A0A060W5L9_ONCMY Loading...

Trimeric intracellular cation channel type A

Intracellular monovalent cation channel required for maintenance of rapid intracellular calcium release. Acts as a potassium counter-ion channel that functions in synchronization with calcium release from intracellular stores. Opened by a change of voltage within the sarcoplasmic reticulum lumen.

AlphaFold DB , UniProt , Accession A0A060W5L9, Species ONCMY (Oncorhynchus mykiss, Rainbow trout), Gene LOC110524152, Length 294 aa.

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Site Residue pLDDT pLDDT confidence pLDDT10 pLDDT10 confidence SASA SASA [Ų] SASA10 SASA10 [Ų] RSA RSA unformatted RSA10 RSA10 unformatted Surface Surface10 (not used) Disorder (not used) Disorder Sec. str. Secondary structure Isomer Phi (φ) Psi (ψ) Omega (ω) Chi 1 (χ1) Chi 2 (χ2) Chi 3 (χ3) Chi 4 (χ4) Chi 5 (χ5) Tau (τ) Contacts (colored by PAE) Contact details
1M44.5Very low62.1Low222 Ų222104.3 Ų104.3100%1.09457%0.569SS**  0110.70-69.6-173.7-160.300106.3V3M1-V3 PolarHBondContact O-N 3.15Å
2D55.9Low63.5Low101 Ų101102.2 Ų102.254%0.5456%0.561SS.*  trans-67.1123-175-112.5-44.3000109.5L4 E5 V6D2-L4 HydrophobicContact CB-CB 4.44Å; D2-L4 PolarHBondContact O-N 3.23Å; D2-E5 HydrophobicContact CB-CB 4.18Å; D2-E5 HydrophobicContact CB-CG 4.01Å; D2-E5 PolarHBondContact O-N 3.26Å; D2-V6 PolarHBondContact O-N 2.99Å
3V57.7Low64.9Low111 Ų11194.3 Ų94.367%0.67352%0.518SS*.Hα-helixtrans-55.9-25.3176.1-175.30000110.8M1M1-V3 PolarHBondContact O-N 3.15Å
4L54.6Low66Low82 Ų8293.8 Ų93.843%0.42951%0.51SS..Hα-helixtrans-69-35.8173.2-78.9141000114.2D2 L9 T211D2-L4 HydrophobicContact CB-CB 4.44Å; D2-L4 PolarHBondContact O-N 3.23Å; L4-L9 HydrophobicContact CD2-CB 4.4Å; L4-L9 HydrophobicContact CD2-CD2 3.5Å; L4-L9 VanDerWaalsContact CD2-CD2 3.5Å; L4-L9 HydrophobicContact CD2-CG 4.5Å; L4-L9 PolarHBondContact O-N 3.1Å; L4-T211 HydrophobicContact CD2-CG2 4.2Å
5E56.6Low67.1Low152 Ų15294.7 Ų94.771%0.7151%0.514SS*.Hα-helixtrans-75.6-38.6176.2-78.2-173.2141.400111.6D2 L7 N8D2-E5 HydrophobicContact CB-CB 4.18Å; D2-E5 HydrophobicContact CB-CG 4.01Å; D2-E5 PolarHBondContact O-N 3.26Å; E5-L7 PolarHBondContact O-N 3.37Å; E5-N8 PolarHBondContact O-N 3.03Å; E5-N8 VanDerWaalsContact O-N 3.15Å
6V56.6Low68Low113 Ų11391.6 Ų91.669%0.68550%0.495SS*.Hα-helixtrans-63.9-28.7-178.31770000112.5D2D2-V6 PolarHBondContact O-N 2.99Å
7L61.1Low68.6Low120 Ų12088.1 Ų88.163%0.62848%0.479SS*.THydrogen-bonded Turntrans-94.64.5179.5-76.3165.4000114.2E5 L9E5-L7 PolarHBondContact O-N 3.37Å; L7-L9 PolarHBondContact O-N 2.92Å; L7-L9 VanDerWaalsContact O-N 3.1Å
8N69.9Low69.1Low88 Ų8891 Ų9147%0.47149%0.486SS..THydrogen-bonded Turntrans46.937.4-172.1-153.92.3000113E5 G10 D11 V12E5-N8 PolarHBondContact O-N 3.03Å; E5-N8 VanDerWaalsContact O-N 3.15Å; N8-G10 PolarHBondContact O-N 3.3Å; N8-D11 PolarHBondContact ND2-OD2 3.4Å; N8-D11 PolarHBondContact O-N 3.3Å; N8-D11 WeakPolarHBondContact OD1-CB 3.09Å; N8-D11 PolarHBondContact OD1-OD2 3.37Å; N8-V12 PolarHBondContact O-N 3.24Å
9L73.3Confident69.7Low38 Ų3890 Ų9020%0.19948%0.479CS..Hα-helixtrans-67.1-25.9-170.1-164.970.3000111.7L4 L7 A13 L215L4-L9 HydrophobicContact CD2-CB 4.4Å; L4-L9 HydrophobicContact CD2-CD2 3.5Å; L4-L9 VanDerWaalsContact CD2-CD2 3.5Å; L4-L9 HydrophobicContact CD2-CG 4.5Å; L4-L9 PolarHBondContact O-N 3.1Å; L7-L9 PolarHBondContact O-N 2.92Å; L7-L9 VanDerWaalsContact O-N 3.1Å; L9-A13 WeakPolarHBondContact O-CB 3.48Å; L9-A13 PolarHBondContact O-N 2.87Å; L9-L215 HydrophobicContact CD2-CD2 4.04Å
