarHBondContact O-N 3.17Å; D179-N183 WeakPolarHBondContact O-CB 3.29Å; D179-N183 PolarHBondContact O-N 3.47Å; D179-R278 VanDerWaalsContact CG-NH2 3.33Å; D179-R278 IonicContact OD1-CZ 3Å; D179-R278 IonicContact OD1-NE 3.44Å; D179-R278 PolarHBondContact OD1-NE 3.07Å; D179-R278 IonicContact OD1-NH2 3.89Å; D179-R278 PolarHBondContact OD1-NH2 2.82Å; D179-R278 IonicContact OD2-CZ 3.13Å; D179-R278 IonicContact OD2-NE 3.35Å; D179-R278 IonicContact OD2-NH2 3.9Å; D179-R278 PolarHBondContact OD2-NH2 3.17Å
180K95.4Very high94.1Very high124 Ų12456.1 Ų56.154%0.53928%0.277SS..Hα-helixtrans-74.5-42.5175.7-61.5169.3-167.11560111.5D176 Q177 L178 N183 T184D176-K180 VanDerWaalsContact O-CE 3.29Å; D176-K180 WeakPolarHBondContact O-CE 3.43Å; Q177-K180 WeakPolarHBondContact O-CB 3.32Å; Q177-K180 PolarHBondContact O-N 3.49Å; L178-K180 VanDerWaalsContact C-N 3.29Å; L178-K180 PolarHBondContact O-N 2.81Å; K180-N183 PolarHBondContact O-N 2.61Å; K180-T184 WeakPolarHBondContact O-CB 3.27Å; K180-T184 PolarHBondContact O-N 2.87Å; K180-T184 PolarHBondContact O-OG1 2.87Å
181D95.4Very high93.9Very high48 Ų4856.2 Ų56.226%0.25728%0.278SS..Hα-helixtrans-68-44.3-177.9-65.7-22.6000110.7Q177 L178 N183 T184 F185Q177-D181 WeakPolarHBondContact CG-OD2 3.48Å; Q177-D181 VanDerWaalsContact NE2-CG 3.26Å; Q177-D181 PolarHBondContact NE2-OD1 3.23Å; Q177-D181 PolarHBondContact NE2-OD2 3.08Å; Q177-D181 PolarHBondContact O-N 3.23Å; L178-D181 PolarHBondContact O-N 2.97Å; D181-N183 VanDerWaalsContact C-N 3.34Å; D181-N183 PolarHBondContact O-N 3.12Å; D181-T184 PolarHBondContact O-N 3.12Å; D181-F185 HydrophobicContact CB-CD2 4.35Å; D181-F185 HydrophobicContact CB-CE2 3.92Å; D181-F185 HydrophobicContact CB-CZ 4.3Å; D181-F185 VanDerWaalsContact O-CB 3.31Å; D181-F185 WeakPolarHBondContact O-CB 3.23Å; D181-F185 VanDerWaalsContact O-CD2 3.22Å; D181-F185 WeakPolarHBondContact O-CD2 3.47Å; D181-F185 WeakPolarHBondContact O-CG 3.44Å; D181-F185 PolarHBondContact O-N 3.17Å
182I94.3Very high93.8Very high22 Ų2260.2 Ų60.211%0.11329%0.291CS..Hα-helixtrans-57.9-45.2173.2-69.9163.6000110.5L178 S186 L274 R278L178-I182 HydrophobicContact CB-CD1 4.36Å; L178-I182 VanDerWaalsContact O-CB 3.26Å; L178-I182 WeakPolarHBondContact O-CB 3.49Å; L178-I182 WeakPolarHBondContact O-CD1 3.41Å; L178-I182 WeakPolarHBondContact O-CG1 3.47Å; L178-I182 PolarHBondContact O-N 3.36Å; I182-S186 VanDerWaalsContact O-CB 3.22Å; I182-S186 WeakPolarHBondContact O-CB 3.34Å; I182-S186 PolarHBondContact O-N 3.05Å; I182-S186 PolarHBondContact O-OG 2.66Å; I182-L274 HydrophobicContact CD1-CB 4.46Å; I182-L274 HydrophobicContact CG1-CB 4.08Å; I182-R278 HydrophobicContact CD1-CB 3.85Å; I182-R278 HydrophobicContact CD1-CG 4.12Å
183N93.4Very high93.6Very high82 Ų8260.1 Ų60.144%0.43929%0.291SS..Hα-helixtrans-65.2-45.7177.8-173.555.6000111.9D179 K180 D181 F185 S186 M187 N207D179-N183 WeakPolarHBondContact O-CB 3.29Å; D179-N183 PolarHBondContact O-N 3.47Å; K180-N183 PolarHBondContact O-N 2.61Å; D181-N183 VanDerWaalsContact C-N 3.34Å; D181-N183 PolarHBondContact O-N 3.12Å; N183-F185 PolarHBondContact O-N 3.47Å; N183-S186 PolarHBondContact O-N 2.91Å; N183-M187 WeakPolarHBondContact O-CG 3.45Å; N183-M187 PolarHBondContact O-N 3.41Å; N183-N207 PolarHBondContact OD1-ND2 3.3Å
184T95.1Very high93.4Very high82 Ų8257.3 Ų57.350%0.50327%0.273SS..Hα-helixtrans-63.1-43.1179.7-55.10000111.7K180 D181 R188K180-T184 WeakPolarHBondContact O-CB 3.27Å; K180-T184 PolarHBondContact O-N 2.87Å; K180-T184 PolarHBondContact O-OG1 2.87Å; D181-T184 PolarHBondContact O-N 3.12Å; T184-R188 PolarHBondContact O-N 3.09Å
185F94.6Very high93.1Very high71 Ų7161.5 Ų61.531%0.31129%0.285SS..Hα-helixtrans-71.5-38.4177.2-59.9-27.5000112D181 N183 M187 R188 V189 F267 V271 L274D181-F185 HydrophobicContact CB-CD2 4.35Å; D181-F185 HydrophobicContact CB-CE2 3.92Å; D181-F185 HydrophobicContact CB-CZ 4.3Å; D181-F185 VanDerWaalsContact O-CB 3.31Å; D181-F185 WeakPolarHBondContact O-CB 3.23Å; D181-F185 VanDerWaalsContact O-CD2 3.22Å; D181-F185 WeakPolarHBondContact O-CD2 3.47Å; D181-F185 WeakPolarHBondContact O-CG 3.44Å; D181-F185 PolarHBondContact O-N 3.17Å; N183-F185 PolarHBondContact O-N 3.47Å; F185-M187 PolarHBondContact O-N 2.93Å; F185-R188 CarbonylContact O-C 3.57Å; F185-R188 WeakPolarHBondContact O-CA 3.45Å; F185-R188 WeakPolarHBondContact O-CB 3.42Å; F185-R188 PolarHBondContact O-N 2.97Å; F185-R188 VanDerWaalsContact O-N 3.08Å; F185-V189 WeakPolarHBondContact O-CG2 3.3Å; F185-V189 PolarHBondContact O-N 2.85Å; F185-F267 HydrophobicContact CB-CE1 4.43Å; F185-F267 HydrophobicContact CB-CE2 4.37Å; F185-F267 HydrophobicContact CB-CZ 3.72Å; F185-F267 HydrophobicContact CD1-CE2 4.3Å; F185-F267 AromaticContact CD1-CZ 3.93Å; F185-F267 HydrophobicContact CD1-CZ 3.93Å; F185-F267 HydrophobicContact CG-CE2 4.28Å; F185-F267 AromaticContact CG-CZ 3.96Å; F185-F267 HydrophobicContact CG-CZ 3.96Å; F185-V271 HydrophobicContact CB-CG2 3.52Å; F185-V271 HydrophobicContact CG-CG2 4.5Å; F185-L274 HydrophobicContact CD2-CD1 3.96Å; F185-L274 HydrophobicContact CE2-CD1 3.99Å
186S92.5Very high92.7Very high0 Ų061.1 Ų61.10%028%0.283CS..Hα-helixtrans-62.5-42.1174.7-580000111.8I182 N183 R188 V189 R190 N207I182-S186 VanDerWaalsContact O-CB 3.22Å; I182-S186 WeakPolarHBondContact O-CB 3.34Å; I182-S186 PolarHBondContact O-N 3.05Å; I182-S186 PolarHBondContact O-OG 2.66Å; N183-S186 PolarHBondContact O-N 2.91Å; S186-R188 VanDerWaalsContact C-N 3.3Å; S186-R188 PolarHBondContact O-N 2.95Å; S186-V189 PolarHBondContact O-N 3.07Å; S186-R190 WeakPolarHBondContact O-CG 3.34Å; S186-R190 PolarHBondContact O-N 3.49Å; S186-N207 WeakPolarHBondContact CB-OD1 3.44Å
187M91.9Very high92.5Very high81 Ų8159 Ų5940%0.39927%0.272SS..Hα-helixtrans-61.8-38.8171.5-70.3-59.9-61.900111.5N183 F185 R190 E191N183-M187 WeakPolarHBondContact O-CG 3.45Å; N183-M187 PolarHBondContact O-N 3.41Å; F185-M187 PolarHBondContact O-N 2.93Å; M187-R190 PolarHBondContact O-N 2.92Å; M187-E191 WeakPolarHBondContact O-CG 3.25Å; M187-E191 PolarHBondContact O-N 3.5Å
188R92.3Very high92.2Very high163 Ų16357.4 Ų57.462%0.61527%0.269SS*.Hα-helixtrans-65.7-38.7174.7-173.462.360.1169.40.8112.8T184 F185 S186 W192 F267T184-R188 PolarHBondContact O-N 3.09Å; F185-R188 CarbonylContact O-C 3.57Å; F185-R188 WeakPolarHBondContact O-CA 3.45Å; F185-R188 WeakPolarHBondContact O-CB 3.42Å; F185-R188 PolarHBondContact O-N 2.97Å; F185-R188 VanDerWaalsContact O-N 3.08Å; S186-R188 VanDerWaalsContact C-N 3.3Å; S186-R188 PolarHBondContact O-N 2.95Å; R188-W192 VanDerWaalsContact O-CB 3.27Å; R188-W192 WeakPolarHBondContact O-CB 3.44Å; R188-W192 PolarHBondContact O-N 2.88Å; R188-F267 HydrophobicContact CB-CE1 3.9Å; R188-F267 HydrophobicContact CB-CZ 4.25Å; R188-F267 HydrophobicContact CG-CE1 3.82Å; R188-F267 HydrophobicContact CG-CZ 4.21Å
189V92.3Very high91.9Very high0 Ų058.8 Ų58.80%028%0.275CS..Hα-helixtrans-63-43.3173175.90000110.3F185 S186 W192 Y193 Y210 F267 V271F185-V189 WeakPolarHBondContact O-CG2 3.3Å; F185-V189 PolarHBondContact O-N 2.85Å; S186-V189 PolarHBondContact O-N 3.07Å; V189-W192 PolarHBondContact O-N 3.39Å; V189-Y193 WeakPolarHBondContact O-CB 3.44Å; V189-Y193 PolarHBondContact O-N 3.12Å; V189-Y210 HydrophobicContact CG1-CD1 4.29Å; V189-Y210 HydrophobicContact CG1-CE1 4.11Å; V189-F267 HydrophobicContact CG2-CD1 3.47Å; V189-F267 VanDerWaalsContact CG2-CD1 3.47Å; V189-F267 HydrophobicContact CG2-CE1 3.57Å; V189-F267 HydrophobicContact CG2-CG 4.48Å; V189-V271 HydrophobicContact CG2-CG2 4.08Å
190R91.6Very high91.7Very high33 Ų3356.4 Ų56.413%0.12526%0.262CS..Hα-helixtrans-60.7-47.1177.4-77174.1171.2-173.6-2113.4S186 M187 G194 V201 I204 N205 D206 N207 Y210S186-R190 WeakPolarHBondContact O-CG 3.34Å; S186-R190 PolarHBondContact O-N 3.49Å; M187-R190 PolarHBondContact O-N 2.92Å; R190-G194 VanDerWaalsContact O-CA 3.23Å; R190-G194 WeakPolarHBondContact O-CA 3.44Å; R190-G194 PolarHBondContact O-N 3.1Å; R190-V201 HydrophobicContact CB-CG2 4.49Å; R190-I204 PolarHBondContact NH2-O 2.84Å; R190-N205 PolarHBondContact NH2-O 3.29Å; R190-D206 PolarHBondContact NH2-O 2.96Å; R190-N207 PolarHBondContact NE-OD1 3.21Å; R190-N207 PolarHBondContact NH1-OD1 2.91Å; R190-N207 PolarHBondContact NH2-OD1 3.39Å; R190-Y210 HydrophobicContact CB-CE1 4.18Å; R190-Y210 HydrophobicContact CG-CD1 3.61Å; R190-Y210 HydrophobicContact CG-CD2 4.23Å; R190-Y210 HydrophobicContact CG-CE1 3.59Å; R190-Y210 HydrophobicContact CG-CE2 4.19Å; R190-Y210 HydrophobicContact CG-CG 3.96Å
191E91Very high91.4Very high116 Ų11653 Ų5354%0.54225%0.252SS..Hα-helixtrans-64.4-45.8176.3-67.5-61134.500111M187 G194 Y195M187-E191 WeakPolarHBondContact O-CG 3.25Å; M187-E191 PolarHBondContact O-N 3.5Å; E191-G194 PolarHBondContact O-N 3.18Å; E191-Y195 WeakPolarHBondContact O-CD2 3.36Å; E191-Y195 PolarHBondContact O-N 3.25Å
192W90.5Very high91Very high95 Ų9559 Ų5936%0.3628%0.275SS..Hα-helixtrans-68.4-45.7-174.6-161.5-2.2000112.6R188 V189 N263 I264 F267R188-W192 VanDerWaalsContact O-CB 3.27Å; R188-W192 WeakPolarHBondContact O-CB 3.44Å; R188-W192 PolarHBondContact O-N 2.88Å; V189-W192 PolarHBondContact O-N 3.39Å; W192-N263 HydrophobicContact CH2-CB 3.89Å; W192-N263 HydrophobicContact CZ2-CB 4.06Å; W192-I264 HydrophobicContact CB-CD1 4.43Å; W192-I264 HydrophobicContact CB-CG1 4.43Å; W192-I264 HydrophobicContact CD2-CD1 4.16Å; W192-I264 HydrophobicContact CD2-CG1 3.52Å; W192-I264 HydrophobicContact CE3-CG1 4.01Å; W192-I264 HydrophobicContact CG-CD1 3.82Å; W192-I264 HydrophobicContact CG-CG1 3.7Å; W192-I264 HydrophobicContact CZ2-CG1 4.17Å; W192-F267 HydrophobicContact CE3-CD1 4.18Å; W192-F267 HydrophobicContact CZ3-CB 4.27Å; W192-F267 HydrophobicContact CZ3-CD1 4.22Å; W192-F267 HydrophobicContact CZ3-CG 4.37Å
193Y91.6Very high90.6Very high0 Ų059.7 Ų59.70%028%0.279CS..Hα-helixtrans-77.3-24.7175.6-165-102.2000112.5V189 Y195 H196 F197 L200 A214 I217 G218 L261 I264V189-Y193 WeakPolarHBondContact O-CB 3.44Å; V189-Y193 PolarHBondContact O-N 3.12Å; Y193-Y195 PolarHBondContact O-N 3.48Å; Y193-H196 WeakPolarHBondContact O-CA 3.25Å; Y193-H196 WeakPolarHBondContact O-CB 3.38Å; Y193-H196 PolarHBondContact O-N 2.73Å; Y193-F197 HydrophobicContact CD1-CB 4.37Å; Y193-F197 HydrophobicContact CE1-CB 3.86Å; Y193-F197 HydrophobicContact CE1-CD1 4.19Å; Y193-F197 PolarHBondContact O-N 3.47Å; Y193-L200 HydrophobicContact CD1-CD2 3.97Å; Y193-L200 HydrophobicContact CE1-CD2 3.72Å; Y193-A214 HydrophobicContact CD1-CB 4.25Å; Y193-A214 HydrophobicContact CD2-CB 4.39Å; Y193-A214 HydrophobicContact CE1-CB 4.44Å; Y193-A214 HydrophobicContact CG-CB 4.22Å; Y193-I217 WeakPolarHBondContact OH-CG2 3.29Å; Y193-G218 WeakPolarHBondContact CE2-O 3.45Å; Y193-G218 PolarHBondContact OH-O 2.97Å; Y193-L261 HydrophobicContact CE2-CD1 4.21Å; Y193-I264 HydrophobicContact CD2-CD1 4.41Å; Y193-I264 HydrophobicContact CD2-CG2 3.96Å
194G90.1Very high90.3Very high15 Ų1556.2 Ų56.216%0.15526%0.26CS..Hα-helixtrans-62-24.1175.900000114.4R190 E191 H196 P198R190-G194 VanDerWaalsContact O-CA 3.23Å; R190-G194 WeakPolarHBondContact O-CA 3.44Å; R190-G194 PolarHBondContact O-N 3.1Å; E191-G194 PolarHBondContact O-N 3.18Å; G194-H196 VanDerWaalsContact C-N 3.27Å; G194-H196 PolarHBondContact O-N 3.26Å; G194-P198 VanDerWaalsContact O-CA 3.26Å; G194-P198 WeakPolarHBondContact O-CA 3.34Å; G194-P198 VanDerWaalsContact O-CB 3.27Å; G194-P198 WeakPolarHBondContact O-CB 3.39Å; G194-P198 VanDerWaalsContact O-CD 3.27Å; G194-P198 WeakPolarHBondContact O-CD 3.24Å; G194-P198 VanDerWaalsContact O-N 3.17Å
195Y89.2Confident89.9Confident159 Ų15959 Ų5962%0.62427%0.273SS*.THydrogen-bonded Turntrans-64.9-30.5169-76.8-78.3000113.1E191 Y193 M254E191-Y195 WeakPolarHBondContact O-CD2 3.36Å; E191-Y195 PolarHBondContact O-N 3.25Å; Y193-Y195 PolarHBondContact O-N 3.48Å; Y195-M254 PolarHBondContact O-N 2.79Å
196H87.9Confident89.6Confident2 Ų259.4 Ų59.41%0.00928%0.278CS..THydrogen-bonded Turntrans-88.6-44.7179.2-176.854.6000112.3Y193 G194 R220 M254 I256Y193-H196 WeakPolarHBondContact O-CA 3.25Å; Y193-H196 WeakPolarHBondContact O-CB 3.38Å; Y193-H196 PolarHBondContact O-N 2.73Å; G194-H196 VanDerWaalsContact C-N 3.27Å; G194-H196 PolarHBondContact O-N 3.26Å; H196-R220 VanDerWaalsContact CE1-CD 3.41Å; H196-R220 WeakPolarHBondContact CE1-CD 3.49Å; H196-R220 PolarHBondContact CE1-NE 3.05Å; H196-R220 WeakPolarHBondContact NE2-CG 3.46Å; H196-R220 PolarHBondContact NE2-N 2.93Å; H196-R220 PolarHBondContact O-NH1 2.94Å; H196-R220 VanDerWaalsContact O-NH1 3.16Å; H196-M254 WeakPolarHBondContact CA-O 3.34Å; H196-M254 PolarHBondContact ND1-O 3.49Å; H196-I256 HydrophobicContact CB-CB 4.36Å; H196-I256 HydrophobicContact CB-CG2 4.48Å
197F88.7Confident89.3Confident0 Ų060.9 Ų60.90%029%0.286CS..  trans-137.675.6-176.8-168.5-161.8000111.5Y193 E199 L200 I217 I244 A247Y193-F197 HydrophobicContact CD1-CB 4.37Å; Y193-F197 HydrophobicContact CE1-CB 3.86Å; Y193-F197 HydrophobicContact CE1-CD1 4.19Å; Y193-F197 PolarHBondContact O-N 3.47Å; F197-E199 VanDerWaalsContact C-N 3.26Å; F197-E199 HydrophobicContact CD2-CB 4.23Å; F197-E199 VanDerWaalsContact CD2-OE2 3.25Å; F197-E199 WeakPolarHBondContact CD2-OE2 3.47Å; F197-E199 HydrophobicContact CE2-CB 3.86Å; F197-E199 PolarHBondContact O-N 2.97Å; F197-L200 HydrophobicContact CD1-CB 3.74Å; F197-L200 HydrophobicContact CD1-CD1 4.18Å; F197-L200 HydrophobicContact CD1-CD2 4.22Å; F197-L200 HydrophobicContact CD1-CG 4.27Å; F197-L200 HydrophobicContact CE1-CB 4Å; F197-L200 HydrophobicContact CE1-CD1 3.83Å; F197-L200 HydrophobicContact CE1-CG 4.38Å; F197-L200 HydrophobicContact CG-CB 4.07Å; F197-L200 WeakPolarHBondContact O-CB 3.4Å; F197-L200 PolarHBondContact O-N 3.2Å; F197-I217 HydrophobicContact CE1-CD1 4.42Å; F197-I244 HydrophobicContact CE1-CG2 4.04Å; F197-I244 HydrophobicContact CZ-CG2 4.31Å; F197-A247 HydrophobicContact CE2-CB 3.89Å; F197-A247 HydrophobicContact CZ-CB 3.91Å
198P89.5Confident89Confident50 Ų5058.4 Ų58.433%0.32528%0.278SS..THydrogen-bonded Turntrans-66.6-25.5-174.523.9-32.1000113.4G194 L200 V201G194-P198 VanDerWaalsContact O-CA 3.26Å; G194-P198 WeakPolarHBondContact O-CA 3.34Å; G194-P198 VanDerWaalsContact O-CB 3.27Å; G194-P198 WeakPolarHBondContact O-CB 3.39Å; G194-P198 VanDerWaalsContact O-CD 3.27Å; G194-P198 WeakPolarHBondContact O-CD 3.24Å; G194-P198 VanDerWaalsContact O-N 3.17Å; P198-L200 VanDerWaalsContact C-N 3.29Å; P198-L200 PolarHBondContact O-N 3.26Å; P198-V201 PolarHBondContact O-N 3.21Å
199E88.7Confident88.8Confident42 Ų4252.2 Ų52.220%0.19626%0.258CS..Hα-helixtrans-65.9-31.2179.7-60.976.3-16400112.2F197 V201 K202 I203 A247 S251F197-E199 VanDerWaalsContact C-N 3.26Å; F197-E199 HydrophobicContact CD2-CB 4.23Å; F197-E199 VanDerWaalsContact CD2-OE2 3.25Å; F197-E199 WeakPolarHBondContact CD2-OE2 3.47Å; F197-E199 HydrophobicContact CE2-CB 3.86Å; F197-E199 PolarHBondContact O-N 2.97Å; E199-V201 PolarHBondContact O-N 3.13Å; E199-K202 WeakPolarHBondContact O-CB 3.44Å; E199-K202 PolarHBondContact O-N 2.98Å; E199-I203 PolarHBondContact O-N 2.88Å; E199-A247 HydrophobicContact CB-CB 3.86Å; E199-A247 HydrophobicContact CG-CB 4.43Å; E199-S251 WeakPolarHBondContact OE2-CB 3.41Å; E199-S251 PolarHBondContact OE2-OG 2.84Å
200L89.5Confident88.7Confident0 Ų052.2 Ų52.20%026%0.258CS..Hα-helixtrans-57.8-35.7-179.8-167.170.9000112.4Y193 F197 P198 K202 I203 I204 Y210 I217 I244Y193-L200 HydrophobicContact CD1-CD2 3.97Å; Y193-L200 HydrophobicContact CE1-CD2 3.72Å; F197-L200 HydrophobicContact CD1-CB 3.74Å; F197-L200 HydrophobicContact CD1-CD1 4.18Å; F197-L200 HydrophobicContact CD1-CD2 4.22Å; F197-L200 HydrophobicContact CD1-CG 4.27Å; F197-L200 HydrophobicContact CE1-CB 4Å; F197-L200 HydrophobicContact CE1-CD1 3.83Å; F197-L200 HydrophobicContact CE1-CG 4.38Å; F197-L200 HydrophobicContact CG-CB 4.07Å; F197-L200 WeakPolarHBondContact O-CB 3.4Å; F197-L200 PolarHBondContact O-N 3.2Å; P198-L200 VanDerWaalsContact C-N 3.29Å; P198-L200 PolarHBondContact O-N 3.26Å; L200-K202 VanDerWaalsContact C-N 3.25Å; L200-K202 PolarHBondContact O-N 3.42Å; L200-I203 PolarHBondContact O-N 3.22Å; L200-I204 HydrophobicContact CD1-CD1 3.24Å; L200-I204 HydrophobicContact CG-CD1 3.68Å; L200-I204 PolarHBondContact O-N 3.44Å; L200-Y210 HydrophobicContact CB-CE2 3.92Å; L200-Y210 HydrophobicContact CD2-CD2 4.07Å; L200-Y210 HydrophobicContact CD2-CE2 3.6Å; L200-Y210 HydrophobicContact CG-CD2 4.04Å; L200-Y210 HydrophobicContact CG-CE2 3.64Å; L200-I217 HydrophobicContact CD1-CD1 3.94Å; L200-I217 HydrophobicContact CD2-CD1 4.08Å; L200-I244 HydrophobicContact CD1-CD1 4.29Å; L200-I244 HydrophobicContact CD1-CG1 4.03Å; L200-I244 HydrophobicContact CD1-CG2 4.13Å
201V88.3Confident88.6Confident52 Ų5250.6 Ų50.632%0.31525%0.252SS..Hα-helixtrans-66.7-28.4179.5-175.80000111.5R190 P198 E199 Y210R190-V201 HydrophobicContact CB-CG2 4.49Å; P198-V201 PolarHBondContact O-N 3.21Å; E199-V201 PolarHBondContact O-N 3.13Å; V201-Y210 HydrophobicContact CB-CE2 4.35Å; V201-Y210 HydrophobicContact CG2-CE2 3.64Å
202K87.3Confident88.5Confident173 Ų17349.7 Ų49.775%0.75224%0.244SC*.Hα-helixtrans-80.2-26.1177.3-61.1175.9-177.5168.80112.8E199 L200E199-K202 WeakPolarHBondContact O-CB 3.44Å; E199-K202 PolarHBondContact O-N 2.98Å; L200-K202 VanDerWaalsContact C-N 3.25Å; L200-K202 PolarHBondContact O-N 3.42Å
203I87.4Confident88.3Confident38 Ų3845.1 Ų45.120%0.19523%0.227CC..Hα-helixtrans-87.3-39.3-177.3-58.2167.4000111.1E199 L200 K240 A243 I244 A247E199-I203 PolarHBondContact O-N 2.88Å; L200-I203 PolarHBondContact O-N 3.22Å; I203-K240 HydrophobicContact CG2-CB 4.18Å; I203-K240 HydrophobicContact CG2-CG 4.28Å; I203-A243 HydrophobicContact CD1-CB 4.35Å; I203-I244 HydrophobicContact CD1-CG1 4.09Å; I203-I244 HydrophobicContact CG2-CG1 4.05Å; I203-A247 HydrophobicContact CD1-CB 3.76Å
204I86.9Confident88.1Confident8 Ų845.2 Ų45.24%0.04123%0.227CC..  trans-112.5103.6-176.7-57.6112.3000111.7R190 L200 D206 T209 Y210 L213 I244R190-I204 PolarHBondContact NH2-O 2.84Å; L200-I204 HydrophobicContact CD1-CD1 3.24Å; L200-I204 HydrophobicContact CG-CD1 3.68Å; L200-I204 PolarHBondContact O-N 3.44Å; I204-D206 WeakPolarHBondContact CG2-O 3.43Å; I204-T209 HydrophobicContact CG2-CG2 4.07Å; I204-Y210 HydrophobicContact CB-CD2 4.48Å; I204-L213 HydrophobicContact CD1-CD1 3.43Å; I204-L213 VanDerWaalsContact CD1-CD1 3.43Å; I204-L213 HydrophobicContact CG1-CD1 3.67Å; I204-I244 HydrophobicContact CD1-CD1 3.86Å; I204-I244 HydrophobicContact CD1-CG1 4.28Å
205N85.7Confident87.9Confident142 Ų14247.5 Ų47.576%0.75923%0.234SC*.  trans-73.9-22.2175.2-67-23.1000113.9R190R190-N205 PolarHBondContact NH2-O 3.29Å
206D87.6Confident87.7Confident79 Ų7942.7 Ų42.742%0.42222%0.216SC..  trans-81.8139179.7178.448.2000112.9R190 I204 A208 T209 Y210R190-D206 PolarHBondContact NH2-O 2.96Å; I204-D206 WeakPolarHBondContact CG2-O 3.43Å; D206-A208 PolarHBondContact OD2-N 3.46Å; D206-A208 VanDerWaalsContact OD2-N 3.12Å; D206-T209 WeakPolarHBondContact OD2-CB 3.46Å; D206-T209 PolarHBondContact OD2-N 2.85Å; D206-T209 PolarHBondContact OD2-OG1 2.87Å; D206-T209 VanDerWaalsContact OD2-OG1 3.13Å; D206-Y210 WeakPolarHBondContact O-CB 3.34Å; D206-Y210 PolarHBondContact O-N 2.93Å
207N86.9Confident87.6Confident31 Ų3142.6 Ų42.617%0.16622%0.216CC..Hα-helixtrans-72.5-43.6-179-88.3-28.6000112.1N183 S186 R190 C211N183-N207 PolarHBondContact OD1-ND2 3.3Å; S186-N207 WeakPolarHBondContact CB-OD1 3.44Å; R190-N207 PolarHBondContact NE-OD1 3.21Å; R190-N207 PolarHBondContact NH1-OD1 2.91Å; R190-N207 PolarHBondContact NH2-OD1 3.39Å; N207-C211 PolarHBondContact O-N 3.34Å; N207-C211 PolarHBondContact O-SG 3.15Å
208A85.6Confident87.3Confident29 Ų2942.9 Ų42.924%0.2422%0.219CC..Hα-helixtrans-72.8-45-17400000111.4D206 C211 R212D206-A208 PolarHBondContact OD2-N 3.46Å; D206-A208 VanDerWaalsContact OD2-N 3.12Å; A208-C211 PolarHBondContact O-N 2.99Å; A208-R212 WeakPolarHBondContact O-CG 3.4Å; A208-R212 PolarHBondContact O-N 3.04Å; A208-R212 VanDerWaalsContact O-N 3.1Å
209T87.7Confident87.1Confident32 Ų3242 Ų4220%0.19621%0.211CC..Hα-helixtrans-62.4-41.2174-61.30000111.4I204 D206 C211 R212 L213I204-T209 HydrophobicContact CG2-CG2 4.07Å; D206-T209 WeakPolarHBondContact OD2-CB 3.46Å; D206-T209 PolarHBondContact OD2-N 2.85Å; D206-T209 PolarHBondContact OD2-OG1 2.87Å; D206-T209 VanDerWaalsContact OD2-OG1 3.13Å; T209-C211 VanDerWaalsContact C-N 3.34Å; T209-C211 PolarHBondContact O-N 3.27Å; T209-R212 PolarHBondContact O-N 3.14Å; T209-L213 HydrophobicContact CG2-CD1 3.76Å; T209-L213 HydrophobicContact CG2-CG 4.23Å; T209-L213 WeakPolarHBondContact O-CB 3.46Å; T209-L213 VanDerWaalsContact O-CG 3.25Å; T209-L213 WeakPolarHBondContact O-CG 3.45Å; T209-L213 PolarHBondContact O-N 2.97Å
210Y91Very high86.7Confident0 Ų041.4 Ų41.40%021%0.207CC..Hα-helixtrans-57.5-45.2174.9-175.6-81.8000112.1V189 R190 L200 V201 I204 D206 L213 A214V189-Y210 HydrophobicContact CG1-CD1 4.29Å; V189-Y210 HydrophobicContact CG1-CE1 4.11Å; R190-Y210 HydrophobicContact CB-CE1 4.18Å; R190-Y210 HydrophobicContact CG-CD1 3.61Å; R190-Y210 HydrophobicContact CG-CD2 4.23Å; R190-Y210 HydrophobicContact CG-CE1 3.59Å; R190-Y210 HydrophobicContact CG-CE2 4.19Å; R190-Y210 HydrophobicContact CG-CG 3.96Å; L200-Y210 HydrophobicContact CB-CE2 3.92Å; L200-Y210 HydrophobicContact CD2-CD2 4.07Å; L200-Y210 HydrophobicContact CD2-CE2 3.6Å; L200-Y210 HydrophobicContact CG-CD2 4.04Å; L200-Y210 HydrophobicContact CG-CE2 3.64Å; V201-Y210 HydrophobicContact CB-CE2 4.35Å; V201-Y210 HydrophobicContact CG2-CE2 3.64Å; I204-Y210 HydrophobicContact CB-CD2 4.48Å; D206-Y210 WeakPolarHBondContact O-CB 3.34Å; D206-Y210 PolarHBondContact O-N 2.93Å; Y210-L213 PolarHBondContact O-N 3.39Å; Y210-A214 PolarHBondContact O-N 3.26Å
211C89.2Confident86.2Confident0 Ų049.7 Ų49.70%024%0.239CC..Hα-helixtrans-63.5-44.3178.4-64.40000112N207 A208 T209 L213 A214 Q215 S268 V271 V272N207-C211 PolarHBondContact O-N 3.34Å; N207-C211 PolarHBondContact O-SG 3.15Å; A208-C211 PolarHBondContact O-N 2.99Å; T209-C211 VanDerWaalsContact C-N 3.34Å; T209-C211 PolarHBondContact O-N 3.27Å; C211-L213 VanDerWaalsContact C-N 3.33Å; C211-L213 PolarHBondContact O-N 3.29Å; C211-A214 PolarHBondContact O-N 3.47Å; C211-Q215 PolarHBondContact O-N 2.97Å; C211-Q215 VanDerWaalsContact O-N 3.16Å; C211-Q215 PolarHBondContact O-NE2 3.17Å; C211-S268 VanDerWaalsContact C-OG 3.25Å; C211-S268 WeakPolarHBondContact CA-OG 3.36Å; C211-S268 WeakPolarHBondContact CB-OG 3.16Å; C211-S268 PolarHBondContact O-OG 2.96Å; C211-V271 HydrophobicContact CB-CG1 4.48Å; C211-V272 HydrophobicContact CB-CG2 3.96Å