10G73.5Confident70Confident38 Ų3888.3 Ų88.339%0.39248%0.484SS..Hα-helixtrans-60.5-51.217500000112.5N8 A13 Q14N8-G10 PolarHBondContact O-N 3.3Å; G10-A13 PolarHBondContact O-N 3.34Å; G10-Q14 WeakPolarHBondContact O-CB 3.38Å; G10-Q14 PolarHBondContact O-N 3.28Å
11D79.1Confident70.5Confident82 Ų8285.7 Ų85.744%0.43947%0.469SS..Hα-helixtrans-65.6-43.2180-72.4-10.6000111.5N8 Q14 N15N8-D11 PolarHBondContact ND2-OD2 3.4Å; N8-D11 PolarHBondContact O-N 3.3Å; N8-D11 WeakPolarHBondContact OD1-CB 3.09Å; N8-D11 PolarHBondContact OD1-OD2 3.37Å; D11-Q14 PolarHBondContact O-N 2.88Å; D11-N15 WeakPolarHBondContact O-CB 3.39Å; D11-N15 PolarHBondContact O-N 3.22Å; D11-N15 PolarHBondContact O-ND2 2.83Å
12V79.8Confident72.1Confident79 Ų7979.8 Ų79.848%0.47944%0.437SS..Hα-helixtrans-61.6-46.9176.1175.50000110.6N8 Q14 N15 F16N8-V12 PolarHBondContact O-N 3.24Å; V12-Q14 VanDerWaalsContact C-N 3.32Å; V12-Q14 PolarHBondContact O-N 3.34Å; V12-N15 PolarHBondContact O-N 3.34Å; V12-F16 WeakPolarHBondContact O-CB 3.18Å; V12-F16 PolarHBondContact O-N 3.44Å
13A80.6Confident73.3Confident0 Ų078.2 Ų78.20%043%0.433CS..Hα-helixtrans-64.1-38.4178.800000111.9L9 G10 F16 S17 C214L9-A13 WeakPolarHBondContact O-CB 3.48Å; L9-A13 PolarHBondContact O-N 2.87Å; G10-A13 PolarHBondContact O-N 3.34Å; A13-F16 PolarHBondContact O-N 2.9Å; A13-S17 WeakPolarHBondContact O-CB 3.47Å; A13-S17 PolarHBondContact O-N 2.9Å; A13-S17 PolarHBondContact O-OG 2.76Å; A13-C214 HydrophobicContact CB-CB 3.71Å
14Q81.6Confident74.7Confident87 Ų8777.2 Ų77.241%0.40743%0.427SS..Hα-helixtrans-66.3-47.6177.9-163.3-178.413.900111.1G10 D11 V12 F16 S17 K18G10-Q14 WeakPolarHBondContact O-CB 3.38Å; G10-Q14 PolarHBondContact O-N 3.28Å; D11-Q14 PolarHBondContact O-N 2.88Å; V12-Q14 VanDerWaalsContact C-N 3.32Å; V12-Q14 PolarHBondContact O-N 3.34Å; Q14-F16 VanDerWaalsContact C-N 3.33Å; Q14-F16 PolarHBondContact O-N 3.21Å; Q14-S17 PolarHBondContact O-N 3.4Å; Q14-S17 PolarHBondContact O-OG 3.42Å; Q14-K18 WeakPolarHBondContact O-CG 3.35Å; Q14-K18 PolarHBondContact O-N 2.95Å
15N81.2Confident76.4Confident107 Ų10774.4 Ų74.457%0.57241%0.411SS*.Hα-helixtrans-61.6-43.1174.9-72.5-24.2000111.5D11 V12 S17 K18 M19D11-N15 WeakPolarHBondContact O-CB 3.39Å; D11-N15 PolarHBondContact O-N 3.22Å; D11-N15 PolarHBondContact O-ND2 2.83Å; V12-N15 PolarHBondContact O-N 3.34Å; N15-S17 VanDerWaalsContact C-N 3.33Å; N15-S17 PolarHBondContact O-N 3.48Å; N15-K18 PolarHBondContact O-N 2.77Å; N15-M19 PolarHBondContact O-N 3.45Å
16F82.3Confident78Confident46 Ų4667.7 Ų67.720%0.20238%0.38CS..Hα-helixtrans-61.1-41.5178.3-177-96.2000112.3V12 A13 Q14 K18 M19 V124 R128 I213 T217V12-F16 WeakPolarHBondContact O-CB 3.18Å; V12-F16 PolarHBondContact O-N 3.44Å; A13-F16 PolarHBondContact O-N 2.9Å; Q14-F16 VanDerWaalsContact C-N 3.33Å; Q14-F16 PolarHBondContact O-N 3.21Å; F16-K18 VanDerWaalsContact C-N 3.31Å; F16-K18 PolarHBondContact O-N 3.12Å; F16-M19 HydrophobicContact CB-CE 4.48Å; F16-M19 HydrophobicContact CD2-CE 3.24Å; F16-M19 HydrophobicContact CE2-CE 3.46Å; F16-M19 VanDerWaalsContact CE2-CE 3.46Å; F16-M19 HydrophobicContact CG-CE 3.97Å; F16-M19 HydrophobicContact CZ-CE 4.34Å; F16-V124 HydrophobicContact CE1-CG1 4.19Å; F16-V124 HydrophobicContact CE2-CG1 4.42Å; F16-V124 HydrophobicContact CZ-CB 4.4Å; F16-V124 HydrophobicContact CZ-CG1 3.61Å; F16-V124 HydrophobicContact CZ-CG2 4Å; F16-R128 PolarHBondContact O-NH2 3.03Å; F16-I213 HydrophobicContact CD1-CG2 4.45Å; F16-I213 HydrophobicContact CE1-CG2 4.32Å; F16-T217 HydrophobicContact CE1-CG2 4Å; F16-T217 HydrophobicContact CZ-CG2 3.66Å