212R88.5Confident85.8Confident96 Ų9652.6 Ų52.636%0.36225%0.248SC..Hα-helixtrans-60-41.8175.4-71.1174.3173.4175.9-5.2112.4A208 T209 Q215 F216 L234 V272A208-R212 WeakPolarHBondContact O-CG 3.4Å; A208-R212 PolarHBondContact O-N 3.04Å; A208-R212 VanDerWaalsContact O-N 3.1Å; T209-R212 PolarHBondContact O-N 3.14Å; R212-Q215 PolarHBondContact O-N 2.87Å; R212-F216 PolarHBondContact O-N 3.39Å; R212-F216 VanDerWaalsContact O-N 3.12Å; R212-L234 HydrophobicContact CB-CD2 4.37Å; R212-V272 HydrophobicContact CG-CG1 4.37Å; R212-V272 HydrophobicContact CG-CG2 3.76Å
213L87.5Confident85.3Confident0 Ų045 Ų450%022%0.216CC..Hα-helixtrans-67.9-41.4177.3-68.3169000111.7I204 T209 Y210 C211 Q215 F216 I217 L231 L234 T235 I244I204-L213 HydrophobicContact CD1-CD1 3.43Å; I204-L213 VanDerWaalsContact CD1-CD1 3.43Å; I204-L213 HydrophobicContact CG1-CD1 3.67Å; T209-L213 HydrophobicContact CG2-CD1 3.76Å; T209-L213 HydrophobicContact CG2-CG 4.23Å; T209-L213 WeakPolarHBondContact O-CB 3.46Å; T209-L213 VanDerWaalsContact O-CG 3.25Å; T209-L213 WeakPolarHBondContact O-CG 3.45Å; T209-L213 PolarHBondContact O-N 2.97Å; Y210-L213 PolarHBondContact O-N 3.39Å; C211-L213 VanDerWaalsContact C-N 3.33Å; C211-L213 PolarHBondContact O-N 3.29Å; L213-Q215 VanDerWaalsContact C-N 3.25Å; L213-Q215 PolarHBondContact O-N 3.06Å; L213-F216 PolarHBondContact O-N 2.92Å; L213-F216 VanDerWaalsContact O-N 3.1Å; L213-I217 HydrophobicContact CB-CD1 4.14Å; L213-I217 WeakPolarHBondContact O-CB 3.44Å; L213-I217 WeakPolarHBondContact O-CG1 3.44Å; L213-I217 PolarHBondContact O-N 3.3Å; L213-L231 HydrophobicContact CD2-CD2 3.55Å; L213-L234 HydrophobicContact CD2-CB 3.83Å; L213-L234 HydrophobicContact CD2-CD1 4.12Å; L213-T235 HydrophobicContact CD1-CG2 4.02Å; L213-T235 HydrophobicContact CD2-CG2 4.18Å; L213-I244 HydrophobicContact CD1-CD1 4.31Å
214A87.1Confident84.8Confident1 Ų147.8 Ų47.81%0.00823%0.232CC..Hα-helixtrans-59.2-35.4175.300000112.7Y193 Y210 C211 G218Y193-A214 HydrophobicContact CD1-CB 4.25Å; Y193-A214 HydrophobicContact CD2-CB 4.39Å; Y193-A214 HydrophobicContact CE1-CB 4.44Å; Y193-A214 HydrophobicContact CG-CB 4.22Å; Y210-A214 PolarHBondContact O-N 3.26Å; C211-A214 PolarHBondContact O-N 3.47Å; A214-G218 PolarHBondContact O-N 3.35Å
215Q85.2Confident84.4Confident63 Ų6353.2 Ų53.229%0.29426%0.257SS..Hα-helixtrans-69.8-38.6173.1-74.1163.460.100113.3C211 R212 L213 S268C211-Q215 PolarHBondContact O-N 2.97Å; C211-Q215 VanDerWaalsContact O-N 3.16Å; C211-Q215 PolarHBondContact O-NE2 3.17Å; R212-Q215 PolarHBondContact O-N 2.87Å; L213-Q215 VanDerWaalsContact C-N 3.25Å; L213-Q215 PolarHBondContact O-N 3.06Å; Q215-S268 PolarHBondContact NE2-O 3.32Å; Q215-S268 VanDerWaalsContact NE2-O 3.08Å; Q215-S268 PolarHBondContact NE2-OG 3.2Å
216F85.4Confident83.9Confident58 Ų5854.3 Ų54.325%0.25426%0.257SS..Hα-helixtrans-82.2-35.1-175.6-179.7-103.4000113.3R212 L213 K227 K230 L231 L234R212-F216 PolarHBondContact O-N 3.39Å; R212-F216 VanDerWaalsContact O-N 3.12Å; L213-F216 PolarHBondContact O-N 2.92Å; L213-F216 VanDerWaalsContact O-N 3.1Å; F216-K227 HydrophobicContact CE1-CB 3.96Å; F216-K227 HydrophobicContact CE1-CD 4.43Å; F216-K227 HydrophobicContact CE1-CG 4.29Å; F216-K227 HydrophobicContact CZ-CB 4.11Å; F216-K227 HydrophobicContact CZ-CD 4.4Å; F216-K227 HydrophobicContact CZ-CG 4.07Å; F216-K230 HydrophobicContact CE1-CB 3.77Å; F216-K230 HydrophobicContact CE2-CB 3.94Å; F216-K230 HydrophobicContact CE2-CD 3.65Å; F216-K230 HydrophobicContact CE2-CG 4.44Å; F216-K230 HydrophobicContact CZ-CB 3.41Å; F216-K230 VanDerWaalsContact CZ-CB 3.41Å; F216-K230 HydrophobicContact CZ-CD 3.65Å; F216-K230 HydrophobicContact CZ-CG 4.15Å; F216-L231 HydrophobicContact CD1-CD2 3.77Å; F216-L231 HydrophobicContact CD1-CG 4.17Å; F216-L231 HydrophobicContact CE1-CD2 4.14Å; F216-L231 HydrophobicContact CE1-CG 4.02Å; F216-L234 HydrophobicContact CB-CD1 3.81Å; F216-L234 HydrophobicContact CD1-CD1 4.25Å; F216-L234 HydrophobicContact CG-CD1 3.98Å
217I85.8Confident83.4Confident0 Ų053 Ų530%025%0.248CC..Hα-helixtrans-68.7-46.2178.3-65.7167.8000110Y193 F197 L200 L213 N219 L223 L231 I244Y193-I217 WeakPolarHBondContact OH-CG2 3.29Å; F197-I217 HydrophobicContact CE1-CD1 4.42Å; L200-I217 HydrophobicContact CD1-CD1 3.94Å; L200-I217 HydrophobicContact CD2-CD1 4.08Å; L213-I217 HydrophobicContact CB-CD1 4.14Å; L213-I217 WeakPolarHBondContact O-CB 3.44Å; L213-I217 WeakPolarHBondContact O-CG1 3.44Å; L213-I217 PolarHBondContact O-N 3.3Å; I217-N219 PolarHBondContact O-N 3.49Å; I217-L223 HydrophobicContact CG1-CD2 4.22Å; I217-L223 HydrophobicContact CG2-CD1 3.7Å; I217-L223 HydrophobicContact CG2-CD2 4.07Å; I217-L223 HydrophobicContact CG2-CG 3.91Å; I217-L231 HydrophobicContact CG1-CD2 4.08Å; I217-I244 HydrophobicContact CD1-CG2 4.2Å
218G82.9Confident83Confident6 Ų653 Ų536%0.06225%0.248CC..  trans60.9-117.6-17100000110.4Y193 A214 E265Y193-G218 WeakPolarHBondContact CE2-O 3.45Å; Y193-G218 PolarHBondContact OH-O 2.97Å; A214-G218 PolarHBondContact O-N 3.35Å; G218-E265 WeakPolarHBondContact CA-OE1 3.34Å
219N84Confident82.7Confident32 Ų3258.8 Ų58.817%0.17127%0.269CS..SBendtrans-82.7129175.1-169.5-22.5000111.3I217 R221 E222 L261I217-N219 PolarHBondContact O-N 3.49Å; N219-R221 PolarHBondContact O-N 3.28Å; N219-R221 PolarHBondContact OD1-N 2.92Å; N219-E222 HydrophobicContact CB-CG 4.31Å; N219-E222 PolarHBondContact O-N 3.06Å; N219-L261 HydrophobicContact CB-CD2 4Å
220R81.5Confident82.3Confident29 Ų2962.8 Ų62.811%0.10928%0.284CS..G310 helixtrans-52.1-29.4178.471.9-168.4173.4173.71.2114.3H196 E222 L223 G253 D255H196-R220 VanDerWaalsContact CE1-CD 3.41Å; H196-R220 WeakPolarHBondContact CE1-CD 3.49Å; H196-R220 PolarHBondContact CE1-NE 3.05Å; H196-R220 WeakPolarHBondContact NE2-CG 3.46Å; H196-R220 PolarHBondContact NE2-N 2.93Å; H196-R220 PolarHBondContact O-NH1 2.94Å; H196-R220 VanDerWaalsContact O-NH1 3.16Å; R220-E222 PolarHBondContact O-N 3.23Å; R220-L223 PolarHBondContact O-N 3.45Å; R220-G253 VanDerWaalsContact CZ-O 3.26Å; R220-G253 VanDerWaalsContact NH1-CA 3.32Å; R220-G253 PolarHBondContact NH1-O 2.97Å; R220-G253 PolarHBondContact NH2-O 3.38Å; R220-D255 IonicContact CZ-OD1 2.66Å; R220-D255 IonicContact NE-OD1 3.94Å; R220-D255 PolarHBondContact NE-OD1 3.3Å; R220-D255 IonicContact NH2-OD1 2.74Å; R220-D255 PolarHBondContact NH2-OD1 2.81Å; R220-D255 IonicContact NH2-OD2 2.74Å
221R79.4Confident81.8Confident175 Ų17562.9 Ų62.966%0.6629%0.285SS*.G310 helixtrans-71.6-17.2-178.5-63.4-179.5176.9-146.6-1.7113.3N219 D255N219-R221 PolarHBondContact O-N 3.28Å; N219-R221 PolarHBondContact OD1-N 2.92Å; R221-D255 IonicContact CZ-OD1 3.45Å; R221-D255 IonicContact CZ-OD2 3.62Å; R221-D255 IonicContact NE-OD1 3.21Å; R221-D255 PolarHBondContact NE-OD1 3.5Å; R221-D255 IonicContact NE-OD2 3.65Å; R221-D255 IonicContact NH2-OD1 2.81Å; R221-D255 PolarHBondContact NH2-OD1 3.22Å; R221-D255 IonicContact NH2-OD2 3.2Å; R221-D255 PolarHBondContact NH2-OD2 3.07Å
222E79.7Confident81.5Confident112 Ų11266.2 Ų66.252%0.52330%0.3SS..G310 helixtrans-97.614.6-179.1-60.1177.3-162.700112.6N219 R220 N224 K227N219-E222 HydrophobicContact CB-CG 4.31Å; N219-E222 PolarHBondContact O-N 3.06Å; R220-E222 PolarHBondContact O-N 3.23Å; E222-N224 PolarHBondContact O-N 3.42Å; E222-K227 WeakPolarHBondContact O-CD 3.45Å; E222-K227 VanDerWaalsContact O-CE 3.27Å; E222-K227 WeakPolarHBondContact O-CE 3.4Å; E222-K227 PolarHBondContact O-NZ 3.45Å
223L76.4Confident81.3Confident15 Ų1568.4 Ų68.48%0.07932%0.315CS..  trans-84.191.6176.8-79.7171.7000111.6I217 R220 K227 L231 L245I217-L223 HydrophobicContact CG1-CD2 4.22Å; I217-L223 HydrophobicContact CG2-CD1 3.7Å; I217-L223 HydrophobicContact CG2-CD2 4.07Å; I217-L223 HydrophobicContact CG2-CG 3.91Å; R220-L223 PolarHBondContact O-N 3.45Å; L223-K227 HydrophobicContact CD2-CD 4.43Å; L223-L231 HydrophobicContact CD2-CD1 4.07Å; L223-L245 HydrophobicContact CB-CD1 4.32Å
224N76.7Confident80.9Confident96 Ų9671 Ų7151%0.51333%0.328SS..  trans-92.5161170.1-66.2-10.4000111.5E222 E226 K227E222-N224 PolarHBondContact O-N 3.42Å; N224-E226 PolarHBondContact O-N 2.81Å; N224-K227 WeakPolarHBondContact O-CB 3.38Å; N224-K227 PolarHBondContact O-N 2.65Å
225E77.5Confident80.3Confident122 Ų12271.8 Ų71.857%0.5733%0.333SS*.G310 helixtrans-60.5-26.9176.1-73.4170.8-166.300112.8K227 L228 L245 R249E225-K227 PolarHBondContact O-N 3.11Å; E225-L228 WeakPolarHBondContact O-CB 3.46Å; E225-L228 PolarHBondContact O-N 3.47Å; E225-L245 HydrophobicContact CG-CD2 3.75Å; E225-R249 IonicContact OE1-CZ 3.65Å; E225-R249 IonicContact OE1-NH1 2.75Å; E225-R249 IonicContact OE1-NH2 3.37Å; E225-R249 PolarHBondContact OE1-NH2 3.28Å
226E76.4Confident80Confident165 Ų16576.9 Ų76.977%0.77136%0.359SS*.G310 helixtrans-61.4-26.3171.9-60175.7166.500113.8N224 L228N224-E226 PolarHBondContact O-N 2.81Å; E226-L228 VanDerWaalsContact C-N 3.26Å
227K76.9Confident79.8Confident52 Ų5276.7 Ų76.723%0.22636%0.361CS..G310 helixtrans-79.8-9174.8-72.5-175.3179.3172.50112.2F216 E222 L223 N224 E225 E229 K230 L231F216-K227 HydrophobicContact CE1-CB 3.96Å; F216-K227 HydrophobicContact CE1-CD 4.43Å; F216-K227 HydrophobicContact CE1-CG 4.29Å; F216-K227 HydrophobicContact CZ-CB 4.11Å; F216-K227 HydrophobicContact CZ-CD 4.4Å; F216-K227 HydrophobicContact CZ-CG 4.07Å; E222-K227 WeakPolarHBondContact O-CD 3.45Å; E222-K227 VanDerWaalsContact O-CE 3.27Å; E222-K227 WeakPolarHBondContact O-CE 3.4Å; E222-K227 PolarHBondContact O-NZ 3.45Å; L223-K227 HydrophobicContact CD2-CD 4.43Å; N224-K227 WeakPolarHBondContact O-CB 3.38Å; N224-K227 PolarHBondContact O-N 2.65Å; E225-K227 PolarHBondContact O-N 3.11Å; K227-E229 PolarHBondContact O-N 2.9Å; K227-K230 PolarHBondContact O-N 3.29Å; K227-L231 WeakPolarHBondContact O-CG 3.38Å; K227-L231 PolarHBondContact O-N 2.95Å; K227-L231 VanDerWaalsContact O-N 3.13Å
228L78Confident79.7Confident31 Ų3178 Ų7816%0.16237%0.373CS..Hα-helixtrans-62.5-44.2-176.1-170.270.5000111.8E225 E226 K230 L231 E232 A241 K242E225-L228 WeakPolarHBondContact O-CB 3.46Å; E225-L228 PolarHBondContact O-N 3.47Å; E226-L228 VanDerWaalsContact C-N 3.26Å; L228-K230 VanDerWaalsContact C-N 3.32Å; L228-K230 PolarHBondContact O-N 3.41Å; L228-L231 CarbonylContact O-C 3.55Å; L228-L231 WeakPolarHBondContact O-CA 3.35Å; L228-L231 WeakPolarHBondContact O-CB 3.47Å; L228-L231 PolarHBondContact O-N 3.26Å; L228-E232 HydrophobicContact CG-CG 4.39Å; L228-E232 WeakPolarHBondContact O-CG 3.43Å; L228-E232 PolarHBondContact O-N 2.74Å; L228-A241 HydrophobicContact CD1-CB 3.74Å; L228-K242 HydrophobicContact CD1-CG 4.28Å; L228-K242 HydrophobicContact CD2-CG 4.29Å
229E79.7Confident79.8Confident149 Ų14981.1 Ų81.170%0.69640%0.399SS*.Hα-helixtrans-54.4-46.9-179.6-61.6-179.216600111.9K227 L231 E232 E233K227-E229 PolarHBondContact O-N 2.9Å; E229-L231 PolarHBondContact O-N 2.73Å; E229-E232 WeakPolarHBondContact O-CB 3.29Å; E229-E232 PolarHBondContact O-N 3.27Å; E229-E233 PolarHBondContact O-N 2.88Å
230K80.4Confident79.9Confident116 Ų11683.4 Ų83.450%0.50441%0.407SS..Hα-helixtrans-71.8-27.7177.5-68.4177.4-178.2172.50113.2F216 K227 L228 L234F216-K230 HydrophobicContact CE1-CB 3.77Å; F216-K230 HydrophobicContact CE2-CB 3.94Å; F216-K230 HydrophobicContact CE2-CD 3.65Å; F216-K230 HydrophobicContact CE2-CG 4.44Å; F216-K230 HydrophobicContact CZ-CB 3.41Å; F216-K230 VanDerWaalsContact CZ-CB 3.41Å; F216-K230 HydrophobicContact CZ-CD 3.65Å; F216-K230 HydrophobicContact CZ-CG 4.15Å; K227-K230 PolarHBondContact O-N 3.29Å; L228-K230 VanDerWaalsContact C-N 3.32Å; L228-K230 PolarHBondContact O-N 3.41Å; K230-L234 WeakPolarHBondContact O-CB 3.48Å; K230-L234 VanDerWaalsContact O-CG 3.3Å; K230-L234 WeakPolarHBondContact O-CG 3.41Å; K230-L234 PolarHBondContact O-N 3.28Å; K230-L234 VanDerWaalsContact O-N 3.13Å
231L79.9Confident80.1Confident2 Ų282 Ų821%0.0140%0.402CS..Hα-helixtrans-68.4-40.1169.2-69.9170.1000110.6L213 F216 I217 L223 K227 L228 E229 L234 T235 A241L213-L231 HydrophobicContact CD2-CD2 3.55Å; F216-L231 HydrophobicContact CD1-CD2 3.77Å; F216-L231 HydrophobicContact CD1-CG 4.17Å; F216-L231 HydrophobicContact CE1-CD2 4.14Å; F216-L231 HydrophobicContact CE1-CG 4.02Å; I217-L231 HydrophobicContact CG1-CD2 4.08Å; L223-L231 HydrophobicContact CD2-CD1 4.07Å; K227-L231 WeakPolarHBondContact O-CG 3.38Å; K227-L231 PolarHBondContact O-N 2.95Å; K227-L231 VanDerWaalsContact O-N 3.13Å; L228-L231 CarbonylContact O-C 3.55Å; L228-L231 WeakPolarHBondContact O-CA 3.35Å; L228-L231 WeakPolarHBondContact O-CB 3.47Å; L228-L231 PolarHBondContact O-N 3.26Å; E229-L231 PolarHBondContact O-N 2.73Å; L231-L234 PolarHBondContact O-N 2.99Å; L231-T235 WeakPolarHBondContact O-CB 3.46Å; L231-T235 WeakPolarHBondContact O-CG2 3.39Å; L231-T235 PolarHBondContact O-N 3.04Å; L231-T235 PolarHBondContact O-OG1 3.36Å; L231-A241 HydrophobicContact CB-CB 4.01Å
232E82Confident80.4Confident70 Ų7079.2 Ų79.233%0.32740%0.395SS..Hα-helixtrans-63.8-41.3175.7-66.1-167.4162.700111.8L228 E229 L234 M236 G238 A241L228-E232 HydrophobicContact CG-CG 4.39Å; L228-E232 WeakPolarHBondContact O-CG 3.43Å; L228-E232 PolarHBondContact O-N 2.74Å; E229-E232 WeakPolarHBondContact O-CB 3.29Å; E229-E232 PolarHBondContact O-N 3.27Å; E232-L234 PolarHBondContact O-N 3.37Å; E232-M236 WeakPolarHBondContact O-CA 3.31Å; E232-M236 PolarHBondContact O-N 2.97Å; E232-G238 WeakPolarHBondContact OE1-CA 3.22Å; E232-A241 HydrophobicContact CB-CB 4.39Å; E232-A241 HydrophobicContact CG-CB 3.41Å; E232-A241 VanDerWaalsContact CG-CB 3.41Å
233E83.9Confident80.8Confident142 Ų14275.8 Ų75.866%0.66439%0.385SS*.Hα-helixtrans-58.9-43.1170.9-71179.7164.200112.7E229E229-E233 PolarHBondContact O-N 2.88Å
234L79.6Confident81.3Confident55 Ų5575 Ų7529%0.28838%0.382SS..Hα-helixtrans-77.7-32.9-177.8-72.5174.6000113.7R212 L213 F216 K230 L231 E232R212-L234 HydrophobicContact CB-CD2 4.37Å; L213-L234 HydrophobicContact CD2-CB 3.83Å; L213-L234 HydrophobicContact CD2-CD1 4.12Å; F216-L234 HydrophobicContact CB-CD1 3.81Å; F216-L234 HydrophobicContact CD1-CD1 4.25Å; F216-L234 HydrophobicContact CG-CD1 3.98Å; K230-L234 WeakPolarHBondContact O-CB 3.48Å; K230-L234 VanDerWaalsContact O-CG 3.3Å; K230-L234 WeakPolarHBondContact O-CG 3.41Å; K230-L234 PolarHBondContact O-N 3.28Å; K230-L234 VanDerWaalsContact O-N 3.13Å; L231-L234 PolarHBondContact O-N 2.99Å; E232-L234 PolarHBondContact O-N 3.37Å
235T75.8Confident81.8Confident17 Ų1771 Ų7110%0.10436%0.36CS..Hα-helixtrans-86.4-20.2178620000113.6L213 L231 D237 K240 I244L213-T235 HydrophobicContact CD1-CG2 4.02Å; L213-T235 HydrophobicContact CD2-CG2 4.18Å; L231-T235 WeakPolarHBondContact O-CB 3.46Å; L231-T235 WeakPolarHBondContact O-CG2 3.39Å; L231-T235 PolarHBondContact O-N 3.04Å; L231-T235 PolarHBondContact O-OG1 3.36Å; T235-D237 PolarHBondContact O-N 3.26Å; T235-D237 PolarHBondContact OG1-N 3.27Å; T235-D237 PolarHBondContact OG1-O 2.84Å; T235-K240 HydrophobicContact CG2-CB 4.37Å; T235-I244 HydrophobicContact CG2-CD1 3.94Å
236M77.1Confident82.3Confident170 Ų17069.6 Ų69.684%0.83736%0.356SS*.SBendtrans56.318.5-167.1-55.2-69.3-6500113.4E232E232-M236 WeakPolarHBondContact O-CA 3.31Å; E232-M236 PolarHBondContact O-N 2.97Å
237D83Confident82.8Confident55 Ų5562.3 Ų62.329%0.29432%0.324SS..  trans-153.9104.6-170.3-174.9-15.3000111.2T235 A239 K240 A241T235-D237 PolarHBondContact O-N 3.26Å; T235-D237 PolarHBondContact OG1-N 3.27Å; T235-D237 PolarHBondContact OG1-O 2.84Å; D237-A239 VanDerWaalsContact C-N 3.26Å; D237-A239 PolarHBondContact O-N 3.21Å; D237-A239 WeakPolarHBondContact OD1-CB 3.16Å; D237-A239 PolarHBondContact OD1-N 3.45Å; D237-K240 HydrophobicContact CB-CB 4.29Å; D237-K240 HydrophobicContact CB-CD 4.32Å; D237-K240 HydrophobicContact CB-CG 4.18Å; D237-K240 PolarHBondContact O-N 3.26Å; D237-K240 VanDerWaalsContact O-N 3.13Å; D237-K240 PolarHBondContact OD1-N 3.08Å; D237-K240 IonicContact OD2-NZ 3.22Å; D237-K240 PolarHBondContact OD2-NZ 3.48Å; D237-A241 PolarHBondContact O-N 2.82Å; D237-A241 VanDerWaalsContact O-N 3.1Å
238G82.5Confident83.3Confident26 Ų2660.6 Ų60.627%0.26832%0.319SS..Hα-helixtrans-64.5-24.2-179.900000114.8E232 K242E232-G238 WeakPolarHBondContact OE1-CA 3.22Å; G238-K242 WeakPolarHBondContact O-CG 3.11Å; G238-K242 PolarHBondContact O-N 2.97Å; G238-K242 VanDerWaalsContact O-N 3.13Å
239A86.4Confident83.7Confident72 Ų7266.8 Ų66.860%0.59534%0.34SS*.Hα-helixtrans-69.1-38.5173.600000110.8D237 A243D237-A239 VanDerWaalsContact C-N 3.26Å; D237-A239 PolarHBondContact O-N 3.21Å; D237-A239 WeakPolarHBondContact OD1-CB 3.16Å; D237-A239 PolarHBondContact OD1-N 3.45Å; A239-A243 WeakPolarHBondContact O-CB 3.41Å; A239-A243 PolarHBondContact O-N 3.49Å
240K84.7Confident84Confident81 Ų8163.4 Ų63.435%0.35233%0.333SS..Hα-helixtrans-69.8-41.2174.6-66.5-171.4-170.889.30112.1I203 T235 D237 K242 A243 I244I203-K240 HydrophobicContact CG2-CB 4.18Å; I203-K240 HydrophobicContact CG2-CG 4.28Å; T235-K240 HydrophobicContact CG2-CB 4.37Å; D237-K240 HydrophobicContact CB-CB 4.29Å; D237-K240 HydrophobicContact CB-CD 4.32Å; D237-K240 HydrophobicContact CB-CG 4.18Å; D237-K240 PolarHBondContact O-N 3.26Å; D237-K240 VanDerWaalsContact O-N 3.13Å; D237-K240 PolarHBondContact OD1-N 3.08Å; D237-K240 IonicContact OD2-NZ 3.22Å; D237-K240 PolarHBondContact OD2-NZ 3.48Å; K240-K242 VanDerWaalsContact C-N 3.34Å; K240-K242 PolarHBondContact O-N 3.03Å; K240-A243 PolarHBondContact O-N 2.8Å; K240-I244 WeakPolarHBondContact O-CD1 3.14Å; K240-I244 WeakPolarHBondContact O-CG1 3.37Å; K240-I244 PolarHBondContact O-N 2.8Å
241A85.7Confident84.3Confident0 Ų058.7 Ų58.70%032%0.315CS..Hα-helixtrans-59.9-44.3178.500000111.8L228 L231 E232 D237 I244 L245L228-A241 HydrophobicContact CD1-CB 3.74Å; L231-A241 HydrophobicContact CB-CB 4.01Å; E232-A241 HydrophobicContact CB-CB 4.39Å; E232-A241 HydrophobicContact CG-CB 3.41Å; E232-A241 VanDerWaalsContact CG-CB 3.41Å; D237-A241 PolarHBondContact O-N 2.82Å; D237-A241 VanDerWaalsContact O-N 3.1Å; A241-I244 WeakPolarHBondContact O-CB 3.26Å; A241-I244 PolarHBondContact O-N 3.41Å; A241-L245 PolarHBondContact O-N 3.39Å
242K85.7Confident84.5Confident115 Ų11567 Ų6750%0.536%0.356SS..Hα-helixtrans-64.6-44.7173.8-69.5174.2-175.9177.90112.2L228 G238 K240 I244 L245 D246L228-K242 HydrophobicContact CD1-CG 4.28Å; L228-K242 HydrophobicContact CD2-CG 4.29Å; G238-K242 WeakPolarHBondContact O-CG 3.11Å; G238-K242 PolarHBondContact O-N 2.97Å; G238-K242 VanDerWaalsContact O-N 3.13Å; K240-K242 VanDerWaalsContact C-N 3.34Å; K240-K242 PolarHBondContact O-N 3.03Å; K242-I244 PolarHBondContact O-N 3.04Å; K242-L245 WeakPolarHBondContact O-CB 3.27Å; K242-L245 PolarHBondContact O-N 3.04Å; K242-D246 PolarHBondContact O-N 3.48Å
243A87.7Confident84.6Confident40 Ų4064.5 Ų64.533%0.33135%0.348SS..Hα-helixtrans-59.8-32.217500000113.1I203 A239 K240 A247I203-A243 HydrophobicContact CD1-CB 4.35Å; A239-A243 WeakPolarHBondContact O-CB 3.41Å; A239-A243 PolarHBondContact O-N 3.49Å; K240-A243 PolarHBondContact O-N 2.8Å; A243-A247 WeakPolarHBondContact O-CB 3.32Å; A243-A247 PolarHBondContact O-N 3.04Å
244I87.9Confident84.8Confident0 Ų063.8 Ų63.80%035%0.346CS..Hα-helixtrans-68.4-40173.9-68160.5000111F197 L200 I203 I204 L213 I217 T235 K240 A241 K242 A247 S248F197-I244 HydrophobicContact CE1-CG2 4.04Å; F197-I244 HydrophobicContact CZ-CG2 4.31Å; L200-I244 HydrophobicContact CD1-CD1 4.29Å; L200-I244 HydrophobicContact CD1-CG1 4.03Å; L200-I244 HydrophobicContact CD1-CG2 4.13Å; I203-I244 HydrophobicContact CD1-CG1 4.09Å; I203-I244 HydrophobicContact CG2-CG1 4.05Å; I204-I244 HydrophobicContact CD1-CD1 3.86Å; I204-I244 HydrophobicContact CD1-CG1 4.28Å; L213-I244 HydrophobicContact CD1-CD1 4.31Å; I217-I244 HydrophobicContact CD1-CG2 4.2Å; T235-I244 HydrophobicContact CG2-CD1 3.94Å; K240-I244 WeakPolarHBondContact O-CD1 3.14Å; K240-I244 WeakPolarHBondContact O-CG1 3.37Å; K240-I244 PolarHBondContact O-N 2.8Å; A241-I244 WeakPolarHBondContact O-CB 3.26Å; A241-I244 PolarHBondContact O-N 3.41Å; K242-I244 PolarHBondContact O-N 3.04Å; I244-A247 PolarHBondContact O-N 2.75Å; I244-S248 PolarHBondContact O-N 3.42Å
245L86.1Confident85.1Confident11 Ų1164.7 Ų64.76%0.05835%0.352CS..Hα-helixtrans-69-42.3176.9-172.870.5000112.1L223 E225 A241 K242 A247 S248 R249L223-L245 HydrophobicContact CB-CD1 4.32Å; E225-L245 HydrophobicContact CG-CD2 3.75Å; A241-L245 PolarHBondContact O-N 3.39Å; K242-L245 WeakPolarHBondContact O-CB 3.27Å; K242-L245 PolarHBondContact O-N 3.04Å; L245-A247 VanDerWaalsContact C-N 3.34Å; L245-S248 PolarHBondContact O-N 3.28Å; L245-S248 PolarHBondContact O-OG 3.28Å; L245-R249 WeakPolarHBondContact O-CG 3.48Å; L245-R249 PolarHBondContact O-N 2.96Å; L245-R249 VanDerWaalsContact O-N 3.13Å
246D88.2Confident85.6Confident93 Ų9365.4 Ų65.450%0.49735%0.354SS..Hα-helixtrans-67.8-36.8175.2-66.9-31.4000111.3K242 S250K242-D246 PolarHBondContact O-N 3.48Å; D246-S250 WeakPolarHBondContact O-CB 3.46Å; D246-S250 PolarHBondContact O-N 3.36Å; D246-S250 VanDerWaalsContact O-N 3.13Å; D246-S250 PolarHBondContact O-OG 3.19Å
247A88.3Confident86.1Confident11 Ų1160 Ų609%0.09133%0.333CS..Hα-helixtrans-67.3-35.9173.100000112.7F197 E199 I203 A243 I244 L245 S250 S251F197-A247 HydrophobicContact CE2-CB 3.89Å; F197-A247 HydrophobicContact CZ-CB 3.91Å; E199-A247 HydrophobicContact CB-CB 3.86Å; E199-A247 HydrophobicContact CG-CB 4.43Å; I203-A247 HydrophobicContact CD1-CB 3.76Å; A243-A247 WeakPolarHBondContact O-CB 3.32Å; A243-A247 PolarHBondContact O-N 3.04Å; I244-A247 PolarHBondContact O-N 2.75Å; L245-A247 VanDerWaalsContact C-N 3.34Å; A247-S250 WeakPolarHBondContact CA-OG 3.34Å; A247-S250 CarbonylContact O-C 3.51Å; A247-S250 PolarHBondContact O-N 3.36Å; A247-S250 PolarHBondContact O-OG 3.01Å; A247-S251 WeakPolarHBondContact O-CA 3.42Å; A247-S251 VanDerWaalsContact O-CB 3.29Å; A247-S251 WeakPolarHBondContact O-CB 3.24Å; A247-S251 PolarHBondContact O-N 2.84Å
248S86.5Confident86.4Confident17 Ų1760.6 Ų60.612%0.11935%0.346CS..Hα-helixtrans-69.9-38.1177.273.10000111.8I244 L245 S250 S251I244-S248 PolarHBondContact O-N 3.42Å; L245-S248 PolarHBondContact O-N 3.28Å; L245-S248 PolarHBondContact O-OG 3.28Å; S248-S250 VanDerWaalsContact C-N 3.26Å; S248-S250 PolarHBondContact O-N 2.84Å; S248-S251 PolarHBondContact O-N 3.22Å
249R85.8Confident86.8Confident161 Ų16165 Ų6561%0.60836%0.362SS*.Hα-helixtrans-63.8-27.6172.6-71.9173.8174.6174.2-1113.4E225 L245E225-R249 IonicContact OE1-CZ 3.65Å; E225-R249 IonicContact OE1-NH1 2.75Å; E225-R249 IonicContact OE1-NH2 3.37Å; E225-R249 PolarHBondContact OE1-NH2 3.28Å; L245-R249 WeakPolarHBondContact O-CG 3.48Å; L245-R249 PolarHBondContact O-N 2.96Å; L245-R249 VanDerWaalsContact O-N 3.13Å