17S77.7Confident79.8Confident32 Ų3265.5 Ų65.522%0.22436%0.364CS..Hα-helixtrans-67.7-29.717973.20000113.2A13 Q14 N15 R128 T210A13-S17 WeakPolarHBondContact O-CB 3.47Å; A13-S17 PolarHBondContact O-N 2.9Å; A13-S17 PolarHBondContact O-OG 2.76Å; Q14-S17 PolarHBondContact O-N 3.4Å; Q14-S17 PolarHBondContact O-OG 3.42Å; N15-S17 VanDerWaalsContact C-N 3.33Å; N15-S17 PolarHBondContact O-N 3.48Å; S17-R128 PolarHBondContact O-NH2 3.39Å; S17-T210 WeakPolarHBondContact OG-CG2 3.36Å
18K78.6Confident81.4Confident140 Ų14059.9 Ų59.961%0.60934%0.335SS*.Hα-helixtrans-84.3-13.3-177.7-71.6175.3-177.9172.20114.3Q14 N15 F16 G20Q14-K18 WeakPolarHBondContact O-CG 3.35Å; Q14-K18 PolarHBondContact O-N 2.95Å; N15-K18 PolarHBondContact O-N 2.77Å; F16-K18 VanDerWaalsContact C-N 3.31Å; F16-K18 PolarHBondContact O-N 3.12Å; K18-G20 PolarHBondContact O-N 3.35Å
19M78.9Confident82.6Confident72 Ų7256.4 Ų56.436%0.35532%0.315SS..SBendtrans-57.7133.9-179.8-67.9-170.7-62.800111.3N15 F16 F25 R128N15-M19 PolarHBondContact O-N 3.45Å; F16-M19 HydrophobicContact CB-CE 4.48Å; F16-M19 HydrophobicContact CD2-CE 3.24Å; F16-M19 HydrophobicContact CE2-CE 3.46Å; F16-M19 VanDerWaalsContact CE2-CE 3.46Å; F16-M19 HydrophobicContact CG-CE 3.97Å; F16-M19 HydrophobicContact CZ-CE 4.34Å; M19-F25 HydrophobicContact CB-CE2 4.39Å; M19-F25 HydrophobicContact CE-CZ 3.8Å; M19-F25 HydrophobicContact SD-CZ 4.26Å; M19-R128 VanDerWaalsContact O-CZ 3.26Å; M19-R128 PolarHBondContact O-NH1 2.95Å; M19-R128 PolarHBondContact O-NH2 2.91Å
20G75.7Confident83.7Confident56 Ų5654.7 Ų54.758%0.57731%0.306SS*.  trans-66.1135.8175.500000111.8K18 F25K18-G20 PolarHBondContact O-N 3.35Å; G20-F25 VanDerWaalsContact O-CD2 3.3Å; G20-F25 WeakPolarHBondContact O-CD2 3.49Å
21M80.4Confident84.9Confident34 Ų3453.4 Ų53.417%0.16729%0.29CS..  trans-78.4-42.8179.2-66-56.5-72.800112.4V24 F25 D26 V125 R128M21-V24 PolarHBondContact O-N 2.98Å; M21-F25 HydrophobicContact CE-CB 3.61Å; M21-F25 HydrophobicContact CE-CG 4.14Å; M21-F25 WeakPolarHBondContact O-CB 3.38Å; M21-F25 PolarHBondContact O-N 2.89Å; M21-F25 HydrophobicContact SD-CB 4.03Å; M21-F25 HydrophobicContact SD-CD2 4.25Å; M21-F25 HydrophobicContact SD-CG 4.05Å; M21-D26 PolarHBondContact O-N 3.21Å; M21-V125 HydrophobicContact CE-CB 3.61Å; M21-V125 HydrophobicContact CE-CG1 3.88Å; M21-V125 HydrophobicContact CE-CG2 3.22Å; M21-R128 VanDerWaalsContact CG-NH1 3.3Å; M21-R128 WeakPolarHBondContact SD-CD 3.47Å; M21-R128 PolarHBondContact SD-NH1 3.2Å
22F78.6Confident85.7Confident97 Ų9749.7 Ų49.743%0.42527%0.271SS..THydrogen-bonded Turntrans-86.8137.4177.1-173-94.2000110.2H86 L89F22-H86 AromaticContact CD2-CE1 3.46Å; F22-H86 VanDerWaalsContact CD2-CE1 3.46Å; F22-H86 WeakPolarHBondContact CD2-CE1 3.46Å; F22-H86 AromaticContact CD2-ND1 3.95Å; F22-H86 AromaticContact CD2-NE2 3.72Å; F22-L89 HydrophobicContact CE2-CD2 3.88Å
23P81.3Confident86.4Confident69 Ų6946 Ų4645%0.44825%0.248SC..THydrogen-bonded Turncis-92.8-18.8-133.7-33.7000114.6L27P23-L27 WeakPolarHBondContact O-CB 3.25Å; P23-L27 PolarHBondContact O-N 2.91Å
24V87.3Confident87.2Confident89 Ų8946 Ų4654%0.53925%0.248SC..Hα-helixtrans-70.3-45.2-162.1-179.40000113.3M21 A28M21-V24 PolarHBondContact O-N 2.98Å; V24-A28 PolarHBondContact O-N 3.43Å
25F90.1Very high87.9Confident24 Ų2442 Ų4211%0.10523%0.23CC..Hα-helixtrans-73.5-39.3-178.5-67.2-92.7000111.3M19 G20 M21 A28 Y29 L121 V124 V125M19-F25 HydrophobicContact CB-CE2 4.39Å; M19-F25 HydrophobicContact CE-CZ 3.8Å; M19-F25 HydrophobicContact SD-CZ 4.26Å; G20-F25 VanDerWaalsContact O-CD2 3.3Å; G20-F25 WeakPolarHBondContact O-CD2 3.49Å; M21-F25 HydrophobicContact CE-CB 3.61Å; M21-F25 HydrophobicContact CE-CG 4.14Å; M21-F25 WeakPolarHBondContact O-CB 3.38Å; M21-F25 PolarHBondContact O-N 2.89Å; M21-F25 HydrophobicContact SD-CB 4.03Å; M21-F25 HydrophobicContact SD-CD2 4.25Å; M21-F25 HydrophobicContact SD-CG 4.05Å; F25-A28 PolarHBondContact O-N 3.42Å; F25-Y29 PolarHBondContact O-N 3.27Å; F25-L121 HydrophobicContact CD1-CB 4.34Å; F25-L121 HydrophobicContact CD1-CD2 3.72Å; F25-L121 HydrophobicContact CE1-CD2 3.48Å; F25-L121 VanDerWaalsContact CE1-CD2 3.48Å; F25-L121 HydrophobicContact CZ-CD2 4.29Å; F25-V124 HydrophobicContact CD1-CB 3.97Å; F25-V124 HydrophobicContact CD1-CG1 3.98Å; F25-V124 HydrophobicContact CD1-CG2 4.37Å; F25-V124 HydrophobicContact CE1-CB 4.06Å; F25-V124 HydrophobicContact CE1-CG1 3.86Å; F25-V124 HydrophobicContact CE1-CG2 4.08Å; F25-V125 HydrophobicContact CB-CG2 3.7Å; F25-V125 WeakPolarHBondContact O-CG2 3.36Å
26D90.8Very high88.5Confident10 Ų1040.7 Ų40.75%0.05322%0.217CC..Hα-helixtrans-67.1-38.4177.1-68.7-25.1000111.9M21 A28 Y29 Y30 H86M21-D26 PolarHBondContact O-N 3.21Å; D26-A28 VanDerWaalsContact C-N 3.34Å; D26-A28 PolarHBondContact O-N 3.09Å; D26-Y29 WeakPolarHBondContact O-CB 3.46Å; D26-Y29 PolarHBondContact O-N 3.45Å; D26-Y30 HydrophobicContact CB-CE2 4.05Å; D26-Y30 WeakPolarHBondContact O-CD2 3.16Å; D26-Y30 PolarHBondContact O-N 3.5Å; D26-H86 IonicContact OD2-CE1 2.58Å; D26-H86 PolarHBondContact OD2-CE1 3.39Å; D26-H86 IonicContact OD2-ND1 2.76Å
27L94.1Very high89.1Confident67 Ų6738.6 Ų38.635%0.35121%0.208SC..Hα-helixtrans-54.9-49.7170.9175.862.7000111P23 Y29 Y30 I31 L89 I93P23-L27 WeakPolarHBondContact O-CB 3.25Å; P23-L27 PolarHBondContact O-N 2.91Å; L27-Y29 PolarHBondContact O-N 2.99Å; L27-Y30 PolarHBondContact O-N 2.84Å; L27-I31 HydrophobicContact CD1-CD1 3.83Å; L27-I31 HydrophobicContact CD1-CG1 4.25Å; L27-I31 HydrophobicContact CG-CD1 3.86Å; L27-I31 VanDerWaalsContact O-CG1 3.24Å; L27-I31 WeakPolarHBondContact O-CG1 3.25Å; L27-I31 PolarHBondContact O-N 3.37Å; L27-L89 HydrophobicContact CB-CD2 4.46Å; L27-L89 HydrophobicContact CD1-CD1 4.15Å; L27-I93 HydrophobicContact CD1-CD1 3.44Å; L27-I93 VanDerWaalsContact CD1-CD1 3.44Å; L27-I93 HydrophobicContact CD1-CG1 3.9Å
28A94.7Very high89.9Confident2 Ų238.4 Ų38.42%0.01720%0.203CC..Hα-helixtrans-63.4-41.6178.400000112.2V24 F25 D26 I31 V32 L118 L121V24-A28 PolarHBondContact O-N 3.43Å; F25-A28 PolarHBondContact O-N 3.42Å; D26-A28 VanDerWaalsContact C-N 3.34Å; D26-A28 PolarHBondContact O-N 3.09Å; A28-I31 PolarHBondContact O-N 3.45Å; A28-V32 WeakPolarHBondContact O-CG2 3.17Å; A28-V32 PolarHBondContact O-N 3.2Å; A28-L118 HydrophobicContact CB-CD2 3.73Å; A28-L121 HydrophobicContact CB-CB 3.57Å; A28-L121 HydrophobicContact CB-CD1 3.79Å; A28-L121 HydrophobicContact CB-CG 4.35Å