250S87Confident87Confident78 Ų7864.8 Ų64.855%0.54535%0.351SS..Hα-helixtrans-106.32.3-179.555.40000114.6D246 A247 S248 M252D246-S250 WeakPolarHBondContact O-CB 3.46Å; D246-S250 PolarHBondContact O-N 3.36Å; D246-S250 VanDerWaalsContact O-N 3.13Å; D246-S250 PolarHBondContact O-OG 3.19Å; A247-S250 WeakPolarHBondContact CA-OG 3.34Å; A247-S250 CarbonylContact O-C 3.51Å; A247-S250 PolarHBondContact O-N 3.36Å; A247-S250 PolarHBondContact O-OG 3.01Å; S248-S250 VanDerWaalsContact C-N 3.26Å; S248-S250 PolarHBondContact O-N 2.84Å; S250-M252 PolarHBondContact O-N 2.97Å
251S86.4Confident87.2Confident17 Ų1761.8 Ų61.812%0.11934%0.339CS..  trans-70.3129.7-173-173.60000112.4E199 A247 S248 G253E199-S251 WeakPolarHBondContact OE2-CB 3.41Å; E199-S251 PolarHBondContact OE2-OG 2.84Å; A247-S251 WeakPolarHBondContact O-CA 3.42Å; A247-S251 VanDerWaalsContact O-CB 3.29Å; A247-S251 WeakPolarHBondContact O-CB 3.24Å; A247-S251 PolarHBondContact O-N 2.84Å; S248-S251 PolarHBondContact O-N 3.22Å; S251-G253 PolarHBondContact OG-N 3.08Å
252M84.4Confident87.5Confident177 Ų17766.5 Ų66.587%0.87236%0.363SS*.  trans-100.612.9178.2-61.8-71.4-92.800112.6S250S250-M252 PolarHBondContact O-N 2.97Å
253G84.8Confident87.7Confident16 Ų1664.5 Ų64.517%0.16536%0.358CS..PPolyproline II helixtrans-65.5174-179.700000114.2R220 S251R220-G253 VanDerWaalsContact CZ-O 3.26Å; R220-G253 VanDerWaalsContact NH1-CA 3.32Å; R220-G253 PolarHBondContact NH1-O 2.97Å; R220-G253 PolarHBondContact NH2-O 3.38Å; S251-G253 PolarHBondContact OG-N 3.08Å
254M86.8Confident87.9Confident127 Ų12762.7 Ų62.763%0.62634%0.342SS*.PPolyproline II helixtrans-76.9141.6178-170.117268.800111.3Y195 H196Y195-M254 PolarHBondContact O-N 2.79Å; H196-M254 WeakPolarHBondContact CA-O 3.34Å; H196-M254 PolarHBondContact ND1-O 3.49Å
255D86.5Confident88.1Confident75 Ų7565.6 Ų65.640%0.40136%0.356SS..PPolyproline II helixtrans-71.8130167.9-69.8-58.8000110.1R220 R221R220-D255 IonicContact CZ-OD1 2.66Å; R220-D255 IonicContact NE-OD1 3.94Å; R220-D255 PolarHBondContact NE-OD1 3.3Å; R220-D255 IonicContact NH2-OD1 2.74Å; R220-D255 PolarHBondContact NH2-OD1 2.81Å; R220-D255 IonicContact NH2-OD2 2.74Å; R221-D255 IonicContact CZ-OD1 3.45Å; R221-D255 IonicContact CZ-OD2 3.62Å; R221-D255 IonicContact NE-OD1 3.21Å; R221-D255 PolarHBondContact NE-OD1 3.5Å; R221-D255 IonicContact NE-OD2 3.65Å; R221-D255 IonicContact NH2-OD1 2.81Å; R221-D255 PolarHBondContact NH2-OD1 3.22Å; R221-D255 IonicContact NH2-OD2 3.2Å; R221-D255 PolarHBondContact NH2-OD2 3.07Å
256I84.9Confident88.3Confident31 Ų3168.5 Ų68.516%0.15938%0.377CS..PPolyproline II helixtrans-95.7146.7-174.3-166.2162.7000111.7H196 D260 L261 I264H196-I256 HydrophobicContact CB-CB 4.36Å; H196-I256 HydrophobicContact CB-CG2 4.48Å; I256-D260 HydrophobicContact CD1-CB 3.94Å; I256-D260 HydrophobicContact CG1-CB 3.71Å; I256-L261 HydrophobicContact CG2-CB 4.23Å; I256-L261 HydrophobicContact CG2-CD1 4.43Å; I256-I264 HydrophobicContact CD1-CD1 3.41Å; I256-I264 VanDerWaalsContact CD1-CD1 3.41Å
257S89.6Confident88.5Confident57 Ų5766.4 Ų66.440%0.39936%0.364SS..PPolyproline II helixtrans-67.1145.6171.2-178.40000110.8I259 D260 L261S257-I259 PolarHBondContact O-N 3.33Å; S257-I259 PolarHBondContact OG-N 3.01Å; S257-D260 WeakPolarHBondContact CB-OD2 3.27Å; S257-D260 PolarHBondContact O-N 3.23Å; S257-D260 VanDerWaalsContact O-N 3.12Å; S257-L261 PolarHBondContact O-N 2.93Å
258A88Confident88.7Confident68 Ų6865.9 Ų65.956%0.56236%0.359SS*.Hα-helixtrans-58-33.5174.700000112.5L261 I262A258-L261 PolarHBondContact O-N 2.94Å; A258-I262 WeakPolarHBondContact O-CD1 3.23Å; A258-I262 VanDerWaalsContact O-CG1 3.24Å; A258-I262 WeakPolarHBondContact O-CG1 3.27Å; A258-I262 PolarHBondContact O-N 2.84Å
259I90.7Very high89Confident117 Ų11768 Ų6860%0.637%0.374SS*.Hα-helixtrans-66.3-43.7177.4-59.9172.5000110.6S257 I262 N263S257-I259 PolarHBondContact O-N 3.33Å; S257-I259 PolarHBondContact OG-N 3.01Å; I259-I262 PolarHBondContact O-N 3.08Å; I259-N263 PolarHBondContact O-N 3.46Å; I259-N263 PolarHBondContact O-ND2 2.93Å; I259-N263 VanDerWaalsContact O-ND2 3.1Å
260D90.6Very high89.3Confident69 Ų6967.9 Ų67.937%0.36937%0.373SS..Hα-helixtrans-70.1-36.4179.2-63.1-41.7000111.4I256 S257 N263 I264I256-D260 HydrophobicContact CD1-CB 3.94Å; I256-D260 HydrophobicContact CG1-CB 3.71Å; S257-D260 WeakPolarHBondContact CB-OD2 3.27Å; S257-D260 PolarHBondContact O-N 3.23Å; S257-D260 VanDerWaalsContact O-N 3.12Å; D260-N263 WeakPolarHBondContact O-CB 3.33Å; D260-N263 PolarHBondContact O-N 3.46Å; D260-I264 WeakPolarHBondContact O-CG1 3.47Å; D260-I264 PolarHBondContact O-N 3.1Å
261L89.5Confident89.6Confident18 Ų1864.3 Ų64.39%0.09435%0.348CS..Hα-helixtrans-61.5-47.8174.1-175.563.2000111.7Y193 N219 I256 S257 A258 N263 I264 E265Y193-L261 HydrophobicContact CE2-CD1 4.21Å; N219-L261 HydrophobicContact CB-CD2 4Å; I256-L261 HydrophobicContact CG2-CB 4.23Å; I256-L261 HydrophobicContact CG2-CD1 4.43Å; S257-L261 PolarHBondContact O-N 2.93Å; A258-L261 PolarHBondContact O-N 2.94Å; L261-N263 PolarHBondContact O-N 2.88Å; L261-I264 PolarHBondContact O-N 3.36Å; L261-I264 VanDerWaalsContact O-N 3.08Å; L261-E265 HydrophobicContact CD1-CG 4.43Å; L261-E265 HydrophobicContact CG-CG 4.43Å; L261-E265 WeakPolarHBondContact CG-OE1 3.4Å; L261-E265 WeakPolarHBondContact O-CG 3.48Å; L261-E265 PolarHBondContact O-N 3.04Å
262I91.6Very high89.9Confident98 Ų9864.2 Ų64.250%0.50335%0.347SS..Hα-helixtrans-56.7-38.8175.3-69.8162.2000111.3A258 I259 S266A258-I262 WeakPolarHBondContact O-CD1 3.23Å; A258-I262 VanDerWaalsContact O-CG1 3.24Å; A258-I262 WeakPolarHBondContact O-CG1 3.27Å; A258-I262 PolarHBondContact O-N 2.84Å; I259-I262 PolarHBondContact O-N 3.08Å; I262-S266 VanDerWaalsContact O-CB 3.25Å; I262-S266 WeakPolarHBondContact O-CB 3.41Å; I262-S266 PolarHBondContact O-N 3.48Å; I262-S266 PolarHBondContact O-OG 2.98Å
263N91.3Very high90.3Very high74 Ų7457.8 Ų57.840%0.39632%0.319SS..Hα-helixtrans-67.3-41.5176.6-71.8-39.1000112.2W192 I259 D260 L261 F267W192-N263 HydrophobicContact CH2-CB 3.89Å; W192-N263 HydrophobicContact CZ2-CB 4.06Å; I259-N263 PolarHBondContact O-N 3.46Å; I259-N263 PolarHBondContact O-ND2 2.93Å; I259-N263 VanDerWaalsContact O-ND2 3.1Å; D260-N263 WeakPolarHBondContact O-CB 3.33Å; D260-N263 PolarHBondContact O-N 3.46Å; L261-N263 PolarHBondContact O-N 2.88Å; N263-F267 WeakPolarHBondContact O-CB 3.44Å; N263-F267 PolarHBondContact O-N 3.21Å
264I91.4Very high90.7Very high1 Ų158.4 Ų58.41%0.00532%0.319CS..Hα-helixtrans-66.9-44.2175.8-66170.3000111.3W192 Y193 I256 D260 L261 S266 F267 S268W192-I264 HydrophobicContact CB-CD1 4.43Å; W192-I264 HydrophobicContact CB-CG1 4.43Å; W192-I264 HydrophobicContact CD2-CD1 4.16Å; W192-I264 HydrophobicContact CD2-CG1 3.52Å; W192-I264 HydrophobicContact CE3-CG1 4.01Å; W192-I264 HydrophobicContact CG-CD1 3.82Å; W192-I264 HydrophobicContact CG-CG1 3.7Å; W192-I264 HydrophobicContact CZ2-CG1 4.17Å; Y193-I264 HydrophobicContact CD2-CD1 4.41Å; Y193-I264 HydrophobicContact CD2-CG2 3.96Å; I256-I264 HydrophobicContact CD1-CD1 3.41Å; I256-I264 VanDerWaalsContact CD1-CD1 3.41Å; D260-I264 WeakPolarHBondContact O-CG1 3.47Å; D260-I264 PolarHBondContact O-N 3.1Å; L261-I264 PolarHBondContact O-N 3.36Å; L261-I264 VanDerWaalsContact O-N 3.08Å; I264-S266 PolarHBondContact O-N 2.91Å; I264-F267 PolarHBondContact O-N 2.88Å; I264-S268 VanDerWaalsContact O-CB 3.23Å; I264-S268 WeakPolarHBondContact O-CB 3.28Å; I264-S268 PolarHBondContact O-N 3.3Å
265E90.9Very high91Very high61 Ų6153.1 Ų53.129%0.28529%0.294SS..Hα-helixtrans-60.1-45.7176.4-73.8174.3-176.300111G218 L261 F267 S268 S269G218-E265 WeakPolarHBondContact CA-OE1 3.34Å; L261-E265 HydrophobicContact CD1-CG 4.43Å; L261-E265 HydrophobicContact CG-CG 4.43Å; L261-E265 WeakPolarHBondContact CG-OE1 3.4Å; L261-E265 WeakPolarHBondContact O-CG 3.48Å; L261-E265 PolarHBondContact O-N 3.04Å; E265-F267 PolarHBondContact O-N 3.45Å; E265-S268 PolarHBondContact O-N 3.13Å; E265-S269 VanDerWaalsContact O-CB 3.27Å; E265-S269 WeakPolarHBondContact O-CB 3.42Å; E265-S269 PolarHBondContact O-N 3.08Å
266S91.5Very high91.3Very high72 Ų7254.3 Ų54.350%0.50330%0.297SS..Hα-helixtrans-61.1-43.9175.7-620000112.3I262 I264 R270I262-S266 VanDerWaalsContact O-CB 3.25Å; I262-S266 WeakPolarHBondContact O-CB 3.41Å; I262-S266 PolarHBondContact O-N 3.48Å; I262-S266 PolarHBondContact O-OG 2.98Å; I264-S266 PolarHBondContact O-N 2.91Å; S266-R270 PolarHBondContact O-N 3.44Å
267F92.3Very high91.7Very high50 Ų5058.2 Ų58.222%0.21931%0.311CS..Hα-helixtrans-68.9-40.9178.3-175.7-122.2000111.9F185 R188 V189 W192 N263 I264 E265 R270 V271F185-F267 HydrophobicContact CB-CE1 4.43Å; F185-F267 HydrophobicContact CB-CE2 4.37Å; F185-F267 HydrophobicContact CB-CZ 3.72Å; F185-F267 HydrophobicContact CD1-CE2 4.3Å; F185-F267 AromaticContact CD1-CZ 3.93Å; F185-F267 HydrophobicContact CD1-CZ 3.93Å; F185-F267 HydrophobicContact CG-CE2 4.28Å; F185-F267 AromaticContact CG-CZ 3.96Å; F185-F267 HydrophobicContact CG-CZ 3.96Å; R188-F267 HydrophobicContact CB-CE1 3.9Å; R188-F267 HydrophobicContact CB-CZ 4.25Å; R188-F267 HydrophobicContact CG-CE1 3.82Å; R188-F267 HydrophobicContact CG-CZ 4.21Å; V189-F267 HydrophobicContact CG2-CD1 3.47Å; V189-F267 VanDerWaalsContact CG2-CD1 3.47Å; V189-F267 HydrophobicContact CG2-CE1 3.57Å; V189-F267 HydrophobicContact CG2-CG 4.48Å; W192-F267 HydrophobicContact CE3-CD1 4.18Å; W192-F267 HydrophobicContact CZ3-CB 4.27Å; W192-F267 HydrophobicContact CZ3-CD1 4.22Å; W192-F267 HydrophobicContact CZ3-CG 4.37Å; N263-F267 WeakPolarHBondContact O-CB 3.44Å; N263-F267 PolarHBondContact O-N 3.21Å; I264-F267 PolarHBondContact O-N 2.88Å; E265-F267 PolarHBondContact O-N 3.45Å; F267-R270 WeakPolarHBondContact O-CB 3.12Å; F267-R270 PolarHBondContact O-N 3.4Å; F267-V271 WeakPolarHBondContact O-CG2 3.05Å; F267-V271 PolarHBondContact O-N 3.09Å
268S92.1Very high92Very high0 Ų060 Ų600%031%0.309CS..Hα-helixtrans-64.4-43.3175.2-1760000112C211 Q215 I264 E265 R270 V271 V272C211-S268 VanDerWaalsContact C-OG 3.25Å; C211-S268 WeakPolarHBondContact CA-OG 3.36Å; C211-S268 WeakPolarHBondContact CB-OG 3.16Å; C211-S268 PolarHBondContact O-OG 2.96Å; Q215-S268 PolarHBondContact NE2-O 3.32Å; Q215-S268 VanDerWaalsContact NE2-O 3.08Å; Q215-S268 PolarHBondContact NE2-OG 3.2Å; I264-S268 VanDerWaalsContact O-CB 3.23Å; I264-S268 WeakPolarHBondContact O-CB 3.28Å; I264-S268 PolarHBondContact O-N 3.3Å; E265-S268 PolarHBondContact O-N 3.13Å; S268-R270 PolarHBondContact O-N 3.46Å; S268-V271 PolarHBondContact O-N 2.9Å; S268-V272 PolarHBondContact O-N 3.2Å
269S92.1Very high92.2Very high60 Ų6062.1 Ų62.142%0.4231%0.307SS..Hα-helixtrans-56-42173.1179.90000110.7E265 V271 V272 S273E265-S269 VanDerWaalsContact O-CB 3.27Å; E265-S269 WeakPolarHBondContact O-CB 3.42Å; E265-S269 PolarHBondContact O-N 3.08Å; S269-V271 PolarHBondContact O-N 3.44Å; S269-V272 PolarHBondContact O-N 3.05Å; S269-S273 PolarHBondContact O-N 3.29Å
270R92.3Very high92.5Very high159 Ų15960.2 Ų60.260%0.630%0.304SS*.Hα-helixtrans-61.1-44.3174-167.955.2164.5174.6-5.2112.3S266 F267 S268 S273 L274S266-R270 PolarHBondContact O-N 3.44Å; F267-R270 WeakPolarHBondContact O-CB 3.12Å; F267-R270 PolarHBondContact O-N 3.4Å; S268-R270 PolarHBondContact O-N 3.46Å; R270-S273 PolarHBondContact O-N 2.97Å; R270-S273 PolarHBondContact O-OG 3.35Å; R270-L274 HydrophobicContact CG-CD1 4.44Å; R270-L274 WeakPolarHBondContact O-CG 3.45Å; R270-L274 PolarHBondContact O-N 2.93Å
271V93.6Very high92.7Very high3 Ų357.5 Ų57.52%0.01829%0.29CS..Hα-helixtrans-62.4-42.5176.5177.60000112.1F185 V189 C211 F267 S268 S269 L274 S275F185-V271 HydrophobicContact CB-CG2 3.52Å; F185-V271 HydrophobicContact CG-CG2 4.5Å; V189-V271 HydrophobicContact CG2-CG2 4.08Å; C211-V271 HydrophobicContact CB-CG1 4.48Å; F267-V271 WeakPolarHBondContact O-CG2 3.05Å; F267-V271 PolarHBondContact O-N 3.09Å; S268-V271 PolarHBondContact O-N 2.9Å; S269-V271 PolarHBondContact O-N 3.44Å; V271-L274 PolarHBondContact O-N 3Å; V271-S275 PolarHBondContact O-N 3.41Å
272V92.2Very high92.9Very high15 Ų1560.5 Ų60.59%0.09130%0.303CS..Hα-helixtrans-64-44.8176.2173.40000111C211 R212 S268 S269 L274 S275 E276C211-V272 HydrophobicContact CB-CG2 3.96Å; R212-V272 HydrophobicContact CG-CG1 4.37Å; R212-V272 HydrophobicContact CG-CG2 3.76Å; S268-V272 PolarHBondContact O-N 3.2Å; S269-V272 PolarHBondContact O-N 3.05Å; V272-L274 VanDerWaalsContact C-N 3.27Å; V272-L274 PolarHBondContact O-N 3.35Å; V272-S275 WeakPolarHBondContact O-CB 3.41Å; V272-S275 PolarHBondContact O-N 3.03Å; V272-E276 PolarHBondContact O-N 2.91Å
273S93.4Very high93.1Very high42 Ų4260.3 Ų60.329%0.29431%0.306SS..Hα-helixtrans-60.5-34175.977.10000113.1S269 R270 Y277S269-S273 PolarHBondContact O-N 3.29Å; R270-S273 PolarHBondContact O-N 2.97Å; R270-S273 PolarHBondContact O-OG 3.35Å; S273-Y277 VanDerWaalsContact O-CB 3.32Å; S273-Y277 WeakPolarHBondContact O-CB 3.36Å; S273-Y277 PolarHBondContact O-N 3.43Å
274L93.9Very high93.2Very high29 Ų2961.3 Ų61.315%0.15231%0.306CS..Hα-helixtrans-71.8-36.9174.5-72.1170.7000112L178 I182 F185 R270 V271 V272 Y277 R278L178-L274 HydrophobicContact CD2-CD2 4.06Å; I182-L274 HydrophobicContact CD1-CB 4.46Å; I182-L274 HydrophobicContact CG1-CB 4.08Å; F185-L274 HydrophobicContact CD2-CD1 3.96Å; F185-L274 HydrophobicContact CE2-CD1 3.99Å; R270-L274 HydrophobicContact CG-CD1 4.44Å; R270-L274 WeakPolarHBondContact O-CG 3.45Å; R270-L274 PolarHBondContact O-N 2.93Å; V271-L274 PolarHBondContact O-N 3Å; V272-L274 VanDerWaalsContact C-N 3.27Å; V272-L274 PolarHBondContact O-N 3.35Å; L274-Y277 PolarHBondContact O-N 3.2Å; L274-R278 WeakPolarHBondContact O-CB 3.35Å; L274-R278 PolarHBondContact O-N 3.38Å
275S92.1Very high93.3Very high16 Ų1661.3 Ų61.311%0.11231%0.306CS..Hα-helixtrans-64-41.9174.6-168.40000112V271 V272 R278 Q279V271-S275 PolarHBondContact O-N 3.41Å; V272-S275 WeakPolarHBondContact O-CB 3.41Å; V272-S275 PolarHBondContact O-N 3.03Å; S275-R278 WeakPolarHBondContact O-CB 3.31Å; S275-R278 PolarHBondContact O-N 3.07Å; S275-Q279 WeakPolarHBondContact O-CG 3.49Å; S275-Q279 PolarHBondContact O-N 2.66Å; S275-Q279 VanDerWaalsContact O-N 3.16Å
276E92.7Very high93.4Very high100 Ų10065.4 Ų65.447%0.46732%0.318SS..Hα-helixtrans-67-43.8174-70.3170.8-17500111.9V272 R278 Q279 S280V272-E276 PolarHBondContact O-N 2.91Å; E276-R278 VanDerWaalsContact C-N 3.29Å; E276-R278 PolarHBondContact O-N 3.49Å; E276-Q279 PolarHBondContact O-N 2.97Å; E276-Q279 VanDerWaalsContact O-N 3.17Å; E276-S280 PolarHBondContact O-N 3.02Å
277Y94.6Very high93.5Very high113 Ų11365.1 Ų65.144%0.44332%0.316SS..Hα-helixtrans-59.5-39.6174.4-179.2-114000112.2L174 L178 S273 L274 Q279 S280 L281L174-Y277 HydrophobicContact CD2-CE1 4.32Å; L178-Y277 HydrophobicContact CD1-CD1 3.79Å; L178-Y277 HydrophobicContact CD1-CE1 3.88Å; S273-Y277 VanDerWaalsContact O-CB 3.32Å; S273-Y277 WeakPolarHBondContact O-CB 3.36Å; S273-Y277 PolarHBondContact O-N 3.43Å; L274-Y277 PolarHBondContact O-N 3.2Å; Y277-Q279 PolarHBondContact O-N 2.89Å; Y277-S280 WeakPolarHBondContact O-CB 3.49Å; Y277-S280 PolarHBondContact O-N 3.29Å; Y277-L281 WeakPolarHBondContact O-CB 3.21Å; Y277-L281 PolarHBondContact O-N 2.67Å
278R94.4Very high93.4Very high96 Ų9665 Ų6536%0.36232%0.315SS..Hα-helixtrans-60.7-42.3174.3-178.6-129.2-175.7-156.93.3112.2D179 I182 L274 S275 E276 L281 H282D179-R278 VanDerWaalsContact CG-NH2 3.33Å; D179-R278 IonicContact OD1-CZ 3Å; D179-R278 IonicContact OD1-NE 3.44Å; D179-R278 PolarHBondContact OD1-NE 3.07Å; D179-R278 IonicContact OD1-NH2 3.89Å; D179-R278 PolarHBondContact OD1-NH2 2.82Å; D179-R278 IonicContact OD2-CZ 3.13Å; D179-R278 IonicContact OD2-NE 3.35Å; D179-R278 IonicContact OD2-NH2 3.9Å; D179-R278 PolarHBondContact OD2-NH2 3.17Å; I182-R278 HydrophobicContact CD1-CB 3.85Å; I182-R278 HydrophobicContact CD1-CG 4.12Å; L274-R278 WeakPolarHBondContact O-CB 3.35Å; L274-R278 PolarHBondContact O-N 3.38Å; S275-R278 WeakPolarHBondContact O-CB 3.31Å; S275-R278 PolarHBondContact O-N 3.07Å; E276-R278 VanDerWaalsContact C-N 3.29Å; E276-R278 PolarHBondContact O-N 3.49Å; R278-L281 PolarHBondContact O-N 3.06Å; R278-H282 WeakPolarHBondContact O-CB 3.28Å; R278-H282 PolarHBondContact O-N 3.46Å
279Q93.8Very high93.4Very high112 Ų11265 Ų6552%0.52332%0.315SS..Hα-helixtrans-65.7-40.9174.9-66.9-1801100112.3S275 E276 Y277 H282 T283S275-Q279 WeakPolarHBondContact O-CG 3.49Å; S275-Q279 PolarHBondContact O-N 2.66Å; S275-Q279 VanDerWaalsContact O-N 3.16Å; E276-Q279 PolarHBondContact O-N 2.97Å; E276-Q279 VanDerWaalsContact O-N 3.17Å; Y277-Q279 PolarHBondContact O-N 2.89Å; Q279-H282 PolarHBondContact O-N 2.9Å; Q279-T283 PolarHBondContact O-N 3.08Å; Q279-T283 PolarHBondContact O-OG1 3.31Å
280S95.7Very high93.3Very high76 Ų7665.6 Ų65.653%0.53132%0.32SS..Hα-helixtrans-61.5-45.9173.9-175.90000111.6E276 Y277 H282 T283 Y284E276-S280 PolarHBondContact O-N 3.02Å; Y277-S280 WeakPolarHBondContact O-CB 3.49Å; Y277-S280 PolarHBondContact O-N 3.29Å; S280-H282 PolarHBondContact O-N 2.85Å; S280-T283 WeakPolarHBondContact O-CB 3.41Å; S280-T283 PolarHBondContact O-N 3.25Å; S280-T283 VanDerWaalsContact O-N 3.15Å; S280-Y284 PolarHBondContact O-N 2.91Å
281L94.9Very high93.1Very high12 Ų1262 Ų626%0.06331%0.31CS..Hα-helixtrans-64.1-38.9177.5-174.265.5000112.3L174 L175 L178 Y277 R278 T283 Y284 L285L174-L281 HydrophobicContact CB-CD2 4.12Å; L174-L281 HydrophobicContact CD2-CD2 3.8Å; L174-L281 HydrophobicContact CG-CD2 3.79Å; L175-L281 HydrophobicContact CB-CD2 4.17Å; L178-L281 HydrophobicContact CD1-CD2 3.9Å; Y277-L281 WeakPolarHBondContact O-CB 3.21Å; Y277-L281 PolarHBondContact O-N 2.67Å; R278-L281 PolarHBondContact O-N 3.06Å; L281-T283 VanDerWaalsContact C-N 3.33Å; L281-T283 PolarHBondContact O-N 3.02Å; L281-Y284 HydrophobicContact CD1-CD1 4.31Å; L281-Y284 PolarHBondContact O-N 3.22Å; L281-L285 WeakPolarHBondContact O-CB 3.45Å; L281-L285 PolarHBondContact O-N 3.41Å
282H94.2Very high92.8Very high82 Ų8262.2 Ų62.238%0.3831%0.311SS..Hα-helixtrans-62.5-40.1173.1-174.5-87.2000111.8L175 R278 Q279 S280 L285 R286L175-H282 HydrophobicContact CD1-CB 4.07Å; R278-H282 WeakPolarHBondContact O-CB 3.28Å; R278-H282 PolarHBondContact O-N 3.46Å; Q279-H282 PolarHBondContact O-N 2.9Å; S280-H282 PolarHBondContact O-N 2.85Å; H282-L285 PolarHBondContact O-N 3.25Å; H282-R286 WeakPolarHBondContact O-CB 3.41Å; H282-R286 PolarHBondContact O-N 3.26Å
283T95.4Very high92.8Very high93 Ų9361.5 Ų61.557%0.57131%0.307SS*.Hα-helixtrans-67.5-39.7176.3-55.40000111.9Q279 S280 L281 R286 S287Q279-T283 PolarHBondContact O-N 3.08Å; Q279-T283 PolarHBondContact O-OG1 3.31Å; S280-T283 WeakPolarHBondContact O-CB 3.41Å; S280-T283 PolarHBondContact O-N 3.25Å; S280-T283 VanDerWaalsContact O-N 3.15Å; L281-T283 VanDerWaalsContact C-N 3.33Å; L281-T283 PolarHBondContact O-N 3.02Å; T283-R286 PolarHBondContact O-N 2.67Å; T283-S287 PolarHBondContact O-N 3.44Å
284Y94.1Very high92.8Very high96 Ų9660 Ų6038%0.37630%0.296SS..Hα-helixtrans-61.8-47.8171.7173.4-95.8000112S171 S280 L281 R286 S287 K288S171-Y284 WeakPolarHBondContact OG-CE1 3.08Å; S280-Y284 PolarHBondContact O-N 2.91Å; L281-Y284 HydrophobicContact CD1-CD1 4.31Å; L281-Y284 PolarHBondContact O-N 3.22Å; Y284-R286 VanDerWaalsContact C-N 3.3Å; Y284-R286 PolarHBondContact O-N 3.38Å; Y284-S287 PolarHBondContact O-N 2.96Å; Y284-K288 HydrophobicContact CD1-CG 4.36Å; Y284-K288 HydrophobicContact CD2-CG 4.43Å; Y284-K288 HydrophobicContact CE1-CG 3.87Å; Y284-K288 HydrophobicContact CE2-CG 3.97Å; Y284-K288 PolarHBondContact O-N 3.33Å
285L93.5Very high92.7Very high1 Ų158.6 Ų58.61%0.00529%0.289CS..Hα-helixtrans-57.5-43.7177.1178.164.1000111.1I168 I172 L175 L281 H282 K288 M289 A306I168-L285 HydrophobicContact CG2-CD1 3.94Å; I172-L285 HydrophobicContact CD1-CD2 4.01Å; L175-L285 HydrophobicContact CD1-CD2 4.32Å; L281-L285 WeakPolarHBondContact O-CB 3.45Å; L281-L285 PolarHBondContact O-N 3.41Å; H282-L285 PolarHBondContact O-N 3.25Å; L285-K288 PolarHBondContact O-N 3.29Å; L285-M289 VanDerWaalsContact O-CB 3.3Å; L285-M289 WeakPolarHBondContact O-CB 3.41Å; L285-M289 PolarHBondContact O-N 2.75Å; L285-A306 HydrophobicContact CD1-CB 3.99Å; L285-A306 HydrophobicContact CD2-CB 4.14Å; L285-A306 HydrophobicContact CG-CB 4.49Å
286R93.4Very high92.8Very high147 Ų14757.9 Ų57.956%0.55528%0.283SS*.Hα-helixtrans-58.7-49.1174.7-179.8169.7-157-148.5-1.1112.4H282 T283 Y284 K288 M289 S290 E302H282-R286 WeakPolarHBondContact O-CB 3.41Å; H282-R286 PolarHBondContact O-N 3.26Å; T283-R286 PolarHBondContact O-N 2.67Å; Y284-R286 VanDerWaalsContact C-N 3.3Å; Y284-R286 PolarHBondContact O-N 3.38Å; R286-K288 VanDerWaalsContact C-N 3.33Å; R286-K288 PolarHBondContact O-N 3.1Å; R286-M289 PolarHBondContact O-N 3.4Å; R286-S290 PolarHBondContact O-N 3.1Å; R286-S290 VanDerWaalsContact O-N 3.1Å; R286-E302 HydrophobicContact CB-CG 4.35Å; R286-E302 WeakPolarHBondContact CD-OE1 3.3Å; R286-E302 HydrophobicContact CG-CG 4.03Å; R286-E302 WeakPolarHBondContact CG-OE1 3.37Å; R286-E302 IonicContact CZ-OE1 2.74Å; R286-E302 IonicContact NE-OE1 2.75Å; R286-E302 PolarHBondContact NE-OE1 3.37Å; R286-E302 IonicContact NH2-OE1 2.66Å
287S92.1Very high92.8Very high65 Ų6553.9 Ų53.946%0.45527%0.267SS..Hα-helixtrans-61.6-40177.3-171.50000112.4T283 Y284 Q291T283-S287 PolarHBondContact O-N 3.44Å; Y284-S287 PolarHBondContact O-N 2.96Å; S287-Q291 WeakPolarHBondContact O-CG 3.47Å; S287-Q291 PolarHBondContact O-N 3.43Å; S287-Q291 PolarHBondContact O-NE2 2.81Å; S287-Q291 PolarHBondContact OG-NE2 3.31Å
288K90.9Very high92.7Very high47 Ų4749.6 Ų49.620%0.20426%0.255CS..Hα-helixtrans-73.2-40.3178.7-77-72.5164.4-160.60113.2I168 Y284 L285 R286 S290 Q291 V292I168-K288 HydrophobicContact CG1-CB 4.29Å; Y284-K288 HydrophobicContact CD1-CG 4.36Å; Y284-K288 HydrophobicContact CD2-CG 4.43Å; Y284-K288 HydrophobicContact CE1-CG 3.87Å; Y284-K288 HydrophobicContact CE2-CG 3.97Å; Y284-K288 PolarHBondContact O-N 3.33Å; L285-K288 PolarHBondContact O-N 3.29Å; R286-K288 VanDerWaalsContact C-N 3.33Å; R286-K288 PolarHBondContact O-N 3.1Å; K288-S290 VanDerWaalsContact C-N 3.31Å; K288-S290 PolarHBondContact O-N 3.46Å; K288-Q291 PolarHBondContact O-N 2.89Å; K288-Q291 VanDerWaalsContact O-N 3.1Å; K288-V292 WeakPolarHBondContact O-CG2 3.21Å; K288-V292 PolarHBondContact O-N 2.83Å; K288-V292 VanDerWaalsContact O-N 3.08Å
289M91.5Very high92.6Very high0 Ų045 Ų450%024%0.238CC..Hα-helixtrans-60.6-42.7175.3-173.660.869.400111.1I168 L285 R286 Q291 V292 A293 E302 A306 I309I168-M289 HydrophobicContact CD1-CE 4.18Å; I168-M289 HydrophobicContact CD1-SD 4.26Å; I168-M289 HydrophobicContact CG2-CE 3.65Å; L285-M289 VanDerWaalsContact O-CB 3.3Å; L285-M289 WeakPolarHBondContact O-CB 3.41Å; L285-M289 PolarHBondContact O-N 2.75Å; R286-M289 PolarHBondContact O-N 3.4Å; M289-Q291 PolarHBondContact O-N 3.44Å; M289-V292 PolarHBondContact O-N 3.12Å; M289-A293 CarbonylContact O-C 3.58Å; M289-A293 PolarHBondContact O-N 3.14Å; M289-A293 HydrophobicContact SD-CB 3.93Å; M289-E302 HydrophobicContact CB-CB 4.35Å; M289-E302 HydrophobicContact CB-CG 4.45Å; M289-E302 HydrophobicContact CG-CB 4.29Å; M289-E302 HydrophobicContact CG-CG 4.46Å; M289-A306 VanDerWaalsContact CE-CA 3.42Å; M289-A306 HydrophobicContact CE-CB 3.57Å; M289-A306 VanDerWaalsContact CE-N 3.28Å; M289-I309 HydrophobicContact CE-CD1 4.18Å; M289-I309 HydrophobicContact SD-CD1 4.22Å
290S90.2Very high92.5Very high74 Ų7440.3 Ų40.352%0.51722%0.216SC..Hα-helixtrans-62.4-25.4175.3179.30000114R286 K288R286-S290 PolarHBondContact O-N 3.1Å; R286-S290 VanDerWaalsContact O-N 3.1Å; K288-S290 VanDerWaalsContact C-N 3.31Å; K288-S290 PolarHBondContact O-N 3.46Å
291Q87.7Confident92.3Very high83 Ų8337.8 Ų37.839%0.38820%0.202SC..Hα-helixtrans-83.9-32.6176.2-70.8164.43100113.1S287 K288 M289S287-Q291 WeakPolarHBondContact O-CG 3.47Å; S287-Q291 PolarHBondContact O-N 3.43Å; S287-Q291 PolarHBondContact O-NE2 2.81Å; S287-Q291 PolarHBondContact OG-NE2 3.31Å; K288-Q291 PolarHBondContact O-N 2.89Å; K288-Q291 VanDerWaalsContact O-N 3.1Å; M289-Q291 PolarHBondContact O-N 3.44Å
292V89.1Confident92.2Very high8 Ų839.4 Ų39.45%0.04821%0.209CC..Hα-helixtrans-99.3-43.3-171.4178.40000112.6N162 I168 K288 M289 L315N162-V292 WeakPolarHBondContact O-CG2 3.44Å; I168-V292 HydrophobicContact CD1-CB 3.69Å; I168-V292 HydrophobicContact CD1-CG1 3.99Å; I168-V292 HydrophobicContact CD1-CG2 3.85Å; K288-V292 WeakPolarHBondContact O-CG2 3.21Å; K288-V292 PolarHBondContact O-N 2.83Å; K288-V292 VanDerWaalsContact O-N 3.08Å; M289-V292 PolarHBondContact O-N 3.12Å; V292-L315 HydrophobicContact CG1-CD2 3.97Å
293A91.4Very high92.1Very high0 Ų037 Ų370%020%0.203CC..  trans-143.463.1-174.900000112.9M289 S295 L296 S297 I309 L315 D383M289-A293 CarbonylContact O-C 3.58Å; M289-A293 PolarHBondContact O-N 3.14Å; M289-A293 HydrophobicContact SD-CB 3.93Å; A293-S295 VanDerWaalsContact C-N 3.33Å; A293-S295 PolarHBondContact O-N 3Å; A293-L296 HydrophobicContact CB-CB 4.23Å; A293-L296 PolarHBondContact O-N 3.27Å; A293-S297 WeakPolarHBondContact O-CB 3.49Å; A293-S297 PolarHBondContact O-N 2.86Å; A293-I309 HydrophobicContact CB-CD1 4.38Å; A293-L315 HydrophobicContact CB-CD2 4.38Å; A293-D383 VanDerWaalsContact C-OD2 3.3Å; A293-D383 VanDerWaalsContact CA-CG 3.47Å; A293-D383 WeakPolarHBondContact CA-OD2 3.25Å; A293-D383 HydrophobicContact CB-CB 4Å; A293-D383 WeakPolarHBondContact CB-OD2 3.39Å
294P92.8Very high91.9Very high9 Ų933.5 Ų33.56%0.05818%0.182CC..Hα-helixtrans-62.2-32.8-179.926.3-35.3000113.7S297 A298 D383 P389P294-S297 WeakPolarHBondContact O-CB 3.34Å; P294-S297 PolarHBondContact O-N 2.65Å; P294-A298 WeakPolarHBondContact O-CB 3.48Å; P294-A298 PolarHBondContact O-N 3.17Å; P294-D383 WeakPolarHBondContact CD-OD1 3.27Å; P294-P389 HydrophobicContact CG-CB 3.67Å; P294-P389 HydrophobicContact CG-CG 4.12Å
295S92.7Very high91.9Very high0 Ų028.9 Ų28.90%016%0.164CC..Hα-helixtrans-68.7-46.7179.9-44.30000111.3A293 S297 A298 L299 D383 T390 G394A293-S295 VanDerWaalsContact C-N 3.33Å; A293-S295 PolarHBondContact O-N 3Å; S295-S297 VanDerWaalsContact C-N 3.33Å; S295-A298 PolarHBondContact O-N 3.32Å; S295-L299 WeakPolarHBondContact O-CB 3.48Å; S295-L299 PolarHBondContact O-N 2.95Å; S295-L299 VanDerWaalsContact O-N 3.14Å; S295-D383 WeakPolarHBondContact CB-OD1 2.98Å; S295-D383 WeakPolarHBondContact CB-OD2 3.4Å; S295-D383 PolarHBondContact N-OD1 3.1Å; S295-D383 PolarHBondContact N-OD2 2.98Å; S295-D383 VanDerWaalsContact N-OD2 3.17Å; S295-D383 PolarHBondContact OG-OD1 3.39Å; S295-T390 PolarHBondContact OG-O 2.93Å; S295-G394 VanDerWaalsContact O-CA 3.27Å; S295-G394 WeakPolarHBondContact O-CA 3.35Å
296L93Very high91.9Very high1 Ų128.9 Ų28.91%0.00516%0.164CC..Hα-helixtrans-63.9-40.9175.5-172.466.5000111A293 L299 I300 I309 L318 C376 D383A293-L296 HydrophobicContact CB-CB 4.23Å; A293-L296 PolarHBondContact O-N 3.27Å; L296-L299 PolarHBondContact O-N 3.36Å; L296-I300 HydrophobicContact CD1-CD1 3.74Å; L296-I300 HydrophobicContact CD1-CG1 4.05Å; L296-I300 HydrophobicContact CG-CD1 4.06Å; L296-I300 HydrophobicContact CG-CG1 4.23Å; L296-I300 WeakPolarHBondContact O-CG1 3.48Å; L296-I300 PolarHBondContact O-N 2.95Å; L296-I300 VanDerWaalsContact O-N 3.07Å; L296-I309 HydrophobicContact CD2-CD1 4.25Å; L296-I309 HydrophobicContact CD2-CG1 4.3Å; L296-L318 HydrophobicContact CD2-CD2 4Å; L296-C376 HydrophobicContact CD1-CB 4.14Å; L296-D383 WeakPolarHBondContact CB-OD2 3.16Å; L296-D383 PolarHBondContact N-OD2 3Å
297S93.3Very high92Very high16 Ų1625.3 Ų25.311%0.11215%0.15CC..Hα-helixtrans-56.6-50.4175.5-169.70000112.6A293 P294 S295 L299 G301 E302A293-S297 WeakPolarHBondContact O-CB 3.49Å; A293-S297 PolarHBondContact O-N 2.86Å; P294-S297 WeakPolarHBondContact O-CB 3.34Å; P294-S297 PolarHBondContact O-N 2.65Å; S295-S297 VanDerWaalsContact C-N 3.33Å; S297-L299 VanDerWaalsContact C-N 3.32Å; S297-L299 PolarHBondContact O-N 3.49Å; S297-G301 WeakPolarHBondContact O-CA 3.16Å; S297-G301 PolarHBondContact O-N 3.43Å; S297-E302 WeakPolarHBondContact OG-CG 3.14Å
298A92.7Very high92.1Very high24 Ų2422.3 Ų22.320%0.19813%0.129CC..Hα-helixtrans-66.8-33.5179.500000112.6P294 S295 E395 R398P294-A298 WeakPolarHBondContact O-CB 3.48Å; P294-A298 PolarHBondContact O-N 3.17Å; S295-A298 PolarHBondContact O-N 3.32Å; A298-E395 HydrophobicContact CB-CG 4.23Å; A298-R398 PolarHBondContact O-NH1 3.16Å
299L92.7Very high92.2Very high0 Ų020 Ų200%012%0.119CC..Hα-helixtrans-73.9-44.1-177.6-176.962000113.9S295 L296 S297 F356 L372 K375 C376 A379 L397 R398 V401S295-L299 WeakPolarHBondContact O-CB 3.48Å; S295-L299 PolarHBondContact O-N 2.95Å; S295-L299 VanDerWaalsContact O-N 3.14Å; L296-L299 PolarHBondContact O-N 3.36Å; S297-L299 VanDerWaalsContact C-N 3.32Å; S297-L299 PolarHBondContact O-N 3.49Å; L299-F356 VanDerWaalsContact O-CE2 3.27Å; L299-F356 WeakPolarHBondContact O-CE2 3.4Å; L299-L372 HydrophobicContact CD1-CD1 4.21Å; L299-L372 HydrophobicContact CD2-CD1 4.35Å; L299-L372 HydrophobicContact CG-CD1 4.13Å; L299-K375 HydrophobicContact CD2-CB 3.82Å; L299-C376 HydrophobicContact CD2-CB 4.47Å; L299-A379 HydrophobicContact CD2-CB 4.15Å; L299-L397 HydrophobicContact CD1-CB 4.02Å; L299-L397 HydrophobicContact CD2-CB 4.48Å; L299-R398 HydrophobicContact CD1-CB 4.2Å; L299-V401 HydrophobicContact CD1-CG2 4.16Å
300I91.6Very high92.3Very high13 Ų1321.4 Ų21.47%0.06713%0.13CC..Hα-helixtrans-125-4.5-174.152.8167.5000115.6L296 V304 L308 L372L296-I300 HydrophobicContact CD1-CD1 3.74Å; L296-I300 HydrophobicContact CD1-CG1 4.05Å; L296-I300 HydrophobicContact CG-CD1 4.06Å; L296-I300 HydrophobicContact CG-CG1 4.23Å; L296-I300 WeakPolarHBondContact O-CG1 3.48Å; L296-I300 PolarHBondContact O-N 2.95Å; L296-I300 VanDerWaalsContact O-N 3.07Å; I300-V304 HydrophobicContact CD1-CB 4.4Å; I300-V304 HydrophobicContact CD1-CG1 4.18Å; I300-L308 HydrophobicContact CD1-CD1 3.44Å; I300-L308 VanDerWaalsContact CD1-CD1 3.44Å; I300-L308 HydrophobicContact CD1-CG 4.45Å; I300-L372 HydrophobicContact CG2-CD1 3.92Å; I300-L372 HydrophobicContact CG2-CD2 4.29Å; I300-L372 HydrophobicContact CG2-CG 4.33Å
301G91.7Very high92.5Very high23 Ų2322.7 Ų22.724%0.23713%0.128CC..  trans89.3155-174.600000113.3S297 A303 G305S297-G301 WeakPolarHBondContact O-CA 3.16Å; S297-G301 PolarHBondContact O-N 3.43Å; G301-A303 PolarHBondContact O-N 3.4Å; G301-G305 PolarHBondContact O-N 3.15Å
302E91.8Very high92.7Very high45 Ų4519 Ų1921%0.2111%0.111CC..Hα-helixtrans-64.4-45.8-168-55.592.3157.100112.6R286 M289 S297 G305 A306R286-E302 HydrophobicContact CB-CG 4.35Å; R286-E302 WeakPolarHBondContact CD-OE1 3.3Å; R286-E302 HydrophobicContact CG-CG 4.03Å; R286-E302 WeakPolarHBondContact CG-OE1 3.37Å; R286-E302 IonicContact CZ-OE1 2.74Å; R286-E302 IonicContact NE-OE1 2.75Å; R286-E302 PolarHBondContact NE-OE1 3.37Å; R286-E302 IonicContact NH2-OE1 2.66Å; M289-E302 HydrophobicContact CB-CB 4.35Å; M289-E302 HydrophobicContact CB-CG 4.45Å; M289-E302 HydrophobicContact CG-CB 4.29Å; M289-E302 HydrophobicContact CG-CG 4.46Å; S297-E302 WeakPolarHBondContact OG-CG 3.14Å; E302-G305 PolarHBondContact O-N 3.06Å; E302-A306 WeakPolarHBondContact O-CB 3.21Å; E302-A306 PolarHBondContact O-N 3.4Å
303A92.1Very high92.8Very high32 Ų3220.7 Ų20.726%0.26413%0.131SC..Hα-helixtrans-67.2-42.3-176.100000112.9G301 A306 R307G301-A303 PolarHBondContact O-N 3.4Å; A303-A306 PolarHBondContact O-N 2.88Å; A303-R307 WeakPolarHBondContact O-CG 3.35Å; A303-R307 PolarHBondContact O-N 2.84Å
304V92.2Very high92.9Very high19 Ų1921.8 Ų21.812%0.11514%0.138CC..Hα-helixtrans-70.8-39.2178.2-1720000110.3I300 A306 R307 L308 H353I300-V304 HydrophobicContact CD1-CB 4.4Å; I300-V304 HydrophobicContact CD1-CG1 4.18Å; V304-A306 PolarHBondContact O-N 3.48Å; V304-R307 PolarHBondContact O-N 3.35Å; V304-L308 WeakPolarHBondContact O-CG 3.48Å; V304-L308 PolarHBondContact O-N 2.95Å; V304-H353 HydrophobicContact CG2-CB 4.38Å
305G93.5Very high92.8Very high0 Ų021.8 Ų21.80%014%0.138CC..Hα-helixtrans-58.6-44.2171.600000112.8G301 E302 L308 I309G301-G305 PolarHBondContact O-N 3.15Å; E302-G305 PolarHBondContact O-N 3.06Å; G305-L308 PolarHBondContact O-N 3.19Å; G305-I309 WeakPolarHBondContact O-CG1 3.35Å; G305-I309 PolarHBondContact O-N 3.06Å
306A94.5Very high92.8Very high0 Ų024.4 Ų24.40%015%0.154CC..Hα-helixtrans-62.4-45.1177.500000112.1I168 I172 L285 M289 E302 A303 V304 L308 I309 A310I168-A306 HydrophobicContact CG2-CB 3.86Å; I172-A306 HydrophobicContact CB-CB 3.9Å; I172-A306 HydrophobicContact CD1-CB 4.22Å; I172-A306 HydrophobicContact CG1-CB 3.94Å; I172-A306 HydrophobicContact CG2-CB 4.26Å; L285-A306 HydrophobicContact CD1-CB 3.99Å; L285-A306 HydrophobicContact CD2-CB 4.14Å; L285-A306 HydrophobicContact CG-CB 4.49Å; M289-A306 VanDerWaalsContact CE-CA 3.42Å; M289-A306 HydrophobicContact CE-CB 3.57Å; M289-A306 VanDerWaalsContact CE-N 3.28Å; E302-A306 WeakPolarHBondContact O-CB 3.21Å; E302-A306 PolarHBondContact O-N 3.4Å; A303-A306 PolarHBondContact O-N 2.88Å; V304-A306 PolarHBondContact O-N 3.48Å; A306-L308 VanDerWaalsContact C-N 3.35Å; A306-L308 PolarHBondContact O-N 3.47Å; A306-I309 PolarHBondContact O-N 3.42Å; A306-A310 WeakPolarHBondContact O-CB 3.42Å; A306-A310 PolarHBondContact O-N 3.47Å
307R94.3Very high92.9Very high73 Ų7327.3 Ų27.328%0.27517%0.17SC..Hα-helixtrans-62.8-37.7176.1-71.3-176.7179.1149.84.6112.4I172 D176 A303 V304 A310 H311 L350I172-R307 HydrophobicContact CD1-CG 4.03Å; I172-R307 HydrophobicContact CG1-CG 3.65Å; D176-R307 IonicContact OD1-CZ 2.95Å; D176-R307 IonicContact OD1-NE 2.7Å; D176-R307 PolarHBondContact OD1-NE 2.82Å; D176-R307 IonicContact OD1-NH2 3.32Å; D176-R307 PolarHBondContact OD1-NH2 2.88Å; D176-R307 IonicContact OD2-CZ 3.93Å; D176-R307 IonicContact OD2-NE 2.81Å; D176-R307 PolarHBondContact OD2-NE 3.26Å; D176-R307 VanDerWaalsContact OD2-NE 3.11Å; D176-R307 IonicContact OD2-NH2 3.48Å; A303-R307 WeakPolarHBondContact O-CG 3.35Å; A303-R307 PolarHBondContact O-N 2.84Å; V304-R307 PolarHBondContact O-N 3.35Å; R307-A310 PolarHBondContact O-N 2.83Å; R307-H311 WeakPolarHBondContact O-CB 3.41Å; R307-H311 PolarHBondContact O-CD2 2.83Å; R307-H311 PolarHBondContact O-N 3.04Å; R307-L350 HydrophobicContact CB-CD1 4.46Å; R307-L350 HydrophobicContact CB-CD2 4.47Å
308L93.7Very high92.9Very high1 Ų126.6 Ų26.61%0.00516%0.164CC..Hα-helixtrans-64.6-42.8174.2-71.7-179.4000112.7I300 V304 G305 A306 A312 L318 L329 L350 I351I300-L308 HydrophobicContact CD1-CD1 3.44Å; I300-L308 VanDerWaalsContact CD1-CD1 3.44Å; I300-L308 HydrophobicContact CD1-CG 4.45Å; V304-L308 WeakPolarHBondContact O-CG 3.48Å; V304-L308 PolarHBondContact O-N 2.95Å; G305-L308 PolarHBondContact O-N 3.19Å; A306-L308 VanDerWaalsContact C-N 3.35Å; A306-L308 PolarHBondContact O-N 3.47Å; L308-A312 WeakPolarHBondContact O-CB 3.45Å; L308-A312 PolarHBondContact O-N 3.33Å; L308-L318 HydrophobicContact CB-CD2 4.21Å; L308-L329 HydrophobicContact CD2-CB 4.18Å; L308-L329 HydrophobicContact CD2-CD1 4.23Å; L308-L350 HydrophobicContact CD2-CB 3.96Å; L308-L350 HydrophobicContact CD2-CD1 4.16Å; L308-I351 HydrophobicContact CD1-CG1 4.25Å; L308-I351 HydrophobicContact CD2-CG1 4.12Å
309I94.2Very high93Very high0 Ų025.6 Ų25.60%016%0.156CC..Hα-helixtrans-64.5-44176.9-67.5171.5000110.5D165 I169 M289 A293 L296 G305 A306 A312 G313 S314 L315 L318D165-I309 HydrophobicContact CB-CG2 4.39Å; I169-I309 HydrophobicContact CD1-CG2 4.34Å; I169-I309 HydrophobicContact CG1-CG2 4.03Å; M289-I309 HydrophobicContact CE-CD1 4.18Å; M289-I309 HydrophobicContact SD-CD1 4.22Å; A293-I309 HydrophobicContact CB-CD1 4.38Å; L296-I309 HydrophobicContact CD2-CD1 4.25Å; L296-I309 HydrophobicContact CD2-CG1 4.3Å; G305-I309 WeakPolarHBondContact O-CG1 3.35Å; G305-I309 PolarHBondContact O-N 3.06Å; A306-I309 PolarHBondContact O-N 3.42Å; I309-A312 PolarHBondContact O-N 2.84Å; I309-G313 PolarHBondContact O-N 3.38Å; I309-S314 PolarHBondContact O-N 3.49Å; I309-L315 HydrophobicContact CD1-CD1 4.14Å; I309-L315 HydrophobicContact CG1-CD1 4.28Å; I309-L318 HydrophobicContact CG1-CD2 3.83Å
310A94.2Very high93.1Very high28 Ų2832.1 Ų32.123%0.23118%0.184CC..Hα-helixtrans-62.4-45.9177.800000112.7I169 I172 A306 R307 A312 G313I169-A310 HydrophobicContact CG1-CB 4.47Å; I169-A310 HydrophobicContact CG2-CB 4.1Å; I172-A310 HydrophobicContact CG2-CB 3.64Å; A306-A310 WeakPolarHBondContact O-CB 3.42Å; A306-A310 PolarHBondContact O-N 3.47Å; R307-A310 PolarHBondContact O-N 2.83Å; A310-A312 VanDerWaalsContact C-N 3.29Å; A310-A312 PolarHBondContact O-N 3.18Å; A310-G313 PolarHBondContact O-N 3.11Å
311H92.6Very high93.2Very high102 Ų10235.4 Ų35.447%0.47220%0.196SC..Hα-helixtrans-67.1-26.8175.9-87.9-92.7000113.7R307 G313 L350R307-H311 WeakPolarHBondContact O-CB 3.41Å; R307-H311 PolarHBondContact O-CD2 2.83Å; R307-H311 PolarHBondContact O-N 3.04Å; H311-G313 VanDerWaalsContact C-N 3.33Å; H311-L350 HydrophobicContact CB-CD1 4Å; H311-L350 VanDerWaalsContact CD2-CD1 3.41Å; H311-L350 WeakPolarHBondContact CD2-CD1 3.46Å
312A93.2Very high93.5Very high4 Ų437.3 Ų37.33%0.03321%0.205CC..Hα-helixtrans-80.6-13171.500000113.8L308 I309 A310 S314 N317 L318 Y321L308-A312 WeakPolarHBondContact O-CB 3.45Å; L308-A312 PolarHBondContact O-N 3.33Å; I309-A312 PolarHBondContact O-N 2.84Å; A310-A312 VanDerWaalsContact C-N 3.29Å; A310-A312 PolarHBondContact O-N 3.18Å; A312-S314 PolarHBondContact O-N 2.98Å; A312-N317 HydrophobicContact CB-CB 4.49Å; A312-N317 VanDerWaalsContact O-CB 3.25Å; A312-N317 WeakPolarHBondContact O-CB 3.48Å; A312-N317 PolarHBondContact O-ND2 3.21Å; A312-L318 HydrophobicContact CB-CB 3.76Å; A312-L318 HydrophobicContact CB-CD1 4.16Å; A312-Y321 HydrophobicContact CB-CD2 4.21Å; A312-Y321 HydrophobicContact CB-CE2 3.75Å
313G91.7Very high93.6Very high45 Ų4535.9 Ų35.946%0.46420%0.201SC..THydrogen-bonded Turntrans74.7-12.6-176.500000115.4I169 I309 A310 H311I169-G313 WeakPolarHBondContact CD1-O 3.44Å; I309-G313 PolarHBondContact O-N 3.38Å; A310-G313 PolarHBondContact O-N 3.11Å; H311-G313 VanDerWaalsContact C-N 3.33Å
314S91.9Very high93.6Very high22 Ų2238.1 Ų38.115%0.15422%0.215CC..SBendtrans-168.5152.4172.3170.90000110.3D165 I309 A312 T316 N317 L318D165-S314 WeakPolarHBondContact OD2-CA 3.4Å; D165-S314 VanDerWaalsContact OD2-CB 3.27Å; D165-S314 WeakPolarHBondContact OD2-CB 3.39Å; D165-S314 PolarHBondContact OD2-OG 3.26Å; I309-S314 PolarHBondContact O-N 3.49Å; A312-S314 PolarHBondContact O-N 2.98Å; S314-T316 PolarHBondContact O-N 2.73Å; S314-T316 PolarHBondContact OG-N 3.39Å; S314-T316 VanDerWaalsContact OG-N 3.07Å; S314-N317 PolarHBondContact O-N 3.33Å; S314-L318 PolarHBondContact O-N 3.49Å
315L92.4Very high93.6Very high10 Ų1039.4 Ų39.45%0.05222%0.222CC..Hα-helixtrans-58.8-35.3169179.161.2000111.5D165 V292 A293 I309 N317 L318 A319 C384D165-L315 HydrophobicContact CB-CB 4.22Å; D165-L315 PolarHBondContact OD2-N 3.45Å; V292-L315 HydrophobicContact CG1-CD2 3.97Å; A293-L315 HydrophobicContact CB-CD2 4.38Å; I309-L315 HydrophobicContact CD1-CD1 4.14Å; I309-L315 HydrophobicContact CG1-CD1 4.28Å; L315-N317 VanDerWaalsContact C-N 3.34Å; L315-N317 PolarHBondContact O-N 2.83Å; L315-L318 HydrophobicContact CD1-CD2 4.47Å; L315-L318 PolarHBondContact O-N 2.93Å; L315-A319 WeakPolarHBondContact O-CB 3.22Å; L315-A319 PolarHBondContact O-N 3.33Å; L315-C384 HydrophobicContact CD2-CB 4.35Å; L315-C384 HydrophobicContact CG-CB 4.1Å
316T92.7Very high93.6Very high55 Ų5539.4 Ų39.434%0.33722%0.222SC..Hα-helixtrans-65.9-37.3176.9-570000111.6S314 K320S314-T316 PolarHBondContact O-N 2.73Å; S314-T316 PolarHBondContact OG-N 3.39Å; S314-T316 VanDerWaalsContact OG-N 3.07Å; T316-K320 HydrophobicContact CG2-CD 4.43Å; T316-K320 VanDerWaalsContact O-CG 3.29Å; T316-K320 WeakPolarHBondContact O-CG 3.32Å; T316-K320 PolarHBondContact O-N 2.98Å; T316-K320 VanDerWaalsContact O-N 3.15Å
317N93.7Very high93.6Very high62 Ų6240.5 Ų40.533%0.33223%0.227SC..Hα-helixtrans-70.9-41.2175.1-69.6-11.9000111.1A312 S314 L315 A319 K320 Y321A312-N317 HydrophobicContact CB-CB 4.49Å; A312-N317 VanDerWaalsContact O-CB 3.25Å; A312-N317 WeakPolarHBondContact O-CB 3.48Å; A312-N317 PolarHBondContact O-ND2 3.21Å; S314-N317 PolarHBondContact O-N 3.33Å; L315-N317 VanDerWaalsContact C-N 3.34Å; L315-N317 PolarHBondContact O-N 2.83Å; N317-A319 VanDerWaalsContact C-N 3.3Å; N317-A319 PolarHBondContact O-N 2.89Å; N317-K320 PolarHBondContact O-N 3.07Å; N317-K320 VanDerWaalsContact O-N 3.17Å; N317-Y321 PolarHBondContact O-N 2.97Å
318L94.3Very high93.5Very high1 Ų138.9 Ų38.91%0.00522%0.224CC..Hα-helixtrans-59.9-39.4175.2-175.162.4000112.3L296 L308 I309 A312 S314 L315 V326 L329L296-L318 HydrophobicContact CD2-CD2 4Å; L308-L318 HydrophobicContact CB-CD2 4.21Å; I309-L318 HydrophobicContact CG1-CD2 3.83Å; A312-L318 HydrophobicContact CB-CB 3.76Å; A312-L318 HydrophobicContact CB-CD1 4.16Å; S314-L318 PolarHBondContact O-N 3.49Å; L315-L318 HydrophobicContact CD1-CD2 4.47Å; L315-L318 PolarHBondContact O-N 2.93Å; L318-V326 HydrophobicContact CD1-CG2 4.07Å; L318-L329 HydrophobicContact CD1-CD1 3.73Å
319A94Very high93.4Very high2 Ų239.1 Ų39.12%0.01723%0.225CC..Hα-helixtrans-68.1-36175.600000112.9L315 N317 R381 C384 F385L315-A319 WeakPolarHBondContact O-CB 3.22Å; L315-A319 PolarHBondContact O-N 3.33Å; N317-A319 VanDerWaalsContact C-N 3.3Å; N317-A319 PolarHBondContact O-N 2.89Å; A319-R381 HydrophobicContact CB-CG 3.92Å; A319-R381 WeakPolarHBondContact O-CG 3.45Å; A319-R381 PolarHBondContact O-NE 2.98Å; A319-C384 HydrophobicContact CB-CB 3.94Å; A319-F385 HydrophobicContact CB-CE2 4.14Å
320K95.2Very high93.2Very high138 Ų13840.9 Ų40.960%0.624%0.243SC*.Hα-helixtrans-70.3-33.2175.4-74.6169.6-179.4174.60113T316 N317T316-K320 HydrophobicContact CG2-CD 4.43Å; T316-K320 VanDerWaalsContact O-CG 3.29Å; T316-K320 WeakPolarHBondContact O-CG 3.32Å; T316-K320 PolarHBondContact O-N 2.98Å; T316-K320 VanDerWaalsContact O-N 3.15Å; N317-K320 PolarHBondContact O-N 3.07Å; N317-K320 VanDerWaalsContact O-N 3.17Å
321Y94.4Very high93Very high81 Ų8140.2 Ų40.232%0.31824%0.238SC..SBendtrans-62.4142.2-179.8-69.4-25.7000112.5A312 N317 T325 L329 R381A312-Y321 HydrophobicContact CB-CD2 4.21Å; A312-Y321 HydrophobicContact CB-CE2 3.75Å; N317-Y321 PolarHBondContact O-N 2.97Å; Y321-T325 HydrophobicContact CD2-CG2 4.26Å; Y321-T325 HydrophobicContact CG-CG2 4.15Å; Y321-L329 HydrophobicContact CD2-CD1 4.42Å; Y321-L329 HydrophobicContact CD2-CD2 4.38Å; Y321-L329 HydrophobicContact CE2-CD2 4.23Å; Y321-R381 PolarHBondContact O-NH2 3.46Å
322P96.1Very high92.8Very high63 Ų6338.9 Ų38.941%0.40923%0.232SC..  trans-72.2154171.232.2-34.9000110S324 T325 V326P322-S324 PolarHBondContact O-N 2.78Å; P322-S324 VanDerWaalsContact O-N 3.1Å; P322-T325 WeakPolarHBondContact CG-OG1 3.49Å; P322-T325 WeakPolarHBondContact O-CB 3.45Å; P322-T325 PolarHBondContact O-N 2.93Å; P322-V326 PolarHBondContact O-N 3.18Å; P322-V326 VanDerWaalsContact O-N 3.08Å
323A94.4Very high92.5Very high16 Ų1647.7 Ų47.713%0.13227%0.269CS..Hα-helixtrans-57.8-27.9-179.800000113.9V326 Q327 N374A323-V326 PolarHBondContact O-N 2.92Å; A323-Q327 WeakPolarHBondContact O-CB 3.35Å; A323-Q327 PolarHBondContact O-N 2.88Å; A323-N374 HydrophobicContact CB-CB 4.42Å; A323-N374 WeakPolarHBondContact CB-OD1 3.45Å
324S92.6Very high92.4Very high79 Ų7947.2 Ų47.255%0.55226%0.261SS*.Hα-helixtrans-63.6-38172.748.70000113.2P322P322-S324 PolarHBondContact O-N 2.78Å; P322-S324 VanDerWaalsContact O-N 3.1Å
325T93Very high92.2Very high45 Ų4547.7 Ų47.728%0.27626%0.261SS..Hα-helixtrans-71-46172.2-58.70000110.1Y321 P322 Q327 I328 L329Y321-T325 HydrophobicContact CD2-CG2 4.26Å; Y321-T325 HydrophobicContact CG-CG2 4.15Å; P322-T325 WeakPolarHBondContact CG-OG1 3.49Å; P322-T325 WeakPolarHBondContact O-CB 3.45Å; P322-T325 PolarHBondContact O-N 2.93Å; T325-Q327 PolarHBondContact O-N 2.97Å; T325-I328 WeakPolarHBondContact O-CG1 3.43Å; T325-I328 PolarHBondContact O-N 2.69Å; T325-L329 HydrophobicContact CG2-CD2 4.25Å; T325-L329 PolarHBondContact O-N 3.44Å; T325-L329 VanDerWaalsContact O-N 3.13Å
326V93.5Very high92.1Very high1 Ų153.2 Ų53.21%0.00629%0.285CS..Hα-helixtrans-55.7-37178.2175.40000111.8L318 P322 A323 I328 L329 I351 A373 C376L318-V326 HydrophobicContact CD1-CG2 4.07Å; P322-V326 PolarHBondContact O-N 3.18Å; P322-V326 VanDerWaalsContact O-N 3.08Å; A323-V326 PolarHBondContact O-N 2.92Å; V326-I328 VanDerWaalsContact C-N 3.29Å; V326-I328 PolarHBondContact O-N 2.96Å; V326-L329 HydrophobicContact CG2-CD1 4.46Å; V326-I351 HydrophobicContact CG1-CD1 3.9Å; V326-I351 VanDerWaalsContact O-CD1 3.31Å; V326-I351 WeakPolarHBondContact O-CD1 3.49Å; V326-A373 HydrophobicContact CG1-CB 4.44Å; V326-C376 HydrophobicContact CG1-CB 4.28Å
327Q93.1Very high92Very high22 Ų2258.8 Ų58.810%0.10330%0.3CS..Hα-helixtrans-57.9-35.5175.1-175.3174.2-6.300113.7A323 T325 K347 Y348 G349 A373A323-Q327 WeakPolarHBondContact O-CB 3.35Å; A323-Q327 PolarHBondContact O-N 2.88Å; T325-Q327 PolarHBondContact O-N 2.97Å; Q327-K347 WeakPolarHBondContact CG-O 3.43Å; Q327-K347 PolarHBondContact NE2-O 2.79Å; Q327-Y348 CarbonylContact O-C 3.57Å; Q327-Y348 WeakPolarHBondContact O-CA 3.35Å; Q327-G349 PolarHBondContact O-N 3.06Å; Q327-A373 HydrophobicContact CB-CB 3.75Å; Q327-A373 HydrophobicContact CG-CB 4.42Å
328I92.6Very high91.8Very high40 Ų4056.1 Ų56.121%0.20529%0.287CS..Hα-helixtrans-104.8-1.5-173.259.7167.1000114.3T325 V326 G330 A331 L335T325-I328 WeakPolarHBondContact O-CG1 3.43Å; T325-I328 PolarHBondContact O-N 2.69Å; V326-I328 VanDerWaalsContact C-N 3.29Å; V326-I328 PolarHBondContact O-N 2.96Å; I328-G330 PolarHBondContact O-N 3.31Å; I328-A331 WeakPolarHBondContact O-CA 3.26Å; I328-A331 WeakPolarHBondContact O-CB 3.27Å; I328-A331 PolarHBondContact O-N 3.16Å; I328-L335 HydrophobicContact CD1-CD2 3.47Å; I328-L335 VanDerWaalsContact CD1-CD2 3.47Å