29Y95.6Very high90.6Very high15 Ų1535.9 Ų35.96%0.05919%0.191CC..Hα-helixtrans-57.9-50.1175.5-177.4-89.1000111.7F25 D26 L27 V32 S33 C62 K122 V125 K129F25-Y29 PolarHBondContact O-N 3.27Å; D26-Y29 WeakPolarHBondContact O-CB 3.46Å; D26-Y29 PolarHBondContact O-N 3.45Å; L27-Y29 PolarHBondContact O-N 2.99Å; Y29-V32 PolarHBondContact O-N 3.25Å; Y29-S33 VanDerWaalsContact O-CB 3.28Å; Y29-S33 WeakPolarHBondContact O-CB 3.22Å; Y29-S33 PolarHBondContact O-N 3.3Å; Y29-S33 PolarHBondContact O-OG 2.84Å; Y29-C62 VanDerWaalsContact CE1-O 3.3Å; Y29-C62 WeakPolarHBondContact CE1-O 3.43Å; Y29-K122 HydrophobicContact CD2-CD 4.38Å; Y29-K122 HydrophobicContact CD2-CG 3.8Å; Y29-K122 HydrophobicContact CE2-CG 4.31Å; Y29-V125 HydrophobicContact CD2-CB 3.82Å; Y29-V125 HydrophobicContact CD2-CG1 3.69Å; Y29-V125 HydrophobicContact CD2-CG2 4.42Å; Y29-V125 HydrophobicContact CE2-CG1 4.27Å; Y29-V125 HydrophobicContact CG-CB 4.36Å; Y29-V125 HydrophobicContact CG-CG1 4.01Å; Y29-K129 PolarHBondContact OH-NZ 3.3Å
30Y96.8Very high91.3Very high3 Ų335.3 Ų35.31%0.01219%0.187CC..Hα-helixtrans-64.6-44.7179.6-60-29.6000112.1D26 L27 V32 S33 I34 C62 F63 H86 L89 A90 I93D26-Y30 HydrophobicContact CB-CE2 4.05Å; D26-Y30 WeakPolarHBondContact O-CD2 3.16Å; D26-Y30 PolarHBondContact O-N 3.5Å; L27-Y30 PolarHBondContact O-N 2.84Å; Y30-V32 PolarHBondContact O-N 2.96Å; Y30-S33 PolarHBondContact O-N 2.95Å; Y30-I34 WeakPolarHBondContact O-CB 3.21Å; Y30-I34 VanDerWaalsContact O-CG1 3.24Å; Y30-I34 WeakPolarHBondContact O-CG1 3.42Å; Y30-I34 PolarHBondContact O-N 3.02Å; Y30-C62 HydrophobicContact CD1-CB 3.64Å; Y30-C62 HydrophobicContact CE1-CB 3.92Å; Y30-F63 AromaticContact CE1-CE1 3.78Å; Y30-F63 HydrophobicContact CE1-CE1 3.78Å; Y30-F63 HydrophobicContact CE1-CZ 4.02Å; Y30-F63 AromaticContact CZ-CE1 3.84Å; Y30-F63 WeakPolarHBondContact OH-CE1 3.21Å; Y30-H86 WeakPolarHBondContact OH-CB 3.24Å; Y30-H86 PolarHBondContact OH-ND1 3.48Å; Y30-L89 HydrophobicContact CD2-CB 4.49Å; Y30-L89 HydrophobicContact CD2-CD2 4.14Å; Y30-L89 HydrophobicContact CD2-CG 4.06Å; Y30-L89 HydrophobicContact CE2-CB 4.31Å; Y30-L89 HydrophobicContact CE2-CD2 4.01Å; Y30-L89 HydrophobicContact CE2-CG 4.2Å; Y30-A90 HydrophobicContact CD1-CB 4.34Å; Y30-A90 HydrophobicContact CD2-CB 4.07Å; Y30-A90 HydrophobicContact CE2-CB 4.27Å; Y30-A90 HydrophobicContact CG-CB 4.12Å; Y30-I93 VanDerWaalsContact CB-CD1 3.43Å; Y30-I93 HydrophobicContact CD2-CD1 3.85Å; Y30-I93 HydrophobicContact CG-CD1 4.15Å
31I97.1Very high91.9Very high11 Ų1136.4 Ų36.46%0.05618%0.184CC..Hα-helixtrans-55.8-52.7176.8-70.1166.4000110.1L27 A28 S33 I34 L35 I93 F105 V109 L118L27-I31 HydrophobicContact CD1-CD1 3.83Å; L27-I31 HydrophobicContact CD1-CG1 4.25Å; L27-I31 HydrophobicContact CG-CD1 3.86Å; L27-I31 VanDerWaalsContact O-CG1 3.24Å; L27-I31 WeakPolarHBondContact O-CG1 3.25Å; L27-I31 PolarHBondContact O-N 3.37Å; A28-I31 PolarHBondContact O-N 3.45Å; I31-S33 PolarHBondContact O-N 3.18Å; I31-I34 PolarHBondContact O-N 2.7Å; I31-L35 HydrophobicContact CG2-CD1 3.92Å; I31-L35 HydrophobicContact CG2-CG 4.33Å; I31-L35 WeakPolarHBondContact O-CB 3.21Å; I31-L35 VanDerWaalsContact O-CG 3.24Å; I31-L35 WeakPolarHBondContact O-CG 3.41Å; I31-L35 PolarHBondContact O-N 2.64Å; I31-I93 HydrophobicContact CB-CG2 4.33Å; I31-I93 HydrophobicContact CG1-CD1 4.26Å; I31-I93 HydrophobicContact CG1-CG1 4.34Å; I31-I93 HydrophobicContact CG1-CG2 3.7Å; I31-F105 HydrophobicContact CD1-CZ 4.16Å; I31-F105 HydrophobicContact CG1-CE1 4.47Å; I31-F105 HydrophobicContact CG1-CZ 4.17Å; I31-V109 HydrophobicContact CD1-CG1 4.41Å; I31-V109 HydrophobicContact CG2-CB 3.76Å; I31-V109 HydrophobicContact CG2-CG1 3.85Å; I31-V109 HydrophobicContact CG2-CG2 3.95Å; I31-L118 HydrophobicContact CD1-CD2 4.31Å; I31-L118 HydrophobicContact CG2-CD1 3.81Å