329L91.8Very high91.6Very high6 Ų661.1 Ų61.13%0.03131%0.313CS..THydrogen-bonded Turntrans-53.4128.5-179.1-76.8176000111.5L308 L318 Y321 T325 V326 A331 G349 L350L308-L329 HydrophobicContact CD2-CB 4.18Å; L308-L329 HydrophobicContact CD2-CD1 4.23Å; L318-L329 HydrophobicContact CD1-CD1 3.73Å; Y321-L329 HydrophobicContact CD2-CD1 4.42Å; Y321-L329 HydrophobicContact CD2-CD2 4.38Å; Y321-L329 HydrophobicContact CE2-CD2 4.23Å; T325-L329 HydrophobicContact CG2-CD2 4.25Å; T325-L329 PolarHBondContact O-N 3.44Å; T325-L329 VanDerWaalsContact O-N 3.13Å; V326-L329 HydrophobicContact CG2-CD1 4.46Å; L329-A331 VanDerWaalsContact C-N 3.3Å; L329-A331 PolarHBondContact O-N 3.33Å; L329-G349 WeakPolarHBondContact O-CA 3.46Å; L329-L350 WeakPolarHBondContact O-CG 3.34Å; L329-L350 PolarHBondContact O-N 3.2Å
330G89.3Confident91.6Very high37 Ų3769.9 Ų69.938%0.38135%0.351SS..THydrogen-bonded Turntrans83.9-16.5-174.200000115.6I328 E332I328-G330 PolarHBondContact O-N 3.31Å; G330-E332 PolarHBondContact N-OE1 2.71Å
331A90.4Very high91.3Very high13 Ų1368.1 Ų68.111%0.10735%0.352CS..  trans-915.5171.900000113.6I328 L329 K333 A334 L335 P346 Y348I328-A331 WeakPolarHBondContact O-CA 3.26Å; I328-A331 WeakPolarHBondContact O-CB 3.27Å; I328-A331 PolarHBondContact O-N 3.16Å; L329-A331 VanDerWaalsContact C-N 3.3Å; L329-A331 PolarHBondContact O-N 3.33Å; A331-K333 PolarHBondContact O-N 2.81Å; A331-A334 WeakPolarHBondContact O-CA 3.36Å; A331-A334 WeakPolarHBondContact O-CB 3.23Å; A331-A334 PolarHBondContact O-N 3.35Å; A331-L335 PolarHBondContact O-N 2.91Å; A331-P346 HydrophobicContact CB-CB 4.06Å; A331-P346 HydrophobicContact CB-CG 4.01Å; A331-Y348 WeakPolarHBondContact CB-O 3.27Å
332E87.6Confident91Very high75 Ų7575.7 Ų75.735%0.3538%0.38SS..Hα-helixtrans-53.6-45.2-172.3-68.4152.9-126.500113.4G330 A334 L335 F336G330-E332 PolarHBondContact N-OE1 2.71Å; E332-A334 VanDerWaalsContact C-N 3.3Å; E332-A334 PolarHBondContact O-N 3.08Å; E332-L335 WeakPolarHBondContact O-CB 3.35Å; E332-L335 PolarHBondContact O-N 3.2Å; E332-L335 VanDerWaalsContact O-N 3.14Å; E332-F336 HydrophobicContact CB-CD2 4.38Å; E332-F336 HydrophobicContact CB-CE2 4.18Å; E332-F336 WeakPolarHBondContact O-CD2 3.49Å; E332-F336 PolarHBondContact O-N 3.07Å
333K88.1Confident90.6Very high189 Ų18974.4 Ų74.482%0.82238%0.378SS*.Hα-helixtrans-58.6-41.2176.9-67.2-177.2-179.41780112A331 R337A331-K333 PolarHBondContact O-N 2.81Å; K333-R337 WeakPolarHBondContact O-CB 3.21Å; K333-R337 PolarHBondContact O-N 2.7Å
334A89Confident90.2Very high35 Ų3581.4 Ų81.429%0.28941%0.413SS..Hα-helixtrans-71.3-35.9177.100000111.9A331 E332 R337 A338 P346A331-A334 WeakPolarHBondContact O-CA 3.36Å; A331-A334 WeakPolarHBondContact O-CB 3.23Å; A331-A334 PolarHBondContact O-N 3.35Å; E332-A334 VanDerWaalsContact C-N 3.3Å; E332-A334 PolarHBondContact O-N 3.08Å; A334-R337 PolarHBondContact O-N 3.39Å; A334-A338 WeakPolarHBondContact O-CB 3.4Å; A334-A338 PolarHBondContact O-N 3.24Å; A334-P346 HydrophobicContact CB-CG 4.23Å
335L88.5Confident90Very high31 Ų3181.3 Ų81.316%0.16241%0.409CS..Hα-helixtrans-63.8-49.8173.6179.363.5000111.7I328 A331 E332 R337 A338 L339 T345 P346I328-L335 HydrophobicContact CD1-CD2 3.47Å; I328-L335 VanDerWaalsContact CD1-CD2 3.47Å; A331-L335 PolarHBondContact O-N 2.91Å; E332-L335 WeakPolarHBondContact O-CB 3.35Å; E332-L335 PolarHBondContact O-N 3.2Å; E332-L335 VanDerWaalsContact O-N 3.14Å; L335-R337 VanDerWaalsContact C-N 3.29Å; L335-R337 PolarHBondContact O-N 2.8Å; L335-A338 PolarHBondContact O-N 2.77Å; L335-L339 HydrophobicContact CD1-CD1 4.25Å; L335-L339 HydrophobicContact CD1-CG 4.3Å; L335-L339 HydrophobicContact CG-CD1 4.06Å; L335-L339 WeakPolarHBondContact O-CG 3.38Å; L335-L339 PolarHBondContact O-N 3.06Å; L335-T345 HydrophobicContact CD1-CG2 3.82Å; L335-P346 HydrophobicContact CB-CG 3.9Å
336F88.9Confident89.7Confident126 Ų12680.7 Ų80.755%0.55341%0.406SS*.Hα-helixtrans-63.8-34.3177.2-70.4-59.7000112.4E332 K340E332-F336 HydrophobicContact CB-CD2 4.38Å; E332-F336 HydrophobicContact CB-CE2 4.18Å; E332-F336 WeakPolarHBondContact O-CD2 3.49Å; E332-F336 PolarHBondContact O-N 3.07Å; F336-K340 VanDerWaalsContact O-CG 3.31Å; F336-K340 WeakPolarHBondContact O-CG 3.47Å; F336-K340 PolarHBondContact O-N 3.47Å; F336-K340 VanDerWaalsContact O-N 3.13Å
337R90.7Very high89.3Confident172 Ų17287.4 Ų87.465%0.64944%0.435SS*.Hα-helixtrans-63.3-50171.3-174.1173.165.7-156.42.1111.2K333 A334 L335 L339 K340 T341K333-R337 WeakPolarHBondContact O-CB 3.21Å; K333-R337 PolarHBondContact O-N 2.7Å; A334-R337 PolarHBondContact O-N 3.39Å; L335-R337 VanDerWaalsContact C-N 3.29Å; L335-R337 PolarHBondContact O-N 2.8Å; R337-L339 PolarHBondContact O-N 3.29Å; R337-K340 PolarHBondContact O-N 3.21Å; R337-T341 PolarHBondContact O-N 3.47Å; R337-T341 PolarHBondContact O-OG1 2.89Å; R337-T341 VanDerWaalsContact O-OG1 3.13Å
338A90.3Very high89Confident7 Ų790.5 Ų90.56%0.05845%0.446CS..Hα-helixtrans-60.9-40.6178.600000112.7A334 L335 T341 R342 G343 N344 T345A334-A338 WeakPolarHBondContact O-CB 3.4Å; A334-A338 PolarHBondContact O-N 3.24Å; L335-A338 PolarHBondContact O-N 2.77Å; A338-T341 PolarHBondContact O-N 3.5Å; A338-R342 CarbonylContact O-C 3.59Å; A338-R342 VanDerWaalsContact O-CA 3.25Å; A338-R342 WeakPolarHBondContact O-CA 3.46Å; A338-R342 PolarHBondContact O-N 3.35Å; A338-G343 PolarHBondContact O-N 3.24Å; A338-N344 WeakPolarHBondContact CB-O 3.5Å; A338-T345 HydrophobicContact CB-CG2 4.36Å
339L90.1Very high88.8Confident106 Ų10689.1 Ų89.156%0.55544%0.442SS*.Hα-helixtrans-64-40175.8-71.2170.6000112.2L335 R337L335-L339 HydrophobicContact CD1-CD1 4.25Å; L335-L339 HydrophobicContact CD1-CG 4.3Å; L335-L339 HydrophobicContact CG-CD1 4.06Å; L335-L339 WeakPolarHBondContact O-CG 3.38Å; L335-L339 PolarHBondContact O-N 3.06Å; R337-L339 PolarHBondContact O-N 3.29Å
340K93Very high88.7Confident186 Ų18690 Ų9081%0.80945%0.447SS*.Hα-helixtrans-67.1-41.9175.7-74.6176179.7-175.30112.7F336 R337F336-K340 VanDerWaalsContact O-CG 3.31Å; F336-K340 WeakPolarHBondContact O-CG 3.47Å; F336-K340 PolarHBondContact O-N 3.47Å; F336-K340 VanDerWaalsContact O-N 3.13Å; R337-K340 PolarHBondContact O-N 3.21Å
341T90.6Very high88.7Confident101 Ų10188.2 Ų88.262%0.6243%0.429SS*.Hα-helixtrans-88.7-0.6-178.662.20000114R337 A338 G343R337-T341 PolarHBondContact O-N 3.47Å; R337-T341 PolarHBondContact O-OG1 2.89Å; R337-T341 VanDerWaalsContact O-OG1 3.13Å; A338-T341 PolarHBondContact O-N 3.5Å; T341-G343 PolarHBondContact O-N 3.5Å; T341-G343 PolarHBondContact OG1-N 3.49Å
342R87.4Confident88.6Confident240 Ų24091 Ų9191%0.90644%0.438SS*.THydrogen-bonded Turntrans50.830.6-166.8-59.3-177.2178.2178.7-0.4113.3A338A338-R342 CarbonylContact O-C 3.59Å; A338-R342 VanDerWaalsContact O-CA 3.25Å; A338-R342 WeakPolarHBondContact O-CA 3.46Å; A338-R342 PolarHBondContact O-N 3.35Å
343G88.1Confident88.5Confident35 Ų3593.3 Ų93.336%0.36145%0.449SS..  trans-83.9-177.9177.900000113.5A338 T341 T345A338-G343 PolarHBondContact O-N 3.24Å; T341-G343 PolarHBondContact O-N 3.5Å; T341-G343 PolarHBondContact OG1-N 3.49Å; G343-T345 PolarHBondContact O-N 3.22Å
344N86.6Confident88.4Confident164 Ų16484.4 Ų84.488%0.87741%0.411SS*.PPolyproline II helixtrans-63.3117.4178.1-71-31.9000111.6A338A338-N344 WeakPolarHBondContact CB-O 3.5Å
345T87.3Confident88.3Confident76 Ų7686.5 Ų86.547%0.46642%0.42SS..PPolyproline II helixtrans-68.8137.6174.8550000111.3L335 A338 G343L335-T345 HydrophobicContact CD1-CG2 3.82Å; A338-T345 HydrophobicContact CB-CG2 4.36Å; G343-T345 PolarHBondContact O-N 3.22Å
346P87Confident88.2Confident33 Ų3385.1 Ų85.121%0.21441%0.412CS..PPolyproline II helixtrans-62.1139.1176.427.4-34.7000111.1A331 A334 L335A331-P346 HydrophobicContact CB-CB 4.06Å; A331-P346 HydrophobicContact CB-CG 4.01Å; A334-P346 HydrophobicContact CB-CG 4.23Å; L335-P346 HydrophobicContact CB-CG 3.9Å
347K84.4Confident88Confident141 Ų14179.1 Ų79.161%0.61339%0.386SS*.SBendtrans-93.8-7.7-178.6-67.5178.8-178.41710113.8Q327Q327-K347 WeakPolarHBondContact CG-O 3.43Å; Q327-K347 PolarHBondContact NE2-O 2.79Å
348Y87.7Confident87.8Confident87 Ų8773.4 Ų73.434%0.34138%0.381SS..  trans-157.9151.3-177.541.7-106.3000109.8Q327 A331 F352Q327-Y348 CarbonylContact O-C 3.57Å; Q327-Y348 WeakPolarHBondContact O-CA 3.35Å; A331-Y348 WeakPolarHBondContact CB-O 3.27Å; Y348-F352 HydrophobicContact CD1-CD2 4.11Å; Y348-F352 HydrophobicContact CD2-CB 3.6Å; Y348-F352 AromaticContact CD2-CD2 3.43Å; Y348-F352 HydrophobicContact CD2-CD2 3.43Å; Y348-F352 VanDerWaalsContact CD2-CD2 3.43Å; Y348-F352 HydrophobicContact CD2-CE2 4.27Å; Y348-F352 AromaticContact CD2-CG 3.67Å; Y348-F352 HydrophobicContact CD2-CG 3.67Å; Y348-F352 AromaticContact CE1-CD2 3.93Å; Y348-F352 HydrophobicContact CE1-CD2 3.93Å; Y348-F352 HydrophobicContact CE1-CE2 4.1Å; Y348-F352 HydrophobicContact CE2-CB 4.13Å; Y348-F352 HydrophobicContact CE2-CD1 4.39Å; Y348-F352 AromaticContact CE2-CD2 3.2Å; Y348-F352 HydrophobicContact CE2-CD2 3.2Å; Y348-F352 AromaticContact CE2-CE2 3.59Å; Y348-F352 HydrophobicContact CE2-CE2 3.59Å; Y348-F352 AromaticContact CE2-CG 3.66Å; Y348-F352 HydrophobicContact CE2-CG 3.66Å; Y348-F352 HydrophobicContact CE2-CZ 4.33Å; Y348-F352 HydrophobicContact CG-CB 4.15Å; Y348-F352 AromaticContact CG-CD2 3.87Å; Y348-F352 HydrophobicContact CG-CD2 3.87Å; Y348-F352 HydrophobicContact CG-CG 4.37Å; Y348-F352 AromaticContact CZ-CD2 3.47Å; Y348-F352 VanDerWaalsContact CZ-CD2 3.47Å; Y348-F352 AromaticContact CZ-CE2 3.48Å; Y348-F352 VanDerWaalsContact CZ-CE2 3.48Å
349G88.3Confident87.6Confident12 Ų1281 Ų8112%0.12441%0.408CS..SBendtrans-114.4-128.4165.600000111.5Q327 L329 I351 F352Q327-G349 PolarHBondContact O-N 3.06Å; L329-G349 WeakPolarHBondContact O-CA 3.46Å; G349-I351 PolarHBondContact O-N 3.14Å; G349-F352 WeakPolarHBondContact O-CB 3.49Å; G349-F352 PolarHBondContact O-N 3.11Å
350L89.5Confident87.5Confident24 Ų2476.2 Ų76.213%0.12638%0.384CS..G310 helixtrans-54-29.9-174.7-66.3160.8000114.2R307 L308 H311 L329 F352 H353R307-L350 HydrophobicContact CB-CD1 4.46Å; R307-L350 HydrophobicContact CB-CD2 4.47Å; L308-L350 HydrophobicContact CD2-CB 3.96Å; L308-L350 HydrophobicContact CD2-CD1 4.16Å; H311-L350 HydrophobicContact CB-CD1 4Å; H311-L350 VanDerWaalsContact CD2-CD1 3.41Å; H311-L350 WeakPolarHBondContact CD2-CD1 3.46Å; L329-L350 WeakPolarHBondContact O-CG 3.34Å; L329-L350 PolarHBondContact O-N 3.2Å; L350-F352 PolarHBondContact O-N 2.91Å; L350-F352 VanDerWaalsContact O-N 3.11Å; L350-H353 PolarHBondContact O-CD2 3.07Å; L350-H353 PolarHBondContact O-N 3.04Å; L350-H353 VanDerWaalsContact O-N 3.12Å
351I89.9Confident87.3Confident0 Ų070.2 Ų70.20%037%0.369CS..G310 helixtrans-59.5-22.3176.9-52.9-174.9000111.7L308 V326 G349 H353 S354 I357 L372 A373L308-I351 HydrophobicContact CD1-CG1 4.25Å; L308-I351 HydrophobicContact CD2-CG1 4.12Å; V326-I351 HydrophobicContact CG1-CD1 3.9Å; V326-I351 VanDerWaalsContact O-CD1 3.31Å; V326-I351 WeakPolarHBondContact O-CD1 3.49Å; G349-I351 PolarHBondContact O-N 3.14Å; I351-H353 PolarHBondContact O-N 2.65Å; I351-S354 WeakPolarHBondContact O-CB 3.41Å; I351-S354 PolarHBondContact O-N 3.12Å; I351-S354 PolarHBondContact O-OG 3.18Å; I351-I357 HydrophobicContact CG2-CD1 3.86Å; I351-I357 WeakPolarHBondContact O-CD1 3.31Å; I351-L372 HydrophobicContact CG2-CB 4.5Å; I351-L372 HydrophobicContact CG2-CD2 3.55Å; I351-L372 HydrophobicContact CG2-CG 3.9Å; I351-A373 HydrophobicContact CD1-CB 3.99Å
352F88.1Confident87.1Confident71 Ų7169.6 Ų69.631%0.31137%0.374SS..G310 helixtrans-56.3-30.4174.8-175.1-104.6000113.5Y348 G349 L350 S354 I357 K365Y348-F352 HydrophobicContact CD1-CD2 4.11Å; Y348-F352 HydrophobicContact CD2-CB 3.6Å; Y348-F352 AromaticContact CD2-CD2 3.43Å; Y348-F352 HydrophobicContact CD2-CD2 3.43Å; Y348-F352 VanDerWaalsContact CD2-CD2 3.43Å; Y348-F352 HydrophobicContact CD2-CE2 4.27Å; Y348-F352 AromaticContact CD2-CG 3.67Å; Y348-F352 HydrophobicContact CD2-CG 3.67Å; Y348-F352 AromaticContact CE1-CD2 3.93Å; Y348-F352 HydrophobicContact CE1-CD2 3.93Å; Y348-F352 HydrophobicContact CE1-CE2 4.1Å; Y348-F352 HydrophobicContact CE2-CB 4.13Å; Y348-F352 HydrophobicContact CE2-CD1 4.39Å; Y348-F352 AromaticContact CE2-CD2 3.2Å; Y348-F352 HydrophobicContact CE2-CD2 3.2Å; Y348-F352 AromaticContact CE2-CE2 3.59Å; Y348-F352 HydrophobicContact CE2-CE2 3.59Å; Y348-F352 AromaticContact CE2-CG 3.66Å; Y348-F352 HydrophobicContact CE2-CG 3.66Å; Y348-F352 HydrophobicContact CE2-CZ 4.33Å; Y348-F352 HydrophobicContact CG-CB 4.15Å; Y348-F352 AromaticContact CG-CD2 3.87Å; Y348-F352 HydrophobicContact CG-CD2 3.87Å; Y348-F352 HydrophobicContact CG-CG 4.37Å; Y348-F352 AromaticContact CZ-CD2 3.47Å; Y348-F352 VanDerWaalsContact CZ-CD2 3.47Å; Y348-F352 AromaticContact CZ-CE2 3.48Å; Y348-F352 VanDerWaalsContact CZ-CE2 3.48Å; G349-F352 WeakPolarHBondContact O-CB 3.49Å; G349-F352 PolarHBondContact O-N 3.11Å; L350-F352 PolarHBondContact O-N 2.91Å; L350-F352 VanDerWaalsContact O-N 3.11Å; F352-S354 PolarHBondContact O-N 3.4Å; F352-I357 HydrophobicContact CD2-CG2 3.63Å; F352-I357 HydrophobicContact CE2-CG2 4.04Å; F352-K365 HydrophobicContact CE2-CD 4.39Å
353H84.5Confident87.1Confident123 Ų12367.6 Ų67.657%0.56937%0.372SS*.G310 helixtrans-76-0.7176-57.3-70.2000113.7V304 L350 I351V304-H353 HydrophobicContact CG2-CB 4.38Å; L350-H353 PolarHBondContact O-CD2 3.07Å; L350-H353 PolarHBondContact O-N 3.04Å; L350-H353 VanDerWaalsContact O-N 3.12Å; I351-H353 PolarHBondContact O-N 2.65Å
354S86.2Confident87.1Confident3 Ų367.3 Ų67.32%0.02136%0.362CS..SBendtrans-70.7140.6170.166.70000111.5I351 F352 F356 I357 G358 L372I351-S354 WeakPolarHBondContact O-CB 3.41Å; I351-S354 PolarHBondContact O-N 3.12Å; I351-S354 PolarHBondContact O-OG 3.18Å; F352-S354 PolarHBondContact O-N 3.4Å; S354-F356 PolarHBondContact O-N 2.92Å; S354-F356 VanDerWaalsContact O-N 3.17Å; S354-I357 PolarHBondContact O-N 2.9Å; S354-I357 VanDerWaalsContact O-N 3.12Å; S354-G358 PolarHBondContact O-N 2.87Å; S354-L372 VanDerWaalsContact OG-CD2 3.26Å; S354-L372 WeakPolarHBondContact OG-CD2 3.49Å
355T86.5Confident87.3Confident79 Ų7961.8 Ų61.849%0.48533%0.33SS..Hα-helixtrans-56.9-33.5-178.351.60000113.1I357 G358 R359T355-I357 PolarHBondContact O-N 3.07Å; T355-G358 PolarHBondContact O-N 3.31Å; T355-R359 WeakPolarHBondContact O-CG 3.4Å; T355-R359 PolarHBondContact O-N 3.47Å; T355-R359 VanDerWaalsContact O-N 3.11Å
356F86.3Confident87.3Confident1 Ų159.1 Ų59.10%0.00432%0.318CS..Hα-helixtrans-62-40.1177.5-54.4-71.1000113.5L299 S354 A360 L372 R398 V401 E402L299-F356 VanDerWaalsContact O-CE2 3.27Å; L299-F356 WeakPolarHBondContact O-CE2 3.4Å; S354-F356 PolarHBondContact O-N 2.92Å; S354-F356 VanDerWaalsContact O-N 3.17Å; F356-A360 WeakPolarHBondContact O-CB 3.21Å; F356-A360 PolarHBondContact O-N 2.96Å; F356-L372 HydrophobicContact CB-CD2 4.46Å; F356-L372 HydrophobicContact CD2-CD2 4.29Å; F356-R398 HydrophobicContact CE1-CG 4.49Å; F356-R398 HydrophobicContact CZ-CG 3.78Å; F356-V401 HydrophobicContact CB-CG1 4.14Å; F356-V401 HydrophobicContact CD1-CG1 3.8Å; F356-V401 HydrophobicContact CD2-CG1 4.21Å; F356-V401 HydrophobicContact CE1-CG1 4.33Å; F356-V401 HydrophobicContact CG-CG1 3.75Å; F356-E402 HydrophobicContact CD1-CG 4.29Å; F356-E402 HydrophobicContact CE1-CG 3.54Å; F356-E402 HydrophobicContact CZ-CG 4.43Å
357I85.5Confident87.4Confident0 Ų065 Ų650%034%0.336CS..Hα-helixtrans-78.3-27179.2-61.2-177.4000111.1I351 F352 S354 T355 K365 I368 L372I351-I357 HydrophobicContact CG2-CD1 3.86Å; I351-I357 WeakPolarHBondContact O-CD1 3.31Å; F352-I357 HydrophobicContact CD2-CG2 3.63Å; F352-I357 HydrophobicContact CE2-CG2 4.04Å; S354-I357 PolarHBondContact O-N 2.9Å; S354-I357 VanDerWaalsContact O-N 3.12Å; T355-I357 PolarHBondContact O-N 3.07Å; I357-K365 HydrophobicContact CG2-CB 4.3Å; I357-K365 HydrophobicContact CG2-CD 4.24Å; I357-K365 HydrophobicContact CG2-CG 4.27Å; I357-K365 WeakPolarHBondContact O-CE 3.21Å; I357-K365 PolarHBondContact O-NZ 3.4Å; I357-I368 HydrophobicContact CG1-CG2 4.43Å; I357-L372 HydrophobicContact CD1-CD2 4.4Å; I357-L372 HydrophobicContact CG1-CD2 4.4Å
358G86.4Confident87.8Confident53 Ų5358.5 Ų58.555%0.54631%0.308SS..Hα-helixtrans-59.7-50.5169.300000112.4S354 T355S354-G358 PolarHBondContact O-N 2.87Å; T355-G358 PolarHBondContact O-N 3.31Å
359R87.1Confident88Confident167 Ų16754.4 Ų54.463%0.6329%0.292SS*.Hα-helixtrans-68.5-34.8-179.2-67.8175.9-178.7-178.6-1.3113.8T355 L405T355-R359 WeakPolarHBondContact O-CG 3.4Å; T355-R359 PolarHBondContact O-N 3.47Å; T355-R359 VanDerWaalsContact O-N 3.11Å; R359-L405 HydrophobicContact CB-CD2 4.07Å
360A86.7Confident88.2Confident4 Ų461.2 Ų61.23%0.03331%0.314CS..SBendtrans-59.5134.1-175.900000114.6F356 K365 I368 L405F356-A360 WeakPolarHBondContact O-CB 3.21Å; F356-A360 PolarHBondContact O-N 2.96Å; A360-K365 HydrophobicContact CB-CG 3.97Å; A360-K365 WeakPolarHBondContact O-CE 3.39Å; A360-K365 WeakPolarHBondContact O-CG 3.47Å; A360-I368 HydrophobicContact CB-CD1 3.44Å; A360-I368 VanDerWaalsContact CB-CD1 3.44Å; A360-L405 HydrophobicContact CB-CD1 4.05Å
361A88.4Confident88.4Confident60 Ų6062.2 Ų62.250%0.49632%0.316SS..  trans-54140.6171.100000112.2K363 N364 K365A361-K363 VanDerWaalsContact C-N 3.27Å; A361-K363 PolarHBondContact O-N 3.5Å; A361-N364 WeakPolarHBondContact O-CA 3.22Å; A361-N364 PolarHBondContact O-N 3.14Å; A361-K365 PolarHBondContact O-N 3.2Å; A361-K365 VanDerWaalsContact O-N 3.12Å
362A86.3Confident88.6Confident89 Ų8962.2 Ų62.274%0.73632%0.316SS*.THydrogen-bonded Turntrans-52.2-38.1-170.100000114.8N364A362-N364 VanDerWaalsContact C-N 3.3Å; A362-N364 PolarHBondContact O-N 3.48Å
363K88Confident88.9Confident198 Ų19858.9 Ų58.986%0.86130%0.301SS*.THydrogen-bonded Turntrans-64.3-31.8175.9-64.3-178.9-179.8177.60113A361A361-K363 VanDerWaalsContact C-N 3.27Å; A361-K363 PolarHBondContact O-N 3.5Å
364N88.9Confident89.4Confident29 Ų2956.5 Ų56.516%0.15529%0.293CS..THydrogen-bonded Turntrans-95.3-17.8-173.9-66.8-25000113.6A361 A362 G366 R367 I368A361-N364 WeakPolarHBondContact O-CA 3.22Å; A361-N364 PolarHBondContact O-N 3.14Å; A362-N364 VanDerWaalsContact C-N 3.3Å; A362-N364 PolarHBondContact O-N 3.48Å; N364-G366 VanDerWaalsContact C-N 3.26Å; N364-G366 PolarHBondContact O-N 3.47Å; N364-G366 VanDerWaalsContact O-N 3.11Å; N364-R367 WeakPolarHBondContact O-CA 3.27Å; N364-R367 WeakPolarHBondContact O-CB 3.44Å; N364-R367 PolarHBondContact O-N 2.96Å; N364-I368 HydrophobicContact CB-CD1 4.01Å; N364-I368 PolarHBondContact O-N 3.38Å
365K89.5Confident89.8Confident47 Ų4756.5 Ų56.520%0.20429%0.293CS..Hα-helixtrans-46.6-44.4179.7-71.1-168178.8-159.90113.7F352 I357 A360 A361 R367 S369F352-K365 HydrophobicContact CE2-CD 4.39Å; I357-K365 HydrophobicContact CG2-CB 4.3Å; I357-K365 HydrophobicContact CG2-CD 4.24Å; I357-K365 HydrophobicContact CG2-CG 4.27Å; I357-K365 WeakPolarHBondContact O-CE 3.21Å; I357-K365 PolarHBondContact O-NZ 3.4Å; A360-K365 HydrophobicContact CB-CG 3.97Å; A360-K365 WeakPolarHBondContact O-CE 3.39Å; A360-K365 WeakPolarHBondContact O-CG 3.47Å; A361-K365 PolarHBondContact O-N 3.2Å; A361-K365 VanDerWaalsContact O-N 3.12Å; K365-R367 PolarHBondContact O-N 2.86Å; K365-S369 WeakPolarHBondContact O-CB 3.21Å; K365-S369 PolarHBondContact O-N 3.45Å
366G88.6Confident90.1Very high20 Ų2052.9 Ų52.921%0.20627%0.27CS..Hα-helixtrans-69.6-28.1178.300000115N364 R370N364-G366 VanDerWaalsContact C-N 3.26Å; N364-G366 PolarHBondContact O-N 3.47Å; N364-G366 VanDerWaalsContact O-N 3.11Å; G366-R370 PolarHBondContact O-N 3.22Å
367R89.6Confident90.5Very high158 Ų15853 Ų5360%0.59627%0.272SS*.Hα-helixtrans-76.5-44.8175.6-66.9177.6171.8-179-4.9110.6N364 K365 R370 Y371N364-R367 WeakPolarHBondContact O-CA 3.27Å; N364-R367 WeakPolarHBondContact O-CB 3.44Å; N364-R367 PolarHBondContact O-N 2.96Å; K365-R367 PolarHBondContact O-N 2.86Å; R367-R370 PolarHBondContact O-N 2.89Å; R367-Y371 PolarHBondContact O-N 3.32Å; R367-Y371 VanDerWaalsContact O-N 3.12Å
368I92Very high90.9Very high4 Ų456.1 Ų56.12%0.02129%0.288CS..Hα-helixtrans-66.8-40.2177.7-69159.9000110.6I357 A360 N364 R370 Y371 L372 L405 Y408I357-I368 HydrophobicContact CG1-CG2 4.43Å; A360-I368 HydrophobicContact CB-CD1 3.44Å; A360-I368 VanDerWaalsContact CB-CD1 3.44Å; N364-I368 HydrophobicContact CB-CD1 4.01Å; N364-I368 PolarHBondContact O-N 3.38Å; I368-R370 PolarHBondContact O-N 3.43Å; I368-Y371 PolarHBondContact O-N 3.2Å; I368-Y371 VanDerWaalsContact O-N 3.15Å; I368-L372 WeakPolarHBondContact O-CB 3.47Å; I368-L372 PolarHBondContact O-N 3.2Å; I368-L405 HydrophobicContact CD1-CD1 3.78Å; I368-Y408 HydrophobicContact CD1-CD2 3.72Å; I368-Y408 HydrophobicContact CD1-CE2 4.17Å; I368-Y408 HydrophobicContact CG1-CD2 3.73Å; I368-Y408 HydrophobicContact CG1-CE2 3.66Å
369S92.5Very high91.3Very high0 Ų053.6 Ų53.60%026%0.262CS..Hα-helixtrans-56-45.5173.7179.50000113K365 L372 A373K365-S369 WeakPolarHBondContact O-CB 3.21Å; K365-S369 PolarHBondContact O-N 3.45Å; S369-L372 PolarHBondContact O-N 2.79Å; S369-A373 VanDerWaalsContact O-CB 3.31Å; S369-A373 WeakPolarHBondContact O-CB 3.47Å; S369-A373 PolarHBondContact O-N 2.74Å
370R92.3Very high91.6Very high156 Ų15645.7 Ų45.759%0.58923%0.232SC*.Hα-helixtrans-63.5-42.7175.3-176.1-176.2-66.5165.6-2.7112.1G366 R367 I368 A373 N374G366-R370 PolarHBondContact O-N 3.22Å; R367-R370 PolarHBondContact O-N 2.89Å; I368-R370 PolarHBondContact O-N 3.43Å; R370-A373 PolarHBondContact O-N 3.25Å; R370-N374 VanDerWaalsContact O-CG 3.3Å; R370-N374 PolarHBondContact O-N 2.93Å; R370-N374 PolarHBondContact O-OD1 3.11Å
371Y92.9Very high91.9Very high45 Ų4550.6 Ų50.618%0.17625%0.249CC..Hα-helixtrans-64.6-45.8178.6-174.8-101.7000111.7R367 I368 N374 K375 Q400 V401 R404R367-Y371 PolarHBondContact O-N 3.32Å; R367-Y371 VanDerWaalsContact O-N 3.12Å; I368-Y371 PolarHBondContact O-N 3.2Å; I368-Y371 VanDerWaalsContact O-N 3.15Å; Y371-N374 WeakPolarHBondContact O-CB 3.09Å; Y371-N374 PolarHBondContact O-N 3.12Å; Y371-K375 HydrophobicContact CD1-CG 4.44Å; Y371-K375 HydrophobicContact CE1-CG 4.18Å; Y371-K375 WeakPolarHBondContact O-CG 3.41Å; Y371-K375 PolarHBondContact O-N 3.41Å; Y371-K375 WeakPolarHBondContact OH-CE 3.45Å; Y371-Q400 VanDerWaalsContact CE1-O 3.29Å; Y371-Q400 WeakPolarHBondContact CE1-O 3.49Å; Y371-Q400 PolarHBondContact OH-O 2.93Å; Y371-Q400 VanDerWaalsContact OH-O 3.11Å; Y371-V401 HydrophobicContact CD1-CG2 4.08Å; Y371-V401 HydrophobicContact CE1-CG2 3.89Å; Y371-R404 HydrophobicContact CD1-CB 4.01Å; Y371-R404 HydrophobicContact CD1-CG 3.84Å; Y371-R404 HydrophobicContact CD2-CG 4.41Å; Y371-R404 HydrophobicContact CE1-CB 3.6Å; Y371-R404 HydrophobicContact CE1-CG 3.8Å; Y371-R404 HydrophobicContact CE2-CG 4.38Å; Y371-R404 HydrophobicContact CG-CG 4.13Å