32V96.4Very high92.4Very high4 Ų436.8 Ų36.82%0.02420%0.196CC..Hα-helixtrans-67.1-41.5-176.5175.90000111.2A28 Y29 Y30 L35 Y36 L118 V119 K122A28-V32 WeakPolarHBondContact O-CG2 3.17Å; A28-V32 PolarHBondContact O-N 3.2Å; Y29-V32 PolarHBondContact O-N 3.25Å; Y30-V32 PolarHBondContact O-N 2.96Å; V32-L35 PolarHBondContact O-N 2.94Å; V32-Y36 HydrophobicContact CG1-CD2 3.74Å; V32-Y36 HydrophobicContact CG1-CE2 3.45Å; V32-Y36 VanDerWaalsContact CG1-CE2 3.45Å; V32-Y36 WeakPolarHBondContact O-CD2 3.32Å; V32-Y36 PolarHBondContact O-N 3.26Å; V32-L118 HydrophobicContact CG2-CB 3.55Å; V32-V119 HydrophobicContact CG1-CG2 4.2Å; V32-V119 HydrophobicContact CG2-CG2 4.39Å; V32-K122 HydrophobicContact CB-CB 4.48Å; V32-K122 HydrophobicContact CB-CD 3.73Å; V32-K122 HydrophobicContact CG1-CD 3.43Å; V32-K122 VanDerWaalsContact CG1-CD 3.43Å
33S95.8Very high93Very high2 Ų232.3 Ų32.31%0.01418%0.177CC..Hα-helixtrans-62.4-42.3177.7-66.50000112.5Y29 Y30 I31 Y36 L37 Y61 K122Y29-S33 VanDerWaalsContact O-CB 3.28Å; Y29-S33 WeakPolarHBondContact O-CB 3.22Å; Y29-S33 PolarHBondContact O-N 3.3Å; Y29-S33 PolarHBondContact O-OG 2.84Å; Y30-S33 PolarHBondContact O-N 2.95Å; I31-S33 PolarHBondContact O-N 3.18Å; S33-Y36 WeakPolarHBondContact O-CB 3.31Å; S33-Y36 PolarHBondContact O-N 2.9Å; S33-L37 PolarHBondContact O-N 3.42Å; S33-L37 VanDerWaalsContact O-N 3.11Å; S33-Y61 VanDerWaalsContact O-CD1 3.23Å; S33-Y61 WeakPolarHBondContact O-CD1 3.3Å; S33-K122 PolarHBondContact OG-NZ 3.32Å
34I96.8Very high93.6Very high0 Ų031.6 Ų31.60%017%0.171CC..Hα-helixtrans-73.2-32.6177.7-65.6168.2000111.3Y30 I31 Y36 L37 K38 A58 A90 I93 W94 V97 F98Y30-I34 WeakPolarHBondContact O-CB 3.21Å; Y30-I34 VanDerWaalsContact O-CG1 3.24Å; Y30-I34 WeakPolarHBondContact O-CG1 3.42Å; Y30-I34 PolarHBondContact O-N 3.02Å; I31-I34 PolarHBondContact O-N 2.7Å; I34-Y36 VanDerWaalsContact C-N 3.32Å; I34-L37 WeakPolarHBondContact O-CB 3.46Å; I34-L37 PolarHBondContact O-N 2.93Å; I34-K38 PolarHBondContact O-N 3.47Å; I34-A58 HydrophobicContact CG1-CB 4.22Å; I34-A90 WeakPolarHBondContact CD1-O 3.31Å; I34-I93 HydrophobicContact CD1-CB 4.03Å; I34-I93 HydrophobicContact CD1-CG2 3.74Å; I34-W94 HydrophobicContact CD1-CB 3.99Å; I34-V97 HydrophobicContact CG2-CB 3.83Å; I34-V97 HydrophobicContact CG2-CG1 3.89Å; I34-V97 HydrophobicContact CG2-CG2 4.01Å; I34-F98 HydrophobicContact CG2-CD2 4.35Å; I34-F98 HydrophobicContact CG2-CE2 3.94Å
35L95.8Very high93.9Very high3 Ų332.4 Ų32.42%0.01617%0.169CC..Hα-helixtrans-60.5-42.8170.1-78.5175.2000111.5I31 V32 K38 Y39 V97 Y106 V109I31-L35 HydrophobicContact CG2-CD1 3.92Å; I31-L35 HydrophobicContact CG2-CG 4.33Å; I31-L35 WeakPolarHBondContact O-CB 3.21Å; I31-L35 VanDerWaalsContact O-CG 3.24Å; I31-L35 WeakPolarHBondContact O-CG 3.41Å; I31-L35 PolarHBondContact O-N 2.64Å; V32-L35 PolarHBondContact O-N 2.94Å; L35-K38 PolarHBondContact O-N 2.93Å; L35-Y39 HydrophobicContact CB-CE2 4.21Å; L35-Y39 WeakPolarHBondContact O-CD2 3.28Å; L35-Y39 WeakPolarHBondContact O-CE2 3.38Å; L35-Y39 VanDerWaalsContact O-CG 3.29Å; L35-Y39 PolarHBondContact O-N 3.26Å; L35-Y39 VanDerWaalsContact O-N 3.08Å; L35-V97 HydrophobicContact CD2-CG1 4.32Å; L35-Y106 HydrophobicContact CD2-CD2 3.51Å; L35-Y106 HydrophobicContact CD2-CE2 3.8Å; L35-V109 HydrophobicContact CD1-CB 4.21Å; L35-V109 HydrophobicContact CD1-CG2 3.73Å; L35-V109 HydrophobicContact CD2-CG2 3.84Å; L35-V109 HydrophobicContact CG-CG2 4.1Å
36Y93.3Very high94Very high78 Ų7832.6 Ų32.631%0.30617%0.172SC..Hα-helixtrans-60.2-45.2173.8-81.9-68.9000111.5V32 S33 I34 K38 Y39 E40V32-Y36 HydrophobicContact CG1-CD2 3.74Å; V32-Y36 HydrophobicContact CG1-CE2 3.45Å; V32-Y36 VanDerWaalsContact CG1-CE2 3.45Å; V32-Y36 WeakPolarHBondContact O-CD2 3.32Å; V32-Y36 PolarHBondContact O-N 3.26Å; S33-Y36 WeakPolarHBondContact O-CB 3.31Å; S33-Y36 PolarHBondContact O-N 2.9Å; I34-Y36 VanDerWaalsContact C-N 3.32Å; Y36-K38 VanDerWaalsContact C-N 3.29Å; Y36-K38 PolarHBondContact O-N 2.97Å; Y36-Y39 HydrophobicContact CD1-CD2 4.31Å; Y36-Y39 PolarHBondContact O-N 3.39Å; Y36-Y39 VanDerWaalsContact O-N 3.09Å; Y36-E40 PolarHBondContact O-N 3.4Å
37L95.3Very high94.2Very high3 Ų332.2 Ų32.22%0.01617%0.171CC..Hα-helixtrans-56.8-42.1173172.862.8000112.1S33 I34 Y39 E40 S43 C57 A58 Y61 F98S33-L37 PolarHBondContact O-N 3.42Å; S33-L37 VanDerWaalsContact O-N 3.11Å; I34-L37 WeakPolarHBondContact O-CB 3.46Å; I34-L37 PolarHBondContact O-N 2.93Å; L37-Y39 VanDerWaalsContact C-N 3.26Å; L37-Y39 PolarHBondContact O-N 2.89Å; L37-E40 VanDerWaalsContact O-CB 3.28Å; L37-E40 WeakPolarHBondContact O-CB 3.27Å; L37-E40 PolarHBondContact O-N 2.67Å; L37-E40 VanDerWaalsContact O-N 3.12Å; L37-S43 WeakPolarHBondContact O-CB 3.35Å; L37-S43 PolarHBondContact O-OG 3.5Å; L37-S43 VanDerWaalsContact O-OG 3.08Å; L37-C57 HydrophobicContact CD1-CB 3.98Å; L37-C57 HydrophobicContact CD2-CB 3.96Å; L37-A58 HydrophobicContact CD2-CB 3.82Å; L37-Y61 HydrophobicContact CB-CD1 4.24Å; L37-Y61 HydrophobicContact CB-CD2 4Å; L37-Y61 HydrophobicContact CB-CE1 4.25Å; L37-Y61 HydrophobicContact CB-CE2 3.98Å; L37-Y61 HydrophobicContact CB-CG 4.12Å; L37-Y61 HydrophobicContact CD1-CD2 4.1Å; L37-Y61 HydrophobicContact CD1-CE2 3.69Å; L37-Y61 HydrophobicContact CD2-CD2 4.44Å; L37-Y61 HydrophobicContact CG-CD2 4.4Å; L37-Y61 HydrophobicContact CG-CE2 4.34Å; L37-F98 HydrophobicContact CD2-CE2 4.33Å; L37-F98 HydrophobicContact CD2-CZ 4.37Å; L37-F98 HydrophobicContact CG-CZ 4.23Å
38K95.3Very high94.2Very high28 Ų2838.4 Ų38.412%0.12219%0.189CC..Hα-helixtrans-67-24.4178.4-179.4163.4171.3163.50113.4I34 L35 Y36 E40 S43 V44 V97 F98 N103 Y106I34-K38 PolarHBondContact O-N 3.47Å; L35-K38 PolarHBondContact O-N 2.93Å; Y36-K38 VanDerWaalsContact C-N 3.29Å; Y36-K38 PolarHBondContact O-N 2.97Å; K38-E40 VanDerWaalsContact C-N 3.29Å; K38-S43 PolarHBondContact O-OG 3.38Å; K38-S43 VanDerWaalsContact O-OG 3.1Å; K38-V44 HydrophobicContact CG-CG2 4.21Å; K38-V97 HydrophobicContact CB-CG1 4.23Å; K38-V97 HydrophobicContact CD-CG1 3.52Å; K38-V97 PolarHBondContact NZ-O 2.9Å; K38-F98 HydrophobicContact CB-CE1 4.23Å; K38-F98 HydrophobicContact CB-CE2 4.4Å; K38-F98 HydrophobicContact CB-CZ 3.85Å; K38-F98 HydrophobicContact CD-CE1 4.5Å; K38-F98 HydrophobicContact CG-CE1 4.25Å; K38-F98 HydrophobicContact CG-CZ 4.38Å; K38-N103 PolarHBondContact NZ-OD1 3.26Å; K38-Y106 HydrophobicContact CD-CD2 3.89Å; K38-Y106 HydrophobicContact CD-CE2 4.2Å
39Y93.4Very high94.2Very high87 Ų8745.5 Ų45.534%0.34122%0.22SC..Hα-helixtrans-77.4-16.8173.9-59.4-39.3000113L35 Y36 L37 Y106 K115L35-Y39 HydrophobicContact CB-CE2 4.21Å; L35-Y39 WeakPolarHBondContact O-CD2 3.28Å; L35-Y39 WeakPolarHBondContact O-CE2 3.38Å; L35-Y39 VanDerWaalsContact O-CG 3.29Å; L35-Y39 PolarHBondContact O-N 3.26Å; L35-Y39 VanDerWaalsContact O-N 3.08Å; Y36-Y39 HydrophobicContact CD1-CD2 4.31Å; Y36-Y39 PolarHBondContact O-N 3.39Å; Y36-Y39 VanDerWaalsContact O-N 3.09Å; L37-Y39 VanDerWaalsContact C-N 3.26Å; L37-Y39 PolarHBondContact O-N 2.89Å; Y39-Y106 AromaticContact CE1-CE2 3.9Å; Y39-Y106 HydrophobicContact CE1-CE2 3.9Å; Y39-K115 PolarHBondContact OH-NZ 3.01Å