372L93.7Very high92.1Very high0 Ų049.6 Ų49.60%024%0.235CC..Hα-helixtrans-62.6-43.5175.9-177.855.2000111.4L299 I300 I351 S354 F356 I357 I368 S369 N374 K375 C376 V401L299-L372 HydrophobicContact CD1-CD1 4.21Å; L299-L372 HydrophobicContact CD2-CD1 4.35Å; L299-L372 HydrophobicContact CG-CD1 4.13Å; I300-L372 HydrophobicContact CG2-CD1 3.92Å; I300-L372 HydrophobicContact CG2-CD2 4.29Å; I300-L372 HydrophobicContact CG2-CG 4.33Å; I351-L372 HydrophobicContact CG2-CB 4.5Å; I351-L372 HydrophobicContact CG2-CD2 3.55Å; I351-L372 HydrophobicContact CG2-CG 3.9Å; S354-L372 VanDerWaalsContact OG-CD2 3.26Å; S354-L372 WeakPolarHBondContact OG-CD2 3.49Å; F356-L372 HydrophobicContact CB-CD2 4.46Å; F356-L372 HydrophobicContact CD2-CD2 4.29Å; I357-L372 HydrophobicContact CD1-CD2 4.4Å; I357-L372 HydrophobicContact CG1-CD2 4.4Å; I368-L372 WeakPolarHBondContact O-CB 3.47Å; I368-L372 PolarHBondContact O-N 3.2Å; S369-L372 PolarHBondContact O-N 2.79Å; L372-N374 VanDerWaalsContact C-N 3.31Å; L372-N374 PolarHBondContact O-N 3.31Å; L372-K375 CarbonylContact O-C 3.53Å; L372-K375 PolarHBondContact O-N 2.76Å; L372-C376 PolarHBondContact O-N 3.47Å; L372-C376 PolarHBondContact O-SG 3.02Å; L372-V401 HydrophobicContact CD1-CG1 4.39Å; L372-V401 HydrophobicContact CD1-CG2 4.11Å
373A94.7Very high92.4Very high0 Ų045.4 Ų45.40%020%0.2CC..Hα-helixtrans-60-38.1175.100000112.8V326 Q327 I351 S369 R370 C376 S377V326-A373 HydrophobicContact CG1-CB 4.44Å; Q327-A373 HydrophobicContact CB-CB 3.75Å; Q327-A373 HydrophobicContact CG-CB 4.42Å; I351-A373 HydrophobicContact CD1-CB 3.99Å; S369-A373 VanDerWaalsContact O-CB 3.31Å; S369-A373 WeakPolarHBondContact O-CB 3.47Å; S369-A373 PolarHBondContact O-N 2.74Å; R370-A373 PolarHBondContact O-N 3.25Å; A373-C376 PolarHBondContact O-N 2.89Å; A373-S377 WeakPolarHBondContact O-CB 3.4Å; A373-S377 PolarHBondContact O-N 3.39Å
374N95Very high92.5Very high73 Ų7336.9 Ų36.939%0.3917%0.166SC..Hα-helixtrans-61.5-45.3171.6-68.8-15.2000111.4A323 R370 Y371 L372 S377 I378A323-N374 HydrophobicContact CB-CB 4.42Å; A323-N374 WeakPolarHBondContact CB-OD1 3.45Å; R370-N374 VanDerWaalsContact O-CG 3.3Å; R370-N374 PolarHBondContact O-N 2.93Å; R370-N374 PolarHBondContact O-OD1 3.11Å; Y371-N374 WeakPolarHBondContact O-CB 3.09Å; Y371-N374 PolarHBondContact O-N 3.12Å; L372-N374 VanDerWaalsContact C-N 3.31Å; L372-N374 PolarHBondContact O-N 3.31Å; N374-S377 PolarHBondContact O-N 3.31Å; N374-I378 WeakPolarHBondContact O-CG1 3.23Å; N374-I378 PolarHBondContact O-N 3.12Å; N374-I378 VanDerWaalsContact O-N 3.14Å
375K94Very high92.5Very high4 Ų442.2 Ų42.22%0.01719%0.188CC..Hα-helixtrans-67-40.1178-60-41.6-161.5149.90112.4L299 Y371 L372 S377 I378 A379 L397 V401 N417L299-K375 HydrophobicContact CD2-CB 3.82Å; Y371-K375 HydrophobicContact CD1-CG 4.44Å; Y371-K375 HydrophobicContact CE1-CG 4.18Å; Y371-K375 WeakPolarHBondContact O-CG 3.41Å; Y371-K375 PolarHBondContact O-N 3.41Å; Y371-K375 WeakPolarHBondContact OH-CE 3.45Å; L372-K375 CarbonylContact O-C 3.53Å; L372-K375 PolarHBondContact O-N 2.76Å; K375-S377 VanDerWaalsContact C-N 3.34Å; K375-S377 PolarHBondContact O-N 3.24Å; K375-I378 HydrophobicContact CD-CD1 4.46Å; K375-I378 PolarHBondContact O-N 3.13Å; K375-A379 WeakPolarHBondContact O-CB 3.28Å; K375-A379 PolarHBondContact O-N 3.46Å; K375-L397 HydrophobicContact CB-CD2 4.33Å; K375-L397 HydrophobicContact CD-CD2 3.8Å; K375-L397 HydrophobicContact CG-CD2 4.32Å; K375-V401 HydrophobicContact CB-CG2 4.43Å; K375-V401 HydrophobicContact CG-CG2 3.95Å; K375-N417 PolarHBondContact NZ-OD1 3.21Å
376C94Very high92.4Very high2 Ų242 Ų421%0.01419%0.192CC..Hα-helixtrans-61.8-39.8174.2-65.40000112.2L296 L299 V326 L372 A373 I378 A379 S380L296-C376 HydrophobicContact CD1-CB 4.14Å; L299-C376 HydrophobicContact CD2-CB 4.47Å; V326-C376 HydrophobicContact CG1-CB 4.28Å; L372-C376 PolarHBondContact O-N 3.47Å; L372-C376 PolarHBondContact O-SG 3.02Å; A373-C376 PolarHBondContact O-N 2.89Å; C376-I378 VanDerWaalsContact C-N 3.33Å; C376-A379 PolarHBondContact O-N 3.17Å; C376-S380 WeakPolarHBondContact O-CB 3.11Å; C376-S380 PolarHBondContact O-N 3.47Å; C376-S380 PolarHBondContact O-OG 2.91Å; C376-S380 VanDerWaalsContact O-OG 3.09Å
377S94.8Very high91.9Very high5 Ų549.5 Ų49.54%0.03522%0.222CC..Hα-helixtrans-66.8-32.3175.7-174.90000112.5A373 N374 K375 S380 R381A373-S377 WeakPolarHBondContact O-CB 3.4Å; A373-S377 PolarHBondContact O-N 3.39Å; N374-S377 PolarHBondContact O-N 3.31Å; K375-S377 VanDerWaalsContact C-N 3.34Å; K375-S377 PolarHBondContact O-N 3.24Å; S377-S380 PolarHBondContact O-OG 2.79Å; S377-R381 VanDerWaalsContact O-CD 3.28Å; S377-R381 WeakPolarHBondContact O-CD 3.44Å; S377-R381 WeakPolarHBondContact O-CG 3.45Å; S377-R381 PolarHBondContact O-N 3.1Å
378I93.7Very high91.6Very high65 Ų6543.7 Ų43.733%0.33320%0.204SC..Hα-helixtrans-71-49.9171.8-66.1164.5000110.3N374 K375 C376 S380 R381 I382 L397 M421N374-I378 WeakPolarHBondContact O-CG1 3.23Å; N374-I378 PolarHBondContact O-N 3.12Å; N374-I378 VanDerWaalsContact O-N 3.14Å; K375-I378 HydrophobicContact CD-CD1 4.46Å; K375-I378 PolarHBondContact O-N 3.13Å; C376-I378 VanDerWaalsContact C-N 3.33Å; I378-S380 PolarHBondContact O-N 2.65Å; I378-R381 PolarHBondContact O-N 3.33Å; I378-I382 HydrophobicContact CG2-CD1 3.86Å; I378-I382 WeakPolarHBondContact O-CG1 3.23Å; I378-I382 PolarHBondContact O-N 3.27Å; I378-L397 HydrophobicContact CG2-CD1 4.27Å; I378-M421 HydrophobicContact CG2-CE 4.22Å
379A93.7Very high91.1Very high0 Ų044.8 Ų44.80%021%0.211CC..Hα-helixtrans-58.1-46.4179.800000112.5L299 K375 C376 R381 I382 D383 L397L299-A379 HydrophobicContact CD2-CB 4.15Å; K375-A379 WeakPolarHBondContact O-CB 3.28Å; K375-A379 PolarHBondContact O-N 3.46Å; C376-A379 PolarHBondContact O-N 3.17Å; A379-R381 VanDerWaalsContact C-N 3.29Å; A379-R381 PolarHBondContact O-N 2.92Å; A379-I382 PolarHBondContact O-N 2.83Å; A379-D383 PolarHBondContact O-N 3.45Å; A379-L397 HydrophobicContact CB-CD1 3.86Å
380S93.7Very high90.8Very high1 Ų145.2 Ų45.21%0.00721%0.214CC..Hα-helixtrans-65.2-30.2179.263.20000113.2C376 S377 I378 C384C376-S380 WeakPolarHBondContact O-CB 3.11Å; C376-S380 PolarHBondContact O-N 3.47Å; C376-S380 PolarHBondContact O-OG 2.91Å; C376-S380 VanDerWaalsContact O-OG 3.09Å; S377-S380 PolarHBondContact O-OG 2.79Å; I378-S380 PolarHBondContact O-N 2.65Å; S380-C384 WeakPolarHBondContact O-CB 3.31Å; S380-C384 PolarHBondContact O-N 3.16Å
381R94.3Very high90.6Very high106 Ų10640 Ų4040%0.420%0.202SC..Hα-helixtrans-70.9-42.7172.4-72.6169-175.3177.74.5111.9A319 Y321 S377 I378 A379 C384 F385A319-R381 HydrophobicContact CB-CG 3.92Å; A319-R381 WeakPolarHBondContact O-CG 3.45Å; A319-R381 PolarHBondContact O-NE 2.98Å; Y321-R381 PolarHBondContact O-NH2 3.46Å; S377-R381 VanDerWaalsContact O-CD 3.28Å; S377-R381 WeakPolarHBondContact O-CD 3.44Å; S377-R381 WeakPolarHBondContact O-CG 3.45Å; S377-R381 PolarHBondContact O-N 3.1Å; I378-R381 PolarHBondContact O-N 3.33Å; A379-R381 VanDerWaalsContact C-N 3.29Å; A379-R381 PolarHBondContact O-N 2.92Å; R381-C384 PolarHBondContact O-N 3.12Å; R381-F385 HydrophobicContact CB-CD2 4.47Å; R381-F385 WeakPolarHBondContact O-CB 3.21Å; R381-F385 WeakPolarHBondContact O-CD2 3.47Å; R381-F385 PolarHBondContact O-N 3.38Å
382I92.1Very high90.5Very high39 Ų3938.8 Ų38.820%0.220%0.199CC..Hα-helixtrans-60.9-49.8175.8-66.8168.9000110.1I378 A379 C384 F385 S386 F393I378-I382 HydrophobicContact CG2-CD1 3.86Å; I378-I382 WeakPolarHBondContact O-CG1 3.23Å; I378-I382 PolarHBondContact O-N 3.27Å; A379-I382 PolarHBondContact O-N 2.83Å; I382-C384 VanDerWaalsContact C-N 3.35Å; I382-C384 PolarHBondContact O-N 3.47Å; I382-F385 PolarHBondContact O-N 3.27Å; I382-S386 WeakPolarHBondContact O-CB 3.48Å; I382-S386 PolarHBondContact O-N 3.11Å; I382-F393 HydrophobicContact CD1-CB 4.13Å; I382-F393 HydrophobicContact CD1-CD1 4.28Å; I382-F393 HydrophobicContact CD1-CG 4.13Å; I382-F393 HydrophobicContact CG2-CB 4.39Å; I382-F393 HydrophobicContact CG2-CD2 3.73Å; I382-F393 HydrophobicContact CG2-CE2 4.26Å; I382-F393 HydrophobicContact CG2-CG 4.18Å
383D92.1Very high90.4Very high1 Ų140.3 Ų40.31%0.00521%0.205CC..Hα-helixtrans-62.3-39.3179-73.2-29.3000112.5A293 P294 S295 L296 A379A293-D383 VanDerWaalsContact C-OD2 3.3Å; A293-D383 VanDerWaalsContact CA-CG 3.47Å; A293-D383 WeakPolarHBondContact CA-OD2 3.25Å; A293-D383 HydrophobicContact CB-CB 4Å; A293-D383 WeakPolarHBondContact CB-OD2 3.39Å; P294-D383 WeakPolarHBondContact CD-OD1 3.27Å; S295-D383 WeakPolarHBondContact CB-OD1 2.98Å; S295-D383 WeakPolarHBondContact CB-OD2 3.4Å; S295-D383 PolarHBondContact N-OD1 3.1Å; S295-D383 PolarHBondContact N-OD2 2.98Å; S295-D383 VanDerWaalsContact N-OD2 3.17Å; S295-D383 PolarHBondContact OG-OD1 3.39Å; L296-D383 WeakPolarHBondContact CB-OD2 3.16Å; L296-D383 PolarHBondContact N-OD2 3Å; A379-D383 PolarHBondContact O-N 3.45Å
384C90.5Very high90.2Very high19 Ų1940.3 Ų40.313%0.12821%0.205CC..Hα-helixtrans-71.1-40.8-180-170.20000113.4R163 L315 A319 S380 R381 I382R163-C384 PolarHBondContact NH1-O 2.81Å; L315-C384 HydrophobicContact CD2-CB 4.35Å; L315-C384 HydrophobicContact CG-CB 4.1Å; A319-C384 HydrophobicContact CB-CB 3.94Å; S380-C384 WeakPolarHBondContact O-CB 3.31Å; S380-C384 PolarHBondContact O-N 3.16Å; R381-C384 PolarHBondContact O-N 3.12Å; I382-C384 VanDerWaalsContact C-N 3.35Å; I382-C384 PolarHBondContact O-N 3.47Å
385F89.8Confident90Very high142 Ų14241.3 Ų41.362%0.62321%0.207SC*.Hα-helixtrans-108.1-15.6-167.7-65.5-66.1000115.6A319 R381 I382A319-F385 HydrophobicContact CB-CE2 4.14Å; R381-F385 HydrophobicContact CB-CD2 4.47Å; R381-F385 WeakPolarHBondContact O-CB 3.21Å; R381-F385 WeakPolarHBondContact O-CD2 3.47Å; R381-F385 PolarHBondContact O-N 3.38Å; I382-F385 PolarHBondContact O-N 3.27Å
386S86.1Confident89.9Confident42 Ų4242.5 Ų42.529%0.29421%0.213SC..  trans-61.8151.3165.51800000110R163 I382 V388R163-S386 PolarHBondContact NH1-O 3.46Å; R163-S386 PolarHBondContact NH2-O 3.39Å; I382-S386 WeakPolarHBondContact O-CB 3.48Å; I382-S386 PolarHBondContact O-N 3.11Å; S386-V388 PolarHBondContact OG-N 3.39Å; S386-V388 PolarHBondContact OG-O 3Å
387E79.1Confident89.9Confident178 Ų17842.4 Ų42.483%0.83221%0.212SC*.SBendtrans-80.8-31.3171.4-66.1-165.8160.100113R163R163-E387 PolarHBondContact NH2-O 2.87Å
388V81.7Confident89.7Confident36 Ų3646.3 Ų46.322%0.21823%0.226CC..SBendtrans-128.9101.8175.7-179.20000107.2S386 I435 T436S386-V388 PolarHBondContact OG-N 3.39Å; S386-V388 PolarHBondContact OG-O 3Å; V388-I435 HydrophobicContact CG1-CB 4.08Å; V388-I435 HydrophobicContact CG1-CD1 4.16Å; V388-I435 HydrophobicContact CG1-CG2 3.59Å; V388-T436 HydrophobicContact CG2-CG2 4.29Å
389P81.8Confident89.7Confident27 Ų2746.7 Ų46.718%0.17523%0.226CC..  trans-76.2138.3-177.833.9-35.3000109.9P294P294-P389 HydrophobicContact CG-CB 3.67Å; P294-P389 HydrophobicContact CG-CG 4.12Å
390T86.8Confident89.5Confident8 Ų846.7 Ų46.75%0.04923%0.227CC..  trans-124.1148.4-176.156.30000110.4S295 V392 A431 A432 I435S295-T390 PolarHBondContact OG-O 2.93Å; T390-V392 VanDerWaalsContact C-N 3.32Å; T390-A431 HydrophobicContact CG2-CB 4.28Å; T390-A432 HydrophobicContact CG2-CB 4.42Å; T390-I435 HydrophobicContact CG2-CD1 3.97Å
391S88.6Confident89.4Confident48 Ų4846.8 Ų46.834%0.33623%0.227SC..SBendtrans-74.4-23.3-180620000113.6F393 G394 E395S391-F393 VanDerWaalsContact C-N 3.3Å; S391-F393 PolarHBondContact O-N 3.48Å; S391-G394 WeakPolarHBondContact O-CA 3.25Å; S391-G394 PolarHBondContact O-N 3.12Å; S391-E395 WeakPolarHBondContact CB-OE1 3.46Å; S391-E395 PolarHBondContact O-N 2.86Å; S391-E395 PolarHBondContact OG-OE1 2.74Å
392V90.7Very high89.3Confident19 Ų1945.2 Ų45.212%0.11522%0.224CC..Hα-helixtrans-46.4-48.2-177.5179.70000112.6T390 G394 E395 K396 A424 Q427 A431T390-V392 VanDerWaalsContact C-N 3.32Å; V392-G394 VanDerWaalsContact C-N 3.34Å; V392-G394 PolarHBondContact O-N 3.15Å; V392-E395 PolarHBondContact O-N 2.81Å; V392-K396 WeakPolarHBondContact O-CG 3.45Å; V392-K396 PolarHBondContact O-N 3.11Å; V392-A424 HydrophobicContact CG1-CB 4.5Å; V392-Q427 HydrophobicContact CG1-CB 3.58Å; V392-A431 HydrophobicContact CG2-CB 4.13Å
393F90.4Very high89.2Confident31 Ų3145.3 Ų45.314%0.13622%0.224CC..Hα-helixtrans-63.8-38.9178.2-68.2-68.1000112.2I382 S391 L397 M421 A424 M425 A428I382-F393 HydrophobicContact CD1-CB 4.13Å; I382-F393 HydrophobicContact CD1-CD1 4.28Å; I382-F393 HydrophobicContact CD1-CG 4.13Å; I382-F393 HydrophobicContact CG2-CB 4.39Å; I382-F393 HydrophobicContact CG2-CD2 3.73Å; I382-F393 HydrophobicContact CG2-CE2 4.26Å; I382-F393 HydrophobicContact CG2-CG 4.18Å; S391-F393 VanDerWaalsContact C-N 3.3Å; S391-F393 PolarHBondContact O-N 3.48Å; F393-L397 WeakPolarHBondContact O-CB 3.25Å; F393-L397 WeakPolarHBondContact O-CG 3.2Å; F393-L397 PolarHBondContact O-N 3.29Å; F393-M421 HydrophobicContact CD1-SD 4.42Å; F393-A424 HydrophobicContact CD1-CB 3.67Å; F393-A424 HydrophobicContact CE1-CB 3.79Å; F393-M425 HydrophobicContact CE1-CG 4.21Å; F393-M425 HydrophobicContact CZ-CG 4.34Å; F393-A428 HydrophobicContact CD2-CB 4.11Å; F393-A428 HydrophobicContact CE1-CB 4.31Å; F393-A428 HydrophobicContact CE2-CB 3.33Å; F393-A428 HydrophobicContact CZ-CB 3.45Å; F393-A428 VanDerWaalsContact CZ-CB 3.45Å
394G90.8Very high89.1Confident0 Ų048.3 Ų48.30%024%0.235CC..Hα-helixtrans-66.1-40.9175.800000113S295 S391 V392 L397 R398S295-G394 VanDerWaalsContact O-CA 3.27Å; S295-G394 WeakPolarHBondContact O-CA 3.35Å; S391-G394 WeakPolarHBondContact O-CA 3.25Å; S391-G394 PolarHBondContact O-N 3.12Å; V392-G394 VanDerWaalsContact C-N 3.34Å; V392-G394 PolarHBondContact O-N 3.15Å; G394-L397 PolarHBondContact O-N 3.12Å; G394-R398 VanDerWaalsContact O-CB 3.29Å; G394-R398 WeakPolarHBondContact O-CB 3.47Å; G394-R398 PolarHBondContact O-N 3.3Å
395E92.4Very high89Confident94 Ų9448.1 Ų48.144%0.43923%0.232SC..Hα-helixtrans-64-47.9175.9-69162.6-14100111.2A298 S391 V392 L397 R398 E399A298-E395 HydrophobicContact CB-CG 4.23Å; S391-E395 WeakPolarHBondContact CB-OE1 3.46Å; S391-E395 PolarHBondContact O-N 2.86Å; S391-E395 PolarHBondContact OG-OE1 2.74Å; V392-E395 PolarHBondContact O-N 2.81Å; E395-L397 PolarHBondContact O-N 3.48Å; E395-R398 WeakPolarHBondContact O-CA 3.17Å; E395-R398 VanDerWaalsContact O-CB 3.29Å; E395-R398 WeakPolarHBondContact O-CB 3.33Å; E395-R398 PolarHBondContact O-N 2.89Å; E395-R398 VanDerWaalsContact O-N 3.08Å; E395-E399 PolarHBondContact O-N 3.08Å
396K91.6Very high88.9Confident29 Ų2943 Ų4313%0.12621%0.214CC..Hα-helixtrans-65.9-34.5174.9-69.1-47-168-173.70113.8V392 R398 E399 Q400 V420 A424V392-K396 WeakPolarHBondContact O-CG 3.45Å; V392-K396 PolarHBondContact O-N 3.11Å; K396-R398 VanDerWaalsContact C-N 3.3Å; K396-E399 WeakPolarHBondContact CD-OE2 3.41Å; K396-E399 IonicContact NZ-OE1 2.84Å; K396-E399 PolarHBondContact NZ-OE1 3.45Å; K396-E399 IonicContact NZ-OE2 3.82Å; K396-E399 PolarHBondContact NZ-OE2 2.9Å; K396-Q400 WeakPolarHBondContact O-CG 3.21Å; K396-Q400 PolarHBondContact O-N 3.43Å; K396-V420 HydrophobicContact CB-CG1 3.82Å; K396-V420 HydrophobicContact CD-CG1 4.33Å; K396-V420 HydrophobicContact CG-CG1 4.33Å; K396-A424 HydrophobicContact CB-CB 4.15Å; K396-A424 HydrophobicContact CG-CB 3.94Å
397L92.5Very high89.1Confident0 Ų043.9 Ų43.90%021%0.213CC..Hα-helixtrans-67.7-31.2171.1-77.7177.8000112.4L299 K375 I378 A379 F393 G394 E395 V401 M421L299-L397 HydrophobicContact CD1-CB 4.02Å; L299-L397 HydrophobicContact CD2-CB 4.48Å; K375-L397 HydrophobicContact CB-CD2 4.33Å; K375-L397 HydrophobicContact CD-CD2 3.8Å; K375-L397 HydrophobicContact CG-CD2 4.32Å; I378-L397 HydrophobicContact CG2-CD1 4.27Å; A379-L397 HydrophobicContact CB-CD1 3.86Å; F393-L397 WeakPolarHBondContact O-CB 3.25Å; F393-L397 WeakPolarHBondContact O-CG 3.2Å; F393-L397 PolarHBondContact O-N 3.29Å; G394-L397 PolarHBondContact O-N 3.12Å; E395-L397 PolarHBondContact O-N 3.48Å; L397-V401 WeakPolarHBondContact O-CG2 3.37Å; L397-V401 PolarHBondContact O-N 3.17Å; L397-M421 HydrophobicContact CD2-CE 3.44Å; L397-M421 VanDerWaalsContact CD2-CE 3.44Å; L397-M421 HydrophobicContact CG-CE 4.03Å
398R91.7Very high89.5Confident88 Ų8838.1 Ų38.133%0.33218%0.184SC..Hα-helixtrans-71.7-47.4176.4-172.5-161.8171.9111.30.4111.3A298 L299 F356 G394 E395 K396 Q400 V401 E402A298-R398 PolarHBondContact O-NH1 3.16Å; L299-R398 HydrophobicContact CD1-CB 4.2Å; F356-R398 HydrophobicContact CE1-CG 4.49Å; F356-R398 HydrophobicContact CZ-CG 3.78Å; G394-R398 VanDerWaalsContact O-CB 3.29Å; G394-R398 WeakPolarHBondContact O-CB 3.47Å; G394-R398 PolarHBondContact O-N 3.3Å; E395-R398 WeakPolarHBondContact O-CA 3.17Å; E395-R398 VanDerWaalsContact O-CB 3.29Å; E395-R398 WeakPolarHBondContact O-CB 3.33Å; E395-R398 PolarHBondContact O-N 2.89Å; E395-R398 VanDerWaalsContact O-N 3.08Å; K396-R398 VanDerWaalsContact C-N 3.3Å; R398-Q400 PolarHBondContact O-N 3.45Å; R398-V401 WeakPolarHBondContact O-CA 3.48Å; R398-V401 PolarHBondContact O-N 3.44Å; R398-E402 IonicContact CZ-OE1 3.64Å; R398-E402 IonicContact NE-OE1 3.69Å; R398-E402 PolarHBondContact NE-OE1 2.95Å; R398-E402 IonicContact NH2-OE1 2.7Å; R398-E402 PolarHBondContact NH2-OE1 3.33Å; R398-E402 PolarHBondContact O-N 3.46Å
399E92.3Very high89.7Confident72 Ų7242.9 Ų42.934%0.33620%0.204SC..Hα-helixtrans-49.1-47.9171.1-71.8174.1-165.600110.4E395 K396 V401 E402 E403E395-E399 PolarHBondContact O-N 3.08Å; K396-E399 WeakPolarHBondContact CD-OE2 3.41Å; K396-E399 IonicContact NZ-OE1 2.84Å; K396-E399 PolarHBondContact NZ-OE1 3.45Å; K396-E399 IonicContact NZ-OE2 3.82Å; K396-E399 PolarHBondContact NZ-OE2 2.9Å; E399-V401 VanDerWaalsContact C-N 3.26Å; E399-V401 PolarHBondContact O-N 3.09Å; E399-E402 PolarHBondContact O-N 3.41Å; E399-E402 VanDerWaalsContact O-N 3.12Å; E399-E403 WeakPolarHBondContact O-CG 3.27Å; E399-E403 PolarHBondContact O-N 3.3Å
400Q91.5Very high90Very high1 Ų145.8 Ų45.81%0.00522%0.221CC..Hα-helixtrans-64.9-20.6177.3-73.3175.9-13.400115.6Y371 K396 R398 R404 V420Y371-Q400 VanDerWaalsContact CE1-O 3.29Å; Y371-Q400 WeakPolarHBondContact CE1-O 3.49Å; Y371-Q400 PolarHBondContact OH-O 2.93Å; Y371-Q400 VanDerWaalsContact OH-O 3.11Å; K396-Q400 WeakPolarHBondContact O-CG 3.21Å; K396-Q400 PolarHBondContact O-N 3.43Å; R398-Q400 PolarHBondContact O-N 3.45Å; Q400-R404 VanDerWaalsContact O-CB 3.31Å; Q400-R404 WeakPolarHBondContact O-CB 3.48Å; Q400-R404 PolarHBondContact O-N 3.21Å; Q400-V420 HydrophobicContact CG-CG1 4.12Å; Q400-V420 HydrophobicContact CG-CG2 4.45Å; Q400-V420 VanDerWaalsContact NE2-CG1 3.3Å
401V91.5Very high89.9Confident2 Ų247.6 Ų47.61%0.01224%0.241CC..Hα-helixtrans-86.3-34.8173173.30000110.4L299 F356 Y371 L372 K375 L397 R398 E399 R404 L405L299-V401 HydrophobicContact CD1-CG2 4.16Å; F356-V401 HydrophobicContact CB-CG1 4.14Å; F356-V401 HydrophobicContact CD1-CG1 3.8Å; F356-V401 HydrophobicContact CD2-CG1 4.21Å; F356-V401 HydrophobicContact CE1-CG1 4.33Å; F356-V401 HydrophobicContact CG-CG1 3.75Å; Y371-V401 HydrophobicContact CD1-CG2 4.08Å; Y371-V401 HydrophobicContact CE1-CG2 3.89Å; L372-V401 HydrophobicContact CD1-CG1 4.39Å; L372-V401 HydrophobicContact CD1-CG2 4.11Å; K375-V401 HydrophobicContact CB-CG2 4.43Å; K375-V401 HydrophobicContact CG-CG2 3.95Å; L397-V401 WeakPolarHBondContact O-CG2 3.37Å; L397-V401 PolarHBondContact O-N 3.17Å; R398-V401 WeakPolarHBondContact O-CA 3.48Å; R398-V401 PolarHBondContact O-N 3.44Å; E399-V401 VanDerWaalsContact C-N 3.26Å; E399-V401 PolarHBondContact O-N 3.09Å; V401-R404 PolarHBondContact O-N 2.95Å; V401-L405 PolarHBondContact O-N 2.85Å
402E90.9Very high89.7Confident74 Ų7451.4 Ų51.435%0.34625%0.254SS..Hα-helixtrans-67.9-47.7173.7-69179.4-174.800111.1F356 R398 E399 R404 L405 S406F356-E402 HydrophobicContact CD1-CG 4.29Å; F356-E402 HydrophobicContact CE1-CG 3.54Å; F356-E402 HydrophobicContact CZ-CG 4.43Å; R398-E402 IonicContact CZ-OE1 3.64Å; R398-E402 IonicContact NE-OE1 3.69Å; R398-E402 PolarHBondContact NE-OE1 2.95Å; R398-E402 IonicContact NH2-OE1 2.7Å; R398-E402 PolarHBondContact NH2-OE1 3.33Å; R398-E402 PolarHBondContact O-N 3.46Å; E399-E402 PolarHBondContact O-N 3.41Å; E399-E402 VanDerWaalsContact O-N 3.12Å; E402-R404 PolarHBondContact O-N 3.44Å; E402-L405 WeakPolarHBondContact O-CB 3.2Å; E402-L405 PolarHBondContact O-N 3.19Å; E402-S406 PolarHBondContact O-N 2.82Å
403E91.1Very high89.5Confident41 Ų4157.9 Ų57.919%0.19229%0.286CS..Hα-helixtrans-57.4-33.5169.8-70.5-173.4170.800112.3E399 S406 F407 P414 R415E399-E403 WeakPolarHBondContact O-CG 3.27Å; E399-E403 PolarHBondContact O-N 3.3Å; E403-S406 WeakPolarHBondContact CA-OG 3.1Å; E403-S406 PolarHBondContact O-OG 3.33Å; E403-F407 WeakPolarHBondContact O-CB 3.29Å; E403-F407 PolarHBondContact O-N 2.87Å; E403-P414 HydrophobicContact CB-CB 3.88Å; E403-R415 VanDerWaalsContact OE1-CD 3.31Å; E403-R415 WeakPolarHBondContact OE1-CD 3.35Å; E403-R415 WeakPolarHBondContact OE1-CG 3.29Å; E403-R415 IonicContact OE1-CZ 3.26Å; E403-R415 IonicContact OE1-NE 3.71Å; E403-R415 PolarHBondContact OE1-NE 2.99Å; E403-R415 PolarHBondContact OE2-N 2.74Å
404R88.8Confident89.2Confident63 Ų6357.7 Ų57.724%0.23829%0.288CS..Hα-helixtrans-78.6-24.5178.2-167.954.4171.6-174.2-1.2112.7Y371 Q400 V401 E402 F407 Y408Y371-R404 HydrophobicContact CD1-CB 4.01Å; Y371-R404 HydrophobicContact CD1-CG 3.84Å; Y371-R404 HydrophobicContact CD2-CG 4.41Å; Y371-R404 HydrophobicContact CE1-CB 3.6Å; Y371-R404 HydrophobicContact CE1-CG 3.8Å; Y371-R404 HydrophobicContact CE2-CG 4.38Å; Y371-R404 HydrophobicContact CG-CG 4.13Å; Q400-R404 VanDerWaalsContact O-CB 3.31Å; Q400-R404 WeakPolarHBondContact O-CB 3.48Å; Q400-R404 PolarHBondContact O-N 3.21Å; V401-R404 PolarHBondContact O-N 2.95Å; E402-R404 PolarHBondContact O-N 3.44Å; R404-F407 VanDerWaalsContact NH1-CE1 3.3Å; R404-Y408 HydrophobicContact CG-CE2 4.16Å; R404-Y408 WeakPolarHBondContact O-CD2 3.21Å
405L88.5Confident88.9Confident15 Ų1564.4 Ų64.48%0.07931%0.313CS..Hα-helixtrans-73.7-48.5171.2-176.865.5000109.7R359 A360 I368 V401 E402 F407 Y408R359-L405 HydrophobicContact CB-CD2 4.07Å; A360-L405 HydrophobicContact CB-CD1 4.05Å; I368-L405 HydrophobicContact CD1-CD1 3.78Å; V401-L405 PolarHBondContact O-N 2.85Å; E402-L405 WeakPolarHBondContact O-CB 3.2Å; E402-L405 PolarHBondContact O-N 3.19Å; L405-F407 VanDerWaalsContact C-N 3.34Å; L405-F407 PolarHBondContact O-N 3.4Å; L405-Y408 PolarHBondContact O-N 3.22Å