40E92.2Very high94.2Very high60 Ų6047.8 Ų47.828%0.2824%0.238SC..SBendtrans-67138.5178.6-66.3-77.4146.100110.9Y36 L37 K38 G42 S43 Y61 R170Y36-E40 PolarHBondContact O-N 3.4Å; L37-E40 VanDerWaalsContact O-CB 3.28Å; L37-E40 WeakPolarHBondContact O-CB 3.27Å; L37-E40 PolarHBondContact O-N 2.67Å; L37-E40 VanDerWaalsContact O-N 3.12Å; K38-E40 VanDerWaalsContact C-N 3.29Å; E40-G42 PolarHBondContact O-N 3.46Å; E40-S43 VanDerWaalsContact O-CB 3.24Å; E40-S43 WeakPolarHBondContact O-CB 3.39Å; E40-S43 PolarHBondContact O-N 2.98Å; E40-S43 VanDerWaalsContact O-N 3.17Å; E40-S43 PolarHBondContact O-OG 3.22Å; E40-Y61 WeakPolarHBondContact CG-OH 3.07Å; E40-R170 VanDerWaalsContact CG-NH1 3.28Å; E40-R170 IonicContact OE2-CZ 3.62Å; E40-R170 IonicContact OE2-NH1 3.6Å; E40-R170 IonicContact OE2-NH2 2.74Å; E40-R170 PolarHBondContact OE2-NH2 2.85Å
41P89.4Confident94.1Very high78 Ų7850.4 Ų50.451%0.50626%0.255SS..THydrogen-bonded Turntrans-62.4133.7-177.926.2-33.7000110.7S43P41-S43 PolarHBondContact O-N 3.13Å
42G89.7Confident94.1Very high42 Ų4255.4 Ų55.443%0.43329%0.286SS..THydrogen-bonded Turntrans79-8.9-179.100000115.2E40 V44 E45 V46E40-G42 PolarHBondContact O-N 3.46Å; G42-V44 VanDerWaalsContact C-N 3.33Å; G42-V44 PolarHBondContact O-N 3.13Å; G42-E45 WeakPolarHBondContact O-CB 3.3Å; G42-E45 PolarHBondContact O-N 3.06Å; G42-E45 VanDerWaalsContact O-N 3.07Å; G42-V46 WeakPolarHBondContact O-CG2 3.38Å; G42-V46 PolarHBondContact O-N 2.92Å
43S92.2Very high94Very high3 Ų356.4 Ų56.42%0.02130%0.295CS..Hα-helixtrans-57.9-40.9-178.262.90000113.6L37 K38 E40 P41 E45 V46 A47L37-S43 WeakPolarHBondContact O-CB 3.35Å; L37-S43 PolarHBondContact O-OG 3.5Å; L37-S43 VanDerWaalsContact O-OG 3.08Å; K38-S43 PolarHBondContact O-OG 3.38Å; K38-S43 VanDerWaalsContact O-OG 3.1Å; E40-S43 VanDerWaalsContact O-CB 3.24Å; E40-S43 WeakPolarHBondContact O-CB 3.39Å; E40-S43 PolarHBondContact O-N 2.98Å; E40-S43 VanDerWaalsContact O-N 3.17Å; E40-S43 PolarHBondContact O-OG 3.22Å; P41-S43 PolarHBondContact O-N 3.13Å; S43-E45 VanDerWaalsContact C-N 3.33Å; S43-V46 PolarHBondContact O-N 3.33Å; S43-A47 PolarHBondContact O-N 2.95Å
44V93.6Very high94Very high54 Ų5456.5 Ų56.533%0.32730%0.295SS..Hα-helixtrans-67.7-34.8178.3178.60000111.5K38 G42 R48 F98K38-V44 HydrophobicContact CG-CG2 4.21Å; G42-V44 VanDerWaalsContact C-N 3.33Å; G42-V44 PolarHBondContact O-N 3.13Å; V44-R48 PolarHBondContact O-N 3.12Å; V44-F98 HydrophobicContact CG2-CE1 4.42Å
45E93.3Very high94Very high106 Ų10660 Ų6050%0.49531%0.309SS..Hα-helixtrans-70.2-44.8176.3-176.3177178.800110.9G42 S43 A47 R48 K49G42-E45 WeakPolarHBondContact O-CB 3.3Å; G42-E45 PolarHBondContact O-N 3.06Å; G42-E45 VanDerWaalsContact O-N 3.07Å; S43-E45 VanDerWaalsContact C-N 3.33Å; E45-A47 VanDerWaalsContact C-N 3.29Å; E45-A47 PolarHBondContact O-N 3.06Å; E45-R48 PolarHBondContact O-N 3.42Å; E45-R48 VanDerWaalsContact O-N 3.09Å; E45-K49 HydrophobicContact CG-CD 3.9Å; E45-K49 HydrophobicContact CG-CG 4.36Å; E45-K49 PolarHBondContact O-N 3.23Å; E45-K49 VanDerWaalsContact OE1-CE 3.24Å; E45-K49 WeakPolarHBondContact OE1-CE 3.29Å; E45-K49 IonicContact OE1-NZ 2.62Å; E45-K49 PolarHBondContact OE1-NZ 3.23Å
46V93.2Very high94Very high28 Ų2863.2 Ų63.217%0.1733%0.325CS..Hα-helixtrans-58.1-42.2173.7175.90000110.6G42 S43 R48 K49 S50 A53G42-V46 WeakPolarHBondContact O-CG2 3.38Å; G42-V46 PolarHBondContact O-N 2.92Å; S43-V46 PolarHBondContact