406S88.3Confident88.5Confident34 Ų3467.4 Ų67.424%0.23833%0.325CS..Hα-helixtrans-60.5-39.9176.566.10000112E402 E403 Y408 E409 T410E402-S406 PolarHBondContact O-N 2.82Å; E403-S406 WeakPolarHBondContact CA-OG 3.1Å; E403-S406 PolarHBondContact O-OG 3.33Å; S406-Y408 PolarHBondContact O-N 3.47Å; S406-E409 CarbonylContact O-C 3.55Å; S406-E409 WeakPolarHBondContact O-CA 3.12Å; S406-E409 PolarHBondContact O-N 3.12Å; S406-T410 PolarHBondContact O-N 3.13Å; S406-T410 PolarHBondContact O-OG1 3.41Å; S406-T410 VanDerWaalsContact O-OG1 3.04Å
407F90.7Very high88Confident62 Ų6269.6 Ų69.627%0.27234%0.338SS..THydrogen-bonded Turntrans-50.9-32.8171.6171.9-104.9000114E403 R404 L405 E409 G411 E412E403-F407 WeakPolarHBondContact O-CB 3.29Å; E403-F407 PolarHBondContact O-N 2.87Å; R404-F407 VanDerWaalsContact NH1-CE1 3.3Å; L405-F407 VanDerWaalsContact C-N 3.34Å; L405-F407 PolarHBondContact O-N 3.4Å; F407-E409 VanDerWaalsContact C-N 3.33Å; F407-G411 VanDerWaalsContact O-CA 3.26Å; F407-G411 WeakPolarHBondContact O-CA 3.36Å; F407-G411 PolarHBondContact O-N 2.61Å; F407-E412 WeakPolarHBondContact CB-O 3.26Å; F407-E412 WeakPolarHBondContact CD2-O 3.41Å
408Y87.3Confident87.7Confident57 Ų5775.7 Ų75.722%0.22437%0.37CS..THydrogen-bonded Turntrans-83.6-6.9177.9-72.2-56.1000114.3I368 R404 L405 S406I368-Y408 HydrophobicContact CD1-CD2 3.72Å; I368-Y408 HydrophobicContact CD1-CE2 4.17Å; I368-Y408 HydrophobicContact CG1-CD2 3.73Å; I368-Y408 HydrophobicContact CG1-CE2 3.66Å; R404-Y408 HydrophobicContact CG-CE2 4.16Å; R404-Y408 WeakPolarHBondContact O-CD2 3.21Å; L405-Y408 PolarHBondContact O-N 3.22Å; S406-Y408 PolarHBondContact O-N 3.47Å
409E85.8Confident87.5Confident135 Ų13574.9 Ų74.963%0.63137%0.372SS*.THydrogen-bonded Turntrans-111.4-47.4-179.7-65.3174.7178.500111.5S406 F407S406-E409 CarbonylContact O-C 3.55Å; S406-E409 WeakPolarHBondContact O-CA 3.12Å; S406-E409 PolarHBondContact O-N 3.12Å; F407-E409 VanDerWaalsContact C-N 3.33Å
410T86.9Confident87.1Confident89 Ų8971.6 Ų71.655%0.54636%0.357SS..THydrogen-bonded Turntrans-101.2-26.4-177.865.30000114S406 E412S406-T410 PolarHBondContact O-N 3.13Å; S406-T410 PolarHBondContact O-OG1 3.41Å; S406-T410 VanDerWaalsContact O-OG1 3.04Å; T410-E412 WeakPolarHBondContact OG1-CG 3.3Å; T410-E412 PolarHBondContact OG1-N 2.96Å
411G85Confident86.6Confident45 Ų4573.6 Ų73.646%0.46437%0.367SS..  trans88.5-0.3-173.900000115.6F407 I413F407-G411 VanDerWaalsContact O-CA 3.26Å; F407-G411 WeakPolarHBondContact O-CA 3.36Å; F407-G411 PolarHBondContact O-N 2.61Å; G411-I413 PolarHBondContact O-N 2.66Å
412E84.9Confident86.3Confident128 Ų12879.9 Ų79.960%0.59839%0.394SS*.PPolyproline II helixtrans-65127.5-178.4-70.7175157.400113F407 T410 P414F407-E412 WeakPolarHBondContact CB-O 3.26Å; F407-E412 WeakPolarHBondContact CD2-O 3.41Å; T410-E412 WeakPolarHBondContact OG1-CG 3.3Å; T410-E412 PolarHBondContact OG1-N 2.96Å; E412-P414 WeakPolarHBondContact O-CD 3.27Å
413I85.7Confident86.1Confident156 Ų15680 Ų8080%0.840%0.395SS*.PPolyproline II helixtrans-70.7119.2-174.3-55.5174.9000109.7G411G411-I413 PolarHBondContact O-N 2.66Å
414P84.6Confident85.7Confident27 Ų2778 Ų7818%0.17539%0.386CS..PPolyproline II helixtrans-69.7157.1-178.730.6-36.7000111.6E403 E412E403-P414 HydrophobicContact CB-CB 3.88Å; E412-P414 WeakPolarHBondContact O-CD 3.27Å
415R84.7Confident85.5Confident140 Ų14080 Ų8053%0.52840%0.399SS..PPolyproline II helixtrans-61.5151.7-178.5-62.7178.6-157.4-146.5-3.2111.7E403 N417 V420E403-R415 VanDerWaalsContact OE1-CD 3.31Å; E403-R415 WeakPolarHBondContact OE1-CD 3.35Å; E403-R415 WeakPolarHBondContact OE1-CG 3.29Å; E403-R415 IonicContact OE1-CZ 3.26Å; E403-R415 IonicContact OE1-NE 3.71Å; E403-R415 PolarHBondContact OE1-NE 2.99Å; E403-R415 PolarHBondContact OE2-N 2.74Å; R415-N417 PolarHBondContact O-N 3.37Å; R415-V420 HydrophobicContact CB-CG2 3.77Å; R415-V420 HydrophobicContact CG-CG2 4.47Å
416K84.1Confident85.3Confident157 Ų15783.4 Ų83.468%0.68342%0.42SS*.PPolyproline II helixtrans-67.6134.9172.8-69.2176.4-177.3171.50109.5L418 D419K416-L418 PolarHBondContact O-N 3.35Å; K416-L418 VanDerWaalsContact O-N 3.08Å; K416-D419 WeakPolarHBondContact CB-OD2 3.49Å; K416-D419 PolarHBondContact O-N 2.87Å
417N81.3Confident85.1Confident76 Ų7685.8 Ų85.841%0.40643%0.427SS..Hα-helixtrans-55.4-31.5-179-69.3-36.3000113.6K375 R415 M421K375-N417 PolarHBondContact NZ-OD1 3.21Å; R415-N417 PolarHBondContact O-N 3.37Å; N417-M421 VanDerWaalsContact O-CB 3.29Å; N417-M421 WeakPolarHBondContact O-CB 3.11Å; N417-M421 WeakPolarHBondContact O-CG 3.45Å; N417-M421 PolarHBondContact O-N 3.33Å; N417-M421 VanDerWaalsContact O-N 3.11Å
418L85.9Confident84.6Confident128 Ų12883.2 Ų83.267%0.6742%0.417SS*.Hα-helixtrans-66.4-39-176.6-62.7177.5000112.6K416 M421 K422K416-L418 PolarHBondContact O-N 3.35Å; K416-L418 VanDerWaalsContact O-N 3.08Å; L418-M421 PolarHBondContact O-N 3.07Å; L418-K422 WeakPolarHBondContact O-CG 3.03Å; L418-K422 PolarHBondContact O-N 3.25Å; L418-K422 VanDerWaalsContact O-N 3.1Å
419D86.9Confident84.2Confident71 Ų7186.7 Ų86.738%0.3844%0.436SS..Hα-helixtrans-77.4-46.2-171.4-54.5-42.5000109.9K416 M421 K422 E423K416-D419 WeakPolarHBondContact CB-OD2 3.49Å; K416-D419 PolarHBondContact O-N 2.87Å; D419-M421 VanDerWaalsContact C-N 3.26Å; D419-M421 PolarHBondContact O-N 3.43Å; D419-K422 WeakPolarHBondContact O-CB 3.49Å; D419-K422 PolarHBondContact O-N 3.39Å; D419-K422 VanDerWaalsContact O-N 3.09Å; D419-K422 IonicContact OD1-NZ 2.67Å; D419-E423 PolarHBondContact O-N 3.44Å
420V84Confident84.1Confident3 Ų386.6 Ų86.62%0.01844%0.435CS..Hα-helixtrans-60.1-33.9171.5178.30000112.3K396 Q400 R415 A424K396-V420 HydrophobicContact CB-CG1 3.82Å; K396-V420 HydrophobicContact CD-CG1 4.33Å; K396-V420 HydrophobicContact CG-CG1 4.33Å; Q400-V420 HydrophobicContact CG-CG1 4.12Å; Q400-V420 HydrophobicContact CG-CG2 4.45Å; Q400-V420 VanDerWaalsContact NE2-CG1 3.3Å; R415-V420 HydrophobicContact CB-CG2 3.77Å; R415-V420 HydrophobicContact CG-CG2 4.47Å; V420-A424 VanDerWaalsContact O-CB 3.3Å; V420-A424 WeakPolarHBondContact O-CB 3.29Å; V420-A424 PolarHBondContact O-N 3.13Å
421M82.4Confident83.7Confident43 Ų4383.7 Ų83.721%0.21242%0.42CS..Hα-helixtrans-72.4-31.9175.8-75.6-70-18000112.7I378 F393 L397 N417 L418 D419 A424 M425I378-M421 HydrophobicContact CG2-CE 4.22Å; F393-M421 HydrophobicContact CD1-SD 4.42Å; L397-M421 HydrophobicContact CD2-CE 3.44Å; L397-M421 VanDerWaalsContact CD2-CE 3.44Å; L397-M421 HydrophobicContact CG-CE 4.03Å; N417-M421 VanDerWaalsContact O-CB 3.29Å; N417-M421 WeakPolarHBondContact O-CB 3.11Å; N417-M421 WeakPolarHBondContact O-CG 3.45Å; N417-M421 PolarHBondContact O-N 3.33Å; N417-M421 VanDerWaalsContact O-N 3.11Å; L418-M421 PolarHBondContact O-N 3.07Å; D419-M421 VanDerWaalsContact C-N 3.26Å; D419-M421 PolarHBondContact O-N 3.43Å; M421-A424 PolarHBondContact O-N 3.32Å; M421-M425 WeakPolarHBondContact O-CG 3.26Å; M421-M425 PolarHBondContact O-N 2.85Å
422K85Confident83.4Confident133 Ų13382.8 Ų82.858%0.57841%0.409SS*.Hα-helixtrans-66.4-45.7171.2-70.3166.8-177.7171.20111.1L418 D419 A424 M425 V426L418-K422 WeakPolarHBondContact O-CG 3.03Å; L418-K422 PolarHBondContact O-N 3.25Å; L418-K422 VanDerWaalsContact O-N 3.1Å; D419-K422 WeakPolarHBondContact O-CB 3.49Å; D419-K422 PolarHBondContact O-N 3.39Å; D419-K422 VanDerWaalsContact O-N 3.09Å; D419-K422 IonicContact OD1-NZ 2.67Å; K422-A424 VanDerWaalsContact C-N 3.3Å; K422-A424 PolarHBondContact O-N 2.96Å; K422-M425 PolarHBondContact O-N 3.34Å; K422-V426 PolarHBondContact O-N 3.13Å
423E85.4Confident83.1Confident77 Ų7778.6 Ų78.636%0.3640%0.395SS..Hα-helixtrans-56.1-46.5172.9-68.3172.7-165.600111D419 M425 V426 Q427D419-E423 PolarHBondContact O-N 3.44Å; E423-M425 PolarHBondContact O-N 3Å; E423-V426 PolarHBondContact O-N 3.13Å; E423-Q427 WeakPolarHBondContact O-CG 3.4Å; E423-Q427 PolarHBondContact O-N 3.13Å; E423-Q427 VanDerWaalsContact O-N 3.12Å
424A83.4Confident82.8Confident0 Ų076 Ų760%038%0.38CS..Hα-helixtrans-63.2-36.7177.900000112.9V392 F393 K396 V420 M421 K422 A428V392-A424 HydrophobicContact CG1-CB 4.5Å; F393-A424 HydrophobicContact CD1-CB 3.67Å; F393-A424 HydrophobicContact CE1-CB 3.79Å; K396-A424 HydrophobicContact CB-CB 4.15Å; K396-A424 HydrophobicContact CG-CB 3.94Å; V420-A424 VanDerWaalsContact O-CB 3.3Å; V420-A424 WeakPolarHBondContact O-CB 3.29Å; V420-A424 PolarHBondContact O-N 3.13Å; M421-A424 PolarHBondContact O-N 3.32Å; K422-A424 VanDerWaalsContact C-N 3.3Å; K422-A424 PolarHBondContact O-N 2.96Å; A424-A428 WeakPolarHBondContact O-CB 3.04Å; A424-A428 PolarHBondContact O-N 2.87Å
425M83.8Confident82.5Confident104 Ų10477.4 Ų77.451%0.51239%0.386SS..Hα-helixtrans-64.9-46.9176.6-78.1-174.971.100112F393 M421 K422 E423 Q427 A428 E429F393-M425 HydrophobicContact CE1-CG 4.21Å; F393-M425 HydrophobicContact CZ-CG 4.34Å; M421-M425 WeakPolarHBondContact O-CG 3.26Å; M421-M425 PolarHBondContact O-N 2.85Å; K422-M425 PolarHBondContact O-N 3.34Å; E423-M425 PolarHBondContact O-N 3Å; M425-Q427 PolarHBondContact O-N 3.48Å; M425-A428 PolarHBondContact O-N 3.25Å; M425-E429 WeakPolarHBondContact O-CG 3.43Å; M425-E429 PolarHBondContact O-N 2.98Å
426V84.8Confident82.1Confident86 Ų8673.4 Ų73.452%0.52138%0.377SS..Hα-helixtrans-59.2-49.7177.51770000110.6K422 E423 A428 E429 E430K422-V426 PolarHBondContact O-N 3.13Å; E423-V426 PolarHBondContact O-N 3.13Å; V426-A428 VanDerWaalsContact C-N 3.32Å; V426-A428 PolarHBondContact O-N 3.22Å; V426-E429 PolarHBondContact O-N 3.49Å; V426-E430 WeakPolarHBondContact O-CG 3.33Å; V426-E430 PolarHBondContact O-N 3.49Å; V426-E430 VanDerWaalsContact O-N 3.13Å
427Q83.8Confident81.9Confident84 Ų8473.8 Ų73.839%0.39337%0.374SS..Hα-helixtrans-64.9-33.9178.1-70177.1-6.300112.7V392 E423 M425 A431V392-Q427 HydrophobicContact CG1-CB 3.58Å; E423-Q427 WeakPolarHBondContact O-CG 3.4Å; E423-Q427 PolarHBondContact O-N 3.13Å; E423-Q427 VanDerWaalsContact O-N 3.12Å; M425-Q427 PolarHBondContact O-N 3.48Å; Q427-A431 VanDerWaalsContact O-CB 3.26Å; Q427-A431 WeakPolarHBondContact O-CB 3.19Å; Q427-A431 PolarHBondContact O-N 3.45Å
428A80.3Confident81.9Confident8 Ų874.8 Ų74.87%0.06638%0.375CS..Hα-helixtrans-73.9-34177.500000112.7F393 A424 M425 V426 A432F393-A428 HydrophobicContact CD2-CB 4.11Å; F393-A428 HydrophobicContact CE1-CB 4.31Å; F393-A428 HydrophobicContact CE2-CB 3.33Å; F393-A428 HydrophobicContact CZ-CB 3.45Å; F393-A428 VanDerWaalsContact CZ-CB 3.45Å; A424-A428 WeakPolarHBondContact O-CB 3.04Å; A424-A428 PolarHBondContact O-N 2.87Å; M425-A428 PolarHBondContact O-N 3.25Å; V426-A428 VanDerWaalsContact C-N 3.32Å; V426-A428 PolarHBondContact O-N 3.22Å; A428-A432 WeakPolarHBondContact O-CB 3.49Å; A428-A432 PolarHBondContact O-N 3.26Å
429E80.4Confident81.4Confident130 Ų13073 Ų7361%0.60737%0.365SS*.Hα-helixtrans-66.1-44172.9-76.4176.8-167.200111.1M425 V426 A432 A433M425-E429 WeakPolarHBondContact O-CG 3.43Å; M425-E429 PolarHBondContact O-N 2.98Å; V426-E429 PolarHBondContact O-N 3.49Å; E429-A432 PolarHBondContact O-N 3.5Å; E429-A433 VanDerWaalsContact O-CB 3.23Å; E429-A433 WeakPolarHBondContact O-CB 3.45Å; E429-A433 PolarHBondContact O-N 3.12Å
430E82.2Confident81.1Confident134 Ų13473.9 Ų73.963%0.62637%0.367SS*.Hα-helixtrans-60.3-48.6173.1-70.2179.2169.700111.8V426 A433 E434V426-E430 WeakPolarHBondContact O-CG 3.33Å; V426-E430 PolarHBondContact O-N 3.49Å; V426-E430 VanDerWaalsContact O-N 3.13Å; E430-A433 PolarHBondContact O-N 3.41Å; E430-E434 PolarHBondContact O-N 3.06Å
431A79.8Confident80.9Confident27 Ų2780.4 Ų80.422%0.22340%0.395CS..Hα-helixtrans-64.4-42.4177.900000112.3T390 V392 Q427 E434 I435T390-A431 HydrophobicContact CG2-CB 4.28Å; V392-A431 HydrophobicContact CG2-CB 4.13Å; Q427-A431 VanDerWaalsContact O-CB 3.26Å; Q427-A431 WeakPolarHBondContact O-CB 3.19Å; Q427-A431 PolarHBondContact O-N 3.45Å; A431-E434 PolarHBondContact O-N 3.11Å; A431-I435 WeakPolarHBondContact O-CD1 3.47Å; A431-I435 VanDerWaalsContact O-CG1 3.23Å; A431-I435 WeakPolarHBondContact O-CG1 3.3Å; A431-I435 PolarHBondContact O-N 3.48Å
432A77.8Confident80.7Confident27 Ų2784.2 Ų84.222%0.22341%0.412CS..Hα-helixtrans-64.2-42.7176.400000111.2T390 A428 E429 E434 I435 T436T390-A432 HydrophobicContact CG2-CB 4.42Å; A428-A432 WeakPolarHBondContact O-CB 3.49Å; A428-A432 PolarHBondContact O-N 3.26Å; E429-A432 PolarHBondContact O-N 3.5Å; A432-E434 VanDerWaalsContact C-N 3.3Å; A432-E434 PolarHBondContact O-N 3.44Å; A432-I435 PolarHBondContact O-N 3.21Å; A432-T436 WeakPolarHBondContact O-CG2 3.44Å; A432-T436 PolarHBondContact O-N 3.08Å; A432-T436 PolarHBondContact O-OG1 3.18Å; A432-T436 VanDerWaalsContact O-OG1 3.14Å
433A78.9Confident80.3Confident39 Ų3983.6 Ų83.632%0.32241%0.412SS..Hα-helixtrans-63-34.9174.100000112.3E429 E430 T436 R437E429-A433 VanDerWaalsContact O-CB 3.23Å; E429-A433 WeakPolarHBondContact O-CB 3.45Å; E429-A433 PolarHBondContact O-N 3.12Å; E430-A433 PolarHBondContact O-N 3.41Å; A433-T436 WeakPolarHBondContact CA-OG1 3.46Å; A433-T436 PolarHBondContact O-OG1 3.11Å; A433-T436 VanDerWaalsContact O-OG1 3.12Å; A433-R437 VanDerWaalsContact O-CB 3.27Å; A433-R437 WeakPolarHBondContact O-CB 3.48Å; A433-R437 VanDerWaalsContact O-CD 3.28Å; A433-R437 WeakPolarHBondContact O-CD 3.38Å; A433-R437 WeakPolarHBondContact O-CG 3.41Å; A433-R437 PolarHBondContact O-N 2.79Å; A433-R437 VanDerWaalsContact O-N 3.11Å
434E80.4Confident79.9Confident103 Ų10386.1 Ų86.148%0.48142%0.421SS..Hα-helixtrans-70.6-39.8173.6-149.1-149.1168.700112E430 A431 A432 K438E430-E434 PolarHBondContact O-N 3.06Å; A431-E434 PolarHBondContact O-N 3.11Å; A432-E434 VanDerWaalsContact C-N 3.3Å; A432-E434 PolarHBondContact O-N 3.44Å; E434-K438 WeakPolarHBondContact O-CB 3.39Å; E434-K438 VanDerWaalsContact O-CG 3.25Å; E434-K438 WeakPolarHBondContact O-CG 3.31Å; E434-K438 PolarHBondContact O-N 3.12Å; E434-K438 WeakPolarHBondContact OE1-CE 3.29Å; E434-K438 IonicContact OE1-NZ 3.35Å; E434-K438 PolarHBondContact OE1-NZ 2.91Å; E434-K438 IonicContact OE2-NZ 3.11Å; E434-K438 PolarHBondContact OE2-NZ 3.27Å
435I76.8Confident79.7Confident56 Ų5693.6 Ų93.629%0.28745%0.454SS..Hα-helixtrans-66.1-46.7177-68.4160.7000111V388 T390 A431 A432 R437 K438 L439V388-I435 HydrophobicContact CG1-CB 4.08Å; V388-I435 HydrophobicContact CG1-CD1 4.16Å; V388-I435 HydrophobicContact CG1-CG2 3.59Å; T390-I435 HydrophobicContact CG2-CD1 3.97Å; A431-I435 WeakPolarHBondContact O-CD1 3.47Å; A431-I435 VanDerWaalsContact O-CG1 3.23Å; A431-I435 WeakPolarHBondContact O-CG1 3.3Å; A431-I435 PolarHBondContact O-N 3.48Å; A432-I435 PolarHBondContact O-N 3.21Å; I435-R437 PolarHBondContact O-N 3.47Å; I435-K438 WeakPolarHBondContact O-CB 3.43Å; I435-K438 PolarHBondContact O-N 3.1Å; I435-K438 VanDerWaalsContact O-N 3.11Å; I435-L439 HydrophobicContact CG2-CD1 3.97Å; I435-L439 HydrophobicContact CG2-CG 4.34Å; I435-L439 WeakPolarHBondContact O-CG 3.37Å; I435-L439 PolarHBondContact O-N 3.22Å
436T77.3Confident79.4Confident56 Ų5697.9 Ų97.934%0.34447%0.465SS..Hα-helixtrans-62.1-44.5176.454.60000111V388 A432 A433 K438 L439 E440V388-T436 HydrophobicContact CG2-CG2 4.29Å; A432-T436 WeakPolarHBondContact O-CG2 3.44Å; A432-T436 PolarHBondContact O-N 3.08Å; A432-T436 PolarHBondContact O-OG1 3.18Å; A432-T436 VanDerWaalsContact O-OG1 3.14Å; A433-T436 WeakPolarHBondContact CA-OG1 3.46Å; A433-T436 PolarHBondContact O-OG1 3.11Å; A433-T436 VanDerWaalsContact O-OG1 3.12Å; T436-K438 VanDerWaalsContact C-N 3.29Å; T436-K438 PolarHBondContact O-N 3.36Å; T436-L439 PolarHBondContact O-N 2.82Å; T436-E440 PolarHBondContact O-N 3.04Å
437R80Confident79Confident164 Ų16497.9 Ų97.962%0.61946%0.461SS*.Hα-helixtrans-59.1-36.5172.1-74.2169.6177.6-175.70.7112.9A433 I435 K441A433-R437 VanDerWaalsContact O-CB 3.27Å; A433-R437 WeakPolarHBondContact O-CB 3.48Å; A433-R437 VanDerWaalsContact O-CD 3.28Å; A433-R437 WeakPolarHBondContact O-CD 3.38Å; A433-R437 WeakPolarHBondContact O-CG 3.41Å; A433-R437 PolarHBondContact O-N 2.79Å; A433-R437 VanDerWaalsContact O-N 3.11Å; I435-R437 PolarHBondContact O-N 3.47Å; R437-K441 VanDerWaalsContact O-CB 3.31Å; R437-K441 WeakPolarHBondContact O-CB 3.49Å; R437-K441 WeakPolarHBondContact O-CD 3.14Å; R437-K441 WeakPolarHBondContact O-CG 2.89Å; R437-K441 PolarHBondContact O-N 3.29Å; R437-K441 VanDerWaalsContact O-N 3.12Å
438K80.5Confident78.7Confident97 Ų97100.9 Ų100.942%0.42247%0.473SS..Hα-helixtrans-68.5-44.4174.6-78.5165.8179.1166.30111.2E434 I435 T436 K441 Q442E434-K438 WeakPolarHBondContact O-CB 3.39Å; E434-K438 VanDerWaalsContact O-CG 3.25Å; E434-K438 WeakPolarHBondContact O-CG 3.31Å; E434-K438 PolarHBondContact O-N 3.12Å; E434-K438 WeakPolarHBondContact OE1-CE 3.29Å; E434-K438 IonicContact OE1-NZ 3.35Å; E434-K438 PolarHBondContact OE1-NZ 2.91Å; E434-K438 IonicContact OE2-NZ 3.11Å; E434-K438 PolarHBondContact OE2-NZ 3.27Å; I435-K438 WeakPolarHBondContact O-CB 3.43Å; I435-K438 PolarHBondContact O-N 3.1Å; I435-K438 VanDerWaalsContact O-N 3.11Å; T436-K438 VanDerWaalsContact C-N 3.29Å; T436-K438 PolarHBondContact O-N 3.36Å; K438-K441 PolarHBondContact O-N 2.93Å; K438-Q442 WeakPolarHBondContact O-CG 3.46Å; K438-Q442 PolarHBondContact O-N 3.23Å
439L76.4Confident78.6Confident91 Ų91107.2 Ų107.248%0.47650%0.499SS..Hα-helixtrans-63.1-50177.2-70.1171.8000111.6I435 T436 K441 Q442 E443I435-L439 HydrophobicContact CG2-CD1 3.97Å; I435-L439 HydrophobicContact CG2-CG 4.34Å; I435-L439 WeakPolarHBondContact O-CG 3.37Å; I435-L439 PolarHBondContact O-N 3.22Å; T436-L439 PolarHBondContact O-N 2.82Å; L439-K441 VanDerWaalsContact C-N 3.31Å; L439-K441 PolarHBondContact O-N 2.91Å; L439-Q442 CarbonylContact O-C 3.46Å; L439-Q442 WeakPolarHBondContact O-CA 3.38Å; L439-Q442 WeakPolarHBondContact O-CB 3.47Å; L439-Q442 PolarHBondContact O-N 3.44Å; L439-E443 WeakPolarHBondContact O-CB 3.48Å; L439-E443 PolarHBondContact O-N 3.3Å
440E79Confident78.3Confident90 Ų90106.3 Ų106.342%0.42150%0.495SS..Hα-helixtrans-56.7-43174.4-77.9-172.5-148.400112.4T436 Q442 E443 K444T436-E440 PolarHBondContact O-N 3.04Å; E440-Q442 VanDerWaalsContact C-N 3.3Å; E440-Q442 PolarHBondContact O-N 2.81Å; E440-E443 PolarHBondContact O-N 2.74Å; E440-K444 VanDerWaalsContact O-CB 3.27Å; E440-K444 WeakPolarHBondContact O-CB 3.15Å; E440-K444 WeakPolarHBondContact O-CD 3.49Å; E440-K444 VanDerWaalsContact O-CG 3.24Å; E440-K444 WeakPolarHBondContact O-CG 3.44Å; E440-K444 PolarHBondContact O-N 3.49Å; E440-K444 IonicContact OE2-NZ 2.91Å; E440-K444 PolarHBondContact OE2-NZ 3.18Å
441K80.4Confident78.1Confident140 Ų140107.6 Ų107.661%0.60950%0.498SS*.Hα-helixtrans-64.4-35.3176.9-78.3171.5-176.8176.90111.6R437 K438 L439 K445R437-K441 VanDerWaalsContact O-CB 3.31Å; R437-K441 WeakPolarHBondContact O-CB 3.49Å; R437-K441 WeakPolarHBondContact O-CD 3.14Å; R437-K441 WeakPolarHBondContact O-CG 2.89Å; R437-K441 PolarHBondContact O-N 3.29Å; R437-K441 VanDerWaalsContact O-N 3.12Å; K438-K441 PolarHBondContact O-N 2.93Å; L439-K441 VanDerWaalsContact C-N 3.31Å; L439-K441 PolarHBondContact O-N 2.91Å; K441-K445 WeakPolarHBondContact O-CB 3.44Å; K441-K445 WeakPolarHBondContact O-CG 3.47Å; K441-K445 PolarHBondContact O-N 3.21Å
442Q78.4Confident78Confident122 Ų122113.4 Ų113.457%0.5752%0.518SS*.Hα-helixtrans-70.7-43.6174.3-72.6179.516.500111.4K438 L439 E440 K445 R446K438-Q442 WeakPolarHBondContact O-CG 3.46Å; K438-Q442 PolarHBondContact O-N 3.23Å; L439-Q442 CarbonylContact O-C 3.46Å; L439-Q442 WeakPolarHBondContact O-CA 3.38Å; L439-Q442 WeakPolarHBondContact O-CB 3.47Å; L439-Q442 PolarHBondContact O-N 3.44Å; E440-Q442 VanDerWaalsContact C-N 3.3Å; E440-Q442 PolarHBondContact O-N 2.81Å; Q442-K445 CarbonylContact O-C 3.54Å; Q442-K445 WeakPolarHBondContact O-CB 3.29Å; Q442-K445 PolarHBondContact O-N 2.93Å; Q442-R446 WeakPolarHBondContact O-CG 3.34Å; Q442-R446 PolarHBondContact O-N 2.75Å
443E75.9Confident77.9Confident121 Ų121120.3 Ų120.357%0.56554%0.539SS*.Hα-helixtrans-63.7-49178-173.1169.1-15000111.8L439 E440 K445 R446 L447L439-E443 WeakPolarHBondContact O-CB 3.48Å; L439-E443 PolarHBondContact O-N 3.3Å; E440-E443 PolarHBondContact O-N 2.74Å; E443-K445 PolarHBondContact O-N 2.66Å; E443-R446 WeakPolarHBondContact O-CA 3.48Å; E443-R446 PolarHBondContact O-N 2.71Å; E443-L447 HydrophobicContact CG-CD1 4.13Å; E443-L447 HydrophobicContact CG-CG 4.49Å; E443-L447 WeakPolarHBondContact O-CG 3.48Å; E443-L447 PolarHBondContact O-N 2.89Å
444K77.7Confident77.7Confident129 Ų129123.8 Ų123.856%0.56155%0.551SS**Hα-helixtrans-55.9-36.1172.1-71.8163.8-179.4163.10111.8E440 K448E440-K444 VanDerWaalsContact O-CB 3.27Å; E440-K444 WeakPolarHBondContact O-CB 3.15Å; E440-K444 WeakPolarHBondContact O-CD 3.49Å; E440-K444 VanDerWaalsContact O-CG 3.24Å; E440-K444 WeakPolarHBondContact O-CG 3.44Å; E440-K444 PolarHBondContact O-N 3.49Å; E440-K444 IonicContact OE2-NZ 2.91Å; E440-K444 PolarHBondContact OE2-NZ 3.18Å; K444-K448 VanDerWaalsContact O-CB 3.28Å; K444-K448 WeakPolarHBondContact O-CB 3.41Å; K444-K448 PolarHBondContact O-N 2.91Å; K444-K448 VanDerWaalsContact O-N 3.08Å
445K79.7Confident77.5Confident157 Ų157121.4 Ų121.468%0.68355%0.549SS*.Hα-helixtrans-70.4-39.1172.5-78.4174.4-179.7-176.20113K441 Q442 E443 K449K441-K445 WeakPolarHBondContact O-CB 3.44Å; K441-K445 WeakPolarHBondContact O-CG 3.47Å; K441-K445 PolarHBondContact O-N 3.21Å; Q442-K445 CarbonylContact O-C 3.54Å; Q442-K445 WeakPolarHBondContact O-CB 3.29Å; Q442-K445 PolarHBondContact O-N 2.93Å; E443-K445 PolarHBondContact O-N 2.66Å; K445-K449 WeakPolarHBondContact O-CB 3.33Å; K445-K449 PolarHBondContact O-N 2.88Å
446R76.1Confident77.5Confident195 Ų195121.5 Ų121.574%0.73656%0.558SS**Hα-helixtrans-65.3-52.1176-71.6-178.277.8-175.23.4110.8Q442 E443 K448 K449 E450Q442-R446 WeakPolarHBondContact O-CG 3.34Å; Q442-R446 PolarHBondContact O-N 2.75Å; E443-R446 WeakPolarHBondContact O-CA 3.48Å; E443-R446 PolarHBondContact O-N 2.71Å; R446-K448 VanDerWaalsContact C-N 3.29Å; R446-K448 PolarHBondContact O-N 3.25Å; R446-K449 CarbonylContact O-C 3.54Å; R446-K449 WeakPolarHBondContact O-CA 3.35Å; R446-K449 WeakPolarHBondContact O-CB 3.48Å; R446-K449 PolarHBondContact O-N 3.29Å; R446-E450 WeakPolarHBondContact O-CB 3.47Å; R446-E450 PolarHBondContact O-N 3.25Å
447L76.8Confident77.3Confident86 Ų86124.4 Ų124.445%0.4557%0.571SS.*Hα-helixtrans-55.5-41.6175.3-68170000111.9E443 K449 E450 K451E443-L447 HydrophobicContact CG-CD1 4.13Å; E443-L447 HydrophobicContact CG-CG 4.49Å; E443-L447 WeakPolarHBondContact O-CG 3.48Å; E443-L447 PolarHBondContact O-N 2.89Å; L447-K449 PolarHBondContact O-N 3.02Å; L447-E450 PolarHBondContact O-N 3.44Å; L447-K451 WeakPolarHBondContact O-CB 3.38Å; L447-K451 WeakPolarHBondContact O-CG 3.03Å; L447-K451 PolarHBondContact O-N 3.1Å
448K77.4Confident76.9Confident146 Ų146119.5 Ų119.564%0.63557%0.565SS**Hα-helixtrans-66.8-34.1174.9-170.5169.5-174.4170.50113K444 R446 K452K444-K448 VanDerWaalsContact O-CB 3.28Å; K444-K448 WeakPolarHBondContact O-CB 3.41Å; K444-K448 PolarHBondContact O-N 2.91Å; K444-K448 VanDerWaalsContact O-N 3.08Å; R446-K448 VanDerWaalsContact C-N 3.29Å; R446-K448 PolarHBondContact O-N 3.25Å; K448-K452 WeakPolarHBondContact O-CB 3.22Å; K448-K452 WeakPolarHBondContact O-CG 3.32Å; K448-K452 PolarHBondContact O-N 3.02Å
449K78.6Confident76.5Confident141 Ų141119.8 Ų119.861%0.61357%0.571SS**Hα-helixtrans-73.7-34175.7-169.8175.4-177.7178.20111.9K445 R446 L447 R453K445-K449 WeakPolarHBondContact O-CB 3.33Å; K445-K449 PolarHBondContact O-N 2.88Å; R446-K449 CarbonylContact O-C 3.54Å; R446-K449 WeakPolarHBondContact O-CA 3.35Å; R446-K449 WeakPolarHBondContact O-CB 3.48Å; R446-K449 PolarHBondContact O-N 3.29Å; L447-K449 PolarHBondContact O-N 3.02Å; K449-R453 PolarHBondContact O-N 3.13Å
450E74Confident75.9Confident112 Ų112118.2 Ų118.252%0.52357%0.571SS.*Hα-helixtrans-73.4-48.4177.5-173157.2-142.800112R446 L447 K452 R453 L454R446-E450 WeakPolarHBondContact O-CB 3.47Å; R446-E450 PolarHBondContact O-N 3.25Å; L447-E450 PolarHBondContact O-N 3.44Å; E450-K452 PolarHBondContact O-N 3.18Å; E450-R453 WeakPolarHBondContact O-CA 3.42Å; E450-R453 WeakPolarHBondContact O-CB 3.41Å; E450-R453 PolarHBondContact O-N 3.19Å; E450-L454 HydrophobicContact CG-CD1 4.43Å; E450-L454 PolarHBondContact O-N 3.05Å
451K77.6Confident74.7Confident160 Ų160118 Ų11870%0.69658%0.579SS**Hα-helixtrans-55.1-39.6169.9-73-171.1177.1-167.30112.2L447 A455L447-K451 WeakPolarHBondContact O-CB 3.38Å; L447-K451 WeakPolarHBondContact O-CG 3.03Å; L447-K451 PolarHBondContact O-N 3.1Å; K451-A455 WeakPolarHBondContact O-CB 3.03Å; K451-A455 PolarHBondContact O-N 3.32Å
452K79.2Confident73.4Confident150 Ų150114.2 Ų114.265%0.65257%0.571SS**Hα-helixtrans-65.2-35.4172.8-81.8-171.1172.3-155.50113.7K448 E450 A456K448-K452 WeakPolarHBondContact O-CB 3.22Å; K448-K452 WeakPolarHBondContact O-CG 3.32Å; K448-K452 PolarHBondContact O-N 3.02Å; E450-K452 PolarHBondContact O-N 3.18Å; K452-A456 WeakPolarHBondContact O-CB 3.38Å; K452-A456 PolarHBondContact O-N 2.84Å; K452-A456 VanDerWaalsContact O-N 3.07Å
453R74.2Confident71.7Confident172 Ų172115.4 Ų115.465%0.64958%0.576SS**Hα-helixtrans-70.5-44175.6-84.1-178.9161.6-170.1-7.7111.9K449 E450 A456 L457K449-R453 PolarHBondContact O-N 3.13Å; E450-R453 WeakPolarHBondContact O-CA 3.42Å; E450-R453 WeakPolarHBondContact O-CB 3.41Å; E450-R453 PolarHBondContact O-N 3.19Å; R453-A456 PolarHBondContact O-N 2.91Å; R453-L457 WeakPolarHBondContact O-CB 3.43Å; R453-L457 PolarHBondContact O-N 2.9Å
454L74.4Confident70Confident112 Ų112117 Ų11759%0.58659%0.589SS**Hα-helixtrans-61.9-44.8175.8-71.9166.8000111.2E450 A456 L457 A458E450-L454 HydrophobicContact CG-CD1 4.43Å; E450-L454 PolarHBondContact O-N 3.05Å; L454-A456 PolarHBondContact O-N 3.19Å; L454-L457 PolarHBondContact O-N 3.29Å; L454-A458 WeakPolarHBondContact O-CB 3.36Å; L454-A458 PolarHBondContact O-N 2.97Å
455A77Confident68.1Low52 Ų52115.6 Ų115.643%0.4360%0.595SS.*Hα-helixtrans-61.7-40.5174.600000112.9K451 A458 L459K451-A455 WeakPolarHBondContact O-CB 3.03Å; K451-A455 PolarHBondContact O-N 3.32Å; A455-A458 PolarHBondContact O-N 2.99Å; A455-L459 WeakPolarHBondContact O-CG 3.47Å; A455-L459 PolarHBondContact O-N 3.17Å
456A77.7Confident65.7Low58 Ų58112.7 Ų112.748%0.47960%0.595SS.*Hα-helixtrans-67.5-35.917600000113K452 R453 L454 A460K452-A456 WeakPolarHBondContact O-CB 3.38Å; K452-A456 PolarHBondContact O-N 2.84Å; K452-A456 VanDerWaalsContact O-N 3.07Å; R453-A456 PolarHBondContact O-N 2.91Å; L454-A456 PolarHBondContact O-N 3.19Å; A456-A460 VanDerWaalsContact O-CB 3.31Å; A456-A460 WeakPolarHBondContact O-CB 3.39Å; A456-A460 PolarHBondContact O-N 2.92Å
457L72.4Confident63.5Low118 Ų118109.1 Ų109.162%0.61860%0.599SS**Hα-helixtrans-68.1-37.6173.2-87.5157.3000112.3R453 L454 S461R453-L457 WeakPolarHBondContact O-CB 3.43Å; R453-L457 PolarHBondContact O-N 2.9Å; L454-L457 PolarHBondContact O-N 3.29Å; L457-S461 WeakPolarHBondContact O-CB 3.31Å; L457-S461 PolarHBondContact O-N 2.98Å; L457-S461 VanDerWaalsContact O-N 3.1Å; L457-S461 PolarHBondContact O-OG 2.7Å
458A72Confident61.4Low60 Ų60111.4 Ų111.450%0.49662%0.617SS.*Hα-helixtrans-65.3-48.2174.900000111.3L454 A455 A460 S461 S462L454-A458 WeakPolarHBondContact O-CB 3.36Å; L454-A458 PolarHBondContact O-N 2.97Å; A455-A458 PolarHBondContact O-N 2.99Å; A458-A460 PolarHBondContact O-N 3.04Å; A458-S461 WeakPolarHBondContact O-CB 3.27Å; A458-S461 PolarHBondContact O-N 3.04Å; A458-S461 VanDerWaalsContact O-N 3.09Å; A458-S462 PolarHBondContact O-N 3.24Å; A458-S462 VanDerWaalsContact O-N 3.1Å; A458-S462 PolarHBondContact O-OG 3.4Å
459L70.7Confident59.2Low103 Ų103110.5 Ų110.554%0.53963%0.627SS.*Hα-helixtrans-60.2-46177.1-75.8162.5000112.4A455 S461 S462 E463A455-L459 WeakPolarHBondContact O-CG 3.47Å; A455-L459 PolarHBondContact O-N 3.17Å; L459-S461 PolarHBondContact O-N 2.92Å; L459-S462 WeakPolarHBondContact CA-OG 3.18Å; L459-S462 PolarHBondContact O-N 3.32Å; L459-S462 VanDerWaalsContact O-N 3.12Å; L459-S462 PolarHBondContact O-OG 3.01Å; L459-E463 WeakPolarHBondContact O-CG 3.4Å; L459-E463 PolarHBondContact O-N 3.03Å
460A65Low57.1Low59 Ų59113.2 Ų113.249%0.48864%0.641SS.*Hα-helixtrans-65.3-22.2176.400000113.4A456 A458A456-A460 VanDerWaalsContact O-CB 3.31Å; A456-A460 WeakPolarHBondContact O-CB 3.39Å; A456-A460 PolarHBondContact O-N 2.92Å; A458-A460 PolarHBondContact O-N 3.04Å
461S53.7Low54.9Low84 Ų84116.9 Ų116.959%0.58766%0.659SS**Hα-helixtrans-78.4-34.7173-56.40000112.2L457 A458 L459L457-S461 WeakPolarHBondContact O-CB 3.31Å; L457-S461 PolarHBondContact O-N 2.98Å; L457-S461 VanDerWaalsContact O-N 3.1Å; L457-S461 PolarHBondContact O-OG 2.7Å; A458-S461 WeakPolarHBondContact O-CB 3.27Å; A458-S461 PolarHBondContact O-N 3.04Å; A458-S461 VanDerWaalsContact O-N 3.09Å; L459-S461 PolarHBondContact O-N 2.92Å
462S51.8Low52.4Low62 Ų62114.9 Ų114.943%0.43466%0.663SS.*Hα-helixtrans-80.3-33.4179.550.20000114.3A458 L459 N464 S465A458-S462 PolarHBondContact O-N 3.24Å; A458-S462 VanDerWaalsContact O-N 3.1Å; A458-S462 PolarHBondContact O-OG 3.4Å; L459-S462 WeakPolarHBondContact CA-OG 3.18Å; L459-S462 PolarHBondContact O-N 3.32Å; L459-S462 VanDerWaalsContact O-N 3.12Å; L459-S462 PolarHBondContact O-OG 3.01Å; S462-N464 PolarHBondContact O-N 2.87Å; S462-S465 PolarHBondContact O-N 2.84Å; S462-S465 PolarHBondContact O-OG 2.98Å
463E44.3Very low49.9Very low146 Ų146116.2 Ų116.268%0.68267%0.672SS**G310 helixtrans-67.8-18.3179-73.5176.6172.700112.8L459 S465L459-E463 WeakPolarHBondContact O-CG 3.4Å; L459-E463 PolarHBondContact O-N 3.03Å; E463-S465 VanDerWaalsContact C-N 3.31Å; E463-S465 PolarHBondContact O-N 3.47Å
464N40.2Very low47.6Very low155 Ų155116.3 Ų116.383%0.82968%0.68SS**G310 helixtrans-88.38.3-177.6-129.521.7000113.8S462S462-N464 PolarHBondContact O-N 2.87Å
465S36.2Very low45.5Very low100 Ų100118.1 Ų118.170%0.69970%0.696SS**G310 helixtrans-126.17.4-176.253.60000116S462 E463S462-S465 PolarHBondContact O-N 2.84Å; S462-S465 PolarHBondContact O-OG 2.98Å; E463-S465 VanDerWaalsContact C-N 3.31Å; E463-S465 PolarHBondContact O-N 3.47Å
466S30.2Very low43Very low96 Ų96121 Ų12167%0.67171%0.712SS**  trans-135.998.1176.361.70000112.3
467S30Very low40.7Very low119 Ų119128 Ų12883%0.83274%0.735SS**  trans-12587.9173.562.30000111.3
468T32.2Very low38.6Very low135 Ų135132.1 Ų132.183%0.82875%0.748SS**  trans-145118.1162.441.50000107.7
469P31.1Very low36.9Very low127 Ų127134.5 Ų134.583%0.82576%0.759SS**  trans-99.2121.8-177.534.7-27.8000111.5
470E34.6Very low35.1Very low198 Ų198139.9 Ų139.993%0.92578%0.778SS**  trans-137.2155.4162.1-70.7-168157.600110.2
471E27.2Very low33.3Very low189 Ų189146.5 Ų146.588%0.88380%0.795SS**  trans-85.7155.7-161.3-59.3167.813000113.1
472C26Very low32.4Very low117 Ų117153 Ų15379%0.79181%0.813SS**  171.1114.9125.4-92.90000113.5
473E27.3Very low31.3Very low178 Ų178157.6 Ų157.683%0.83283%0.825SS**  trans51.2118.7137.7-57.7-170.1152.700123.7
474E26.2Very low30.8Very low175 Ų175160.9 Ų160.982%0.81884%0.837SS**  trans40118.5132.6-52.7-157.8152.300122
475T29Very low30.2Very low150 Ų150160.3 Ų160.392%0.9283%0.829SS**  -165.8145100.118.50000112
476S25.4Very low29.9Very low112 Ų112165.5 Ų165.578%0.78384%0.84SS**  trans-110.1127.7-170.458.70000113.3
477E29.7Very low30Very low204 Ų204166.4 Ų166.495%0.95384%0.843SS**  trans-137.3124.2157.7-78.3-149.7145.200114.8
478K28.7Very low30.2Very low205 Ų205168.8 Ų168.889%0.89184%0.841SS**  trans-152.3165.3162.7-95.1-177.5-177.9170.60104.9
479P35.3Very low30.1Very low111 Ų111170.2 Ų170.272%0.72184%0.838SS**  cis-132.6-168.6-21.638.5-21.2000111.4
480K33.1Very low30Very low216 Ų216170.1 Ų170.194%0.93984%0.835SS**  trans-159.9145.8144.5-110.7149.7-168.2170.80115.2
481K28Very low29.9Very low197 Ų197166.3 Ų166.386%0.85783%0.827SS**  trans-90.4158.1-175.7-61.7163.7175.8166.90111.9
482K33.9Very low30Very low220 Ų220165.8 Ų165.896%0.95783%0.825SS**  trans-134.3135.9137.2-84.2-170.2177.7174.10110.7
483K27.7Very low30.3Very low160 Ų160169.4 Ų169.470%0.69683%0.83SS**  trans-131.4143.7-174.6-169.6-165.4-163.5-162.10106.7
484K33.9Very low30.4Very low215 Ų215169 Ų16994%0.93583%0.834SS**  trans-143.6126.5161.6-142.2175.5-174.7-177.50109.1
485Q29.5Very low30.6Very low142 Ų142164 Ų16466%0.66483%0.829SS**  trans-116.7156.4178.7-70.2170.7-83.400109
486K29.8Very low30.8Very low210 Ų210166 Ų16691%0.91383%0.831SS**  trans-151.3131.2144.5-124.5-173.7177.4-165.60109.1
487P31.1Very low31Very low114 Ų114170 Ų17074%0.7484%0.837SS**  trans-111.4166.8-17840.7-33.3000113.5
488Q33.8Very low31Very low169 Ų169167.8 Ų167.879%0.7983%0.832SS**  trans152.4142.7159.5-88.3177.3-56.900106.9
489E31.1Very low31.3Very low166 Ų166163.4 Ų163.478%0.77682%0.824SS**  cis-156.6164.4-9.2-115.8156.6-149.400107.3
490V29.3Very low31Very low124 Ų124163.9 Ų163.975%0.75283%0.83SS**  trans-114.3151.7-176.8-137.60000110.1
491P32Very low31Very low118 Ų118160.8 Ų160.877%0.76682%0.822SS**  -139.2134.782.821.90.4000113.8
492Q29.2Very low31.2Very low178 Ų178156.9 Ų156.983%0.83282%0.817SS**  59.2101.590.3-76.4-171.6-26.700116.5
493E32.7Very low31Very low194 Ų194156.7 Ų156.791%0.90782%0.816SS**  -157.1162.2121.4-120.2178.5-179.400111.9
494N29.2Very low31.2Very low168 Ų168154.2 Ų154.290%0.89882%0.819SS**  trans-90.2163.9-165.1-60.4-57.5000113
495G30.8Very low30.8Very low70 Ų70153.5 Ų153.572%0.72282%0.816SS**  cis169-158.1-1.800000113
496M31.8Very low30.8Very low194 Ų194152.9 Ų152.996%0.95683%0.825SS**  trans79.988.2175.1-128.769.4160.300117.6
497E29.8Very low30.9Very low196 Ų196152.8 Ų152.892%0.91682%0.824SS**  trans-115.1162158.8-80.8-169.9153.700110.6
498D29.5Very low30.6Very low157 Ų157157.5 Ų157.584%0.8483%0.833SS**  trans-59.4146.1-164-65.6-66.8000118.2S500D498-S500 PolarHBondContact O-N 3.13Å
499P35.2Very low30.5Very low112 Ų112159.3 Ų159.373%0.72784%0.838SS**  trans-81.5114.1162.132.9-30.3000111.4
500S30.4Very low30.3Very low121 Ų121160.2 Ų160.285%0.84684%0.839SS**  trans-72.7133.9166.857.90000111.7D498D498-S500 PolarHBondContact O-N 3.13Å
501I33Very low30.1Very low152 Ų152159 Ų15978%0.77984%0.836SS**  trans-125.1133.8173.9-62.4-176.9000109.6
502P30.7Very low30Very low114 Ų114163 Ų16374%0.7484%0.842SS**PPolyproline II helixtrans-98.5144-161.636.6-34.8000114.6S504P502-S504 PolarHBondContact O-N 2.6Å
503F30.3Very low30Very low216 Ų216159.8 Ų159.895%0.94784%0.839SS**PPolyproline II helixtrans-75122.5170.2-95.6-85.1000112.4
504S31.9Very low29.7Very low108 Ų108159.9 Ų159.976%0.75584%0.837SS**PPolyproline II helixtrans-88.6156.4-179.3580000113.1P502P502-S504 PolarHBondContact O-N 2.6Å
505K25.2Very low29.6Very low200 Ų200161 Ų16187%0.8784%0.836SS**PPolyproline II helixtrans-91.1135.1174.5-61170.5-179.3171.40110.6
506P30.6Very low29.5Very low130 Ų130166.5 Ų166.584%0.84484%0.844SS**PPolyproline II helixtrans-87.6136.4157.831.4-28.3000111.4
507K31.3Very low29.5Very low207 Ų207165.5 Ų165.590%0.984%0.841SS**PPolyproline II helixtrans-91.2152.1175.5-76.9178.4175.8175.30111.6
508K24.4Very low29.4Very low214 Ų214165 Ų16593%0.9384%0.841SS**PPolyproline II helixtrans-51.8132.6174.5-68.2176.5173.1179.50114.4
509K31.8Very low29.3Very low206 Ų206162.7 Ų162.790%0.89684%0.837SS**  trans-162.3149.5145.2-83.1-176.9-174.7175.80106.5
510K28.1Very low29.2Very low185 Ų185163.2 Ų163.280%0.80484%0.843SS**  cis-170.9127.9-23.3-168.1-173.9-174.7-170.80106.7
511S25.2Very low29.1Very low98 Ų98165.2 Ų165.269%0.68585%0.845SS**  trans57.1157.6162.5490000121.3
512F29.1Very low29.1Very low202 Ų202165.3 Ų165.389%0.88685%0.846SS**  trans85.4129.3-175.3-69.2-85.8000115.7
513S30Very low29.1Very low111 Ų111167.8 Ų167.878%0.77685%0.848SS**  cis-153.7155-15.526.60000108.6
514K25.5Very low29.2Very low197 Ų197165.8 Ų165.886%0.85784%0.841SS**  trans-117.184.8-171.5-179.4-160.6174.2-170.70110.2
515E27.1Very low29Very low190 Ų190166.8 Ų166.889%0.88884%0.843SS**  trans-170.4165.7164.5-107.3142-153.800108.9
516E28.7Very low29.3Very low187 Ų187162.3 Ų162.387%0.87484%0.844SS**  trans65.980.5-177.9-57.7-168.2150.800117.5
517L32.4Very low29.2Very low173 Ų173159.4 Ų159.491%0.90684%0.837SS**  -16964.3121.9-100.6164.5000110
518M26.4Very low28.9Very low185 Ų185155.4 Ų155.491%0.91184%0.835SS**  trans-109.691.1165.3-80.7-18058.100109
519S27.9Very low29.1Very low109 Ų109152 Ų15276%0.76283%0.832SS**  trans176.295.416040.50000113
520S33.5Very low29Very low122 Ų122146.8 Ų146.885%0.85382%0.822SS**  trans-167.850.6154.743.20000112.6
521D27.3Very low29Very low164 Ų164145.3 Ų145.388%0.87782%0.822SS**  trans-125.187.1164.7-95.8-40.2000108.4
522L34.7Very low29.1Very low153 Ų153146.1 Ų146.180%0.80183%0.825SS**  trans-166.5141.7165.4-75.3-171.8000105
523E29.1Very low28.9Very low166 Ų166145.7 Ų145.778%0.77682%0.823SS**  cis-174.3-164.6-13.4-123.8-179.6170.700104.3
524E32.6Very low28.9Very low174 Ų174152.7 Ų152.781%0.81383%0.832SS**  trans67.992.1171.7-53.2-164.1142.200116.4
525T29.3Very low29.1Very low129 Ų129152.9 Ų152.979%0.79183%0.833SS**  70.6127.261.177.80000116.1
526A29.5Very low29.1Very low107 Ų107154 Ų15488%0.88484%0.835SS**  trans48.3142.7148.400000122
527G28.6Very low29.1Very low69 Ų69150.7 Ų150.771%0.71183%0.832SS**  trans140.176.9155.100000116.1T529G527-T529 PolarHBondContact O-N 3.34Å
528S24.8Very low28.7Very low122 Ų122148 Ų14885%0.85383%0.828SS**  trans-68111.5161.554.70000110.7
529T29.4Very low28.9Very low142 Ų142145.1 Ų145.187%0.87182%0.823SS**  trans-147.9148.4160.93.70000112.5G527G527-T529 PolarHBondContact O-N 3.34Å
530S29.7Very low28.9Very low97 Ų97149.4 Ų149.468%0.67883%0.828SS**  trans-98.4138.5-164.645.30000113.8
531L28.7Very low28.6Very low155 Ų155152.6 Ų152.681%0.81283%0.829SS**  trans63.2157.4147.9-68.9173000116.9
532P26.3Very low28.7Very low114 Ų114153.4 Ų153.474%0.7483%0.828SS**  cis-144.316332.540.4-19.5000119.6
533K24.8Very low28.3Very low194 Ų194151.5 Ų151.584%0.84382%0.823SS**  trans-2.6116.9150.5-60.9168.1-179.4169.50117
534R31.4Very low28.5Very low257 Ų257149.7 Ų149.797%0.9782%0.823SS**  trans-117.8148.3147.7-111.6-179.2171.1-174-3.6111.3
535K29.6Very low28.3Very low201 Ų201147.5 Ų147.587%0.87482%0.817SS**  trans-94.9147-160.3-69.3170.9175.7172.10113
536K26.1Very low28.3Very low213 Ų213148.6 Ų148.693%0.92682%0.818SS**  trans17.5117.5145.2-81-179.5167.4-177.80118.2
537S28Very low28.3Very low118 Ų118149.1 Ų149.183%0.82581%0.812SS**  trans-148.5115.2136.155.90000109.4
538S24.3Very low28.4Very low117 Ų117154.7 Ų154.782%0.81882%0.82SS**PPolyproline II helixtrans-89.2129.9177.648.10000111.6
539P30.5Very low28.7Very low124 Ų124158.4 Ų158.481%0.80582%0.824SS**PPolyproline II helixtrans-79.3150150.4-11.329.7000110.1
540K29.5Very low28.7Very low200 Ų200156.7 Ų156.787%0.8782%0.823SS**PPolyproline II helixtrans-68.3162.2-171.2-68.5165.4176.4173.50113.2E542K540-E542 PolarHBondContact O-N 3.34Å
541E26.6Very low28.7Very low188 Ų188155.3 Ų155.388%0.87983%0.825SS**PPolyproline II helixtrans-56.2121.3159.1-64165.7126.400109.7
542E28.8Very low28.8Very low182 Ų182157 Ų15785%0.8583%0.828SS**  trans-102.8108.9153.6-77.7-172.2162.900108K540 V544K540-E542 PolarHBondContact O-N 3.34Å; E542-V544 PolarHBondContact O-N 3.17Å
543T27Very low29Very low112 Ų112163.4 Ų163.469%0.68784%0.837SS**  trans-67.993.8167.746.50000108.9N545T543-N545 VanDerWaalsContact C-N 3.26Å; T543-N545 PolarHBondContact O-N 3.46Å
544V32.4Very low29.2Very low128 Ų128160.3 Ų160.378%0.77684%0.84SS**  trans-6895.5157.7-178.20000106.5E542 D546E542-V544 PolarHBondContact O-N 3.17Å; V544-D546 PolarHBondContact O-N 2.83Å
545N29Very low29.2Very low128 Ų128151.5 Ų151.568%0.68483%0.83SS**  trans-68.3116.6168.8-69.4-44.9000107.9T543 P547T543-N545 VanDerWaalsContact C-N 3.26Å; T543-N545 PolarHBondContact O-N 3.46Å; N545-P547 WeakPolarHBondContact O-CD 3.26Å
546D29.8Very low29.3Very low152 Ų152147.9 Ų147.981%0.81383%0.83SS**  trans-61.5118.9162.2-73.6-53.5000108.8V544V544-D546 PolarHBondContact O-N 2.83Å
547P28.5Very low29.5Very low118 Ų118148 Ų14877%0.76683%0.83SS**  trans-104.449.6178.237.2-24000111.1N545N545-P547 WeakPolarHBondContact O-CD 3.26Å
548E31.3Very low29.7Very low187 Ų187152.6 Ų152.687%0.87484%0.835SS**  trans-123.143.1175.8-69.9-158.915600113.2
549E31.8Very low30.1Very low200 Ų200157 Ų15794%0.93584%0.84SS**SBendtrans-142.347.4165.1-134.2179.5-151.900112.7
550A28.1Very low30.2Very low105 Ų105163.1 Ų163.187%0.86885%0.847SS**  trans-141.875.9179.200000112.9
551G29.7Very low30.3Very low68 Ų68163 Ų16370%0.70185%0.846SS**  trans-172.560.3-177.300000116.7
552H31.2Very low30.5Very low190 Ų190163.7 Ų163.788%0.8885%0.847SS**SBendtrans166106.4143.8-96.2-69.7000111.4
553R30.6Very low30.7Very low250 Ų250159 Ų15994%0.94383%0.834SS**  trans164.175.4142-91.3167.3-175.8-156.60.1111.2
554S29.4Very low30.9Very low128 Ų128162.8 Ų162.890%0.89584%0.841SS**  trans-81.9150.1153.448.40000109.5
555G30.6Very low31.1Very low73 Ų73163.4 Ų163.475%0.75384%0.835SS**  trans96.277.6164.300000117.9
556S31.4Very low31.3Very low125 Ų125165.4 Ų165.487%0.87484%0.84SS**  171.1116.9114.645.30000112.5
557K30.1Very low31.6Very low216 Ų216163.7 Ų163.794%0.93984%0.837SS**  trans-84124.7168.4-74.2172.3176.2169.10109.3
558K33.2Very low32.1Very low214 Ų214164 Ų16493%0.9384%0.837SS**  trans-143.8119150.9-116.2173.8-176.3175.20110.7
559K33.3Very low32.4Very low209 Ų209159.9 Ų159.991%0.90983%0.829SS**  trans-70139.6176.9-66.7171.7174.8174.30110
560R32.4Very low32.7Very low253 Ų253155.8 Ų155.896%0.95582%0.822SS**  trans-149.4136.2141-110.9174.8176.3-176.5-3.9109.6
561K30.4Very low32.9Very low196 Ų196154.4 Ų154.485%0.85282%0.818SS**  trans-104.1172.8175.5-88.4-174.1169.8-174.20108.8
562F31.9Very low33.4Very low204 Ų204157.4 Ų157.490%0.89583%0.825SS**  trans71.8143.8-179.8-81.1-104.4000113.7
563S33.7Very low33.4Very low83 Ų83157.5 Ų157.558%0.5883%0.826SS**  cis-135.6-171.511.254.30000112.8E565S563-E565 WeakPolarHBondContact CB-OE1 3.45Å; S563-E565 VanDerWaalsContact CB-OE2 3.27Å; S563-E565 WeakPolarHBondContact CB-OE2 3.45Å; S563-E565 PolarHBondContact OG-OE1 3.04Å; S563-E565 PolarHBondContact OG-OE2 2.75Å
564K30.6Very low33.6Very low191 Ų191155.1 Ų155.183%0.8383%0.826SS**  trans-131.197.2-166.5174.4-159.5173-1710109.5
565E35.6Very low33.9Very low141 Ų141153.6 Ų153.666%0.65982%0.821SS**  trans-151.1143.9-178.6-58.174.8-13700110.1S563S563-E565 WeakPolarHBondContact CB-OE1 3.45Å; S563-E565 VanDerWaalsContact CB-OE2 3.27Å; S563-E565 WeakPolarHBondContact CB-OE2 3.45Å; S563-E565 PolarHBondContact OG-OE1 3.04Å; S563-E565 PolarHBondContact OG-OE2 2.75Å
566E33.3Very low34.2Very low171 Ų171155.3 Ų155.380%0.79983%0.828SS**  cis-154.6158.4-43-91.4-110.990.600108.7
567P35.9Very low34.6Very low115 Ų115153.2 Ų153.275%0.74783%0.826SS**  trans-100128.4-176.335.8-28.8000114.3
568V39.2Very low34.8Very low126 Ų126152.7 Ų152.776%0.76482%0.824SS**  trans-138.9109177.9-178.60000108.5
569S38Very low34.9Very low100 Ų100147.5 Ų147.570%0.69981%0.814SS**  64.3127.3103.91210000114
570S37.4Very low35.1Very low114 Ų114143.1 Ų143.180%0.79781%0.81SS**  cis112.1121.620.567.60000112.4
571G34.3Very low35.4Very low76 Ų76136.9 Ų136.978%0.78481%0.805SS**  trans102.1164.116400000116.5
572P38.2Very low35.7Very low130 Ų130137.1 Ų137.184%0.84481%0.806SS**  cis-121.5158.25.238.8-25.6000115.8
573E32.4Very low36Very low192 Ų192137.6 Ų137.690%0.89781%0.808SS**  trans-86.2139.3148.3-72.6-176.7117.400108.4
574E35.6Very low36.2Very low200 Ų200143.3 Ų143.394%0.93582%0.822SS**  trans-164.2160.9142.3-118.3177.3-172.900113.9
575A35.4Very low36.6Very low97 Ų97144 Ų14480%0.80283%0.825SS**  trans-72.5154.7-15600000119.1
576A37Very low36.5Very low109 Ų109147 Ų14790%0.90184%0.836SS**  165137.7118.300000113.6
577G38.1Very low36.9Very low81 Ų81147.8 Ų147.884%0.83584%0.838SS**  trans151.389.2164.400000118.4
578K35.2Very low37.2Very low205 Ų205151.1 Ų151.189%0.89184%0.843SS**  trans-50.8149174.2-54156.8178.91720112.6
579S35.1Very low37.1Very low104 Ų104154.6 Ų154.673%0.72785%0.847SS**  17315559.349.80000114.7
580S37.1Very low37.4Very low117 Ų117154.2 Ų154.282%0.81885%0.85SS**  trans67.7147.7159.583.40000119.3
581S38.3Very low37.5Very low122 Ų122153.8 Ų153.885%0.85385%0.848SS**  cis-156.1172.9-15.658.90000112.1
582K37.3Very low38.1Very low202 Ų202159.1 Ų159.188%0.87885%0.852SS**  trans-84.1147.7-166.1-60.6161.4175.1168.10115.2
583K39.1Very low38.5Very low214 Ų214161.5 Ų161.593%0.9385%0.852SS**  -167.4138.6120-111.3167.9-177.31730114.8
584K36.1Very low39.4Very low202 Ų202164 Ų16488%0.87887%0.872SS**  trans-90153.3172-68.6173.4172.2176.90110.8
585K40.3Very low39.6Very low206 Ų206162.3 Ų162.390%0.89687%0.869SS**  trans-161.4126.2132.9-112.3177.6-178.8-1730112.1
586K33.7Very low39.9Very low203 Ų203165.7 Ų165.788%0.88387%0.872SS**  trans-109.8136.9158.4-87.4-175172.5-176.50106.6
587F40.7Very low40Very low189 Ų189168.8 Ų168.883%0.82987%0.87SS**  trans-157.4110155.9-108.5-90000105
588H41.5Very low40.1Very low184 Ų184174 Ų17485%0.85287%0.873SS**  86.2155.282.7-107.3-65.9000114.1
589K37.9Very low40.4Very low199 Ų199172.1 Ų172.187%0.86587%0.871SS**  trans-136.3126.7-154168.6-165.4178.3-1730109.8
590A43.9Very low40.8Very low92 Ų92176.6 Ų176.676%0.7688%0.881SS**  trans164.4157.9162.600000106.8
591S40.7Very low41Very low106 Ų106180.9 Ų180.974%0.74189%0.885SS**  cis168.6170.1-15.9-80.30000104.9
592Q46.4Very low41.3Very low188 Ų188185.4 Ų185.488%0.87989%0.888SS**  trans80.2124.2-171.7-56.9179.3-56.700112.5
593E47.2Very low41.6Very low180 Ų180184 Ų18484%0.84189%0.889SS**  cis60.381.521.9-65.4-179.316900113.7
594D51.3Low41.8Very low245 Ų245181.3 Ų181.3100%1.3189%0.885SS**  -142.1089.8-90.8-37.8000109.7

Retrieved 594 of 594 residues in 251.1 ms (Link to these results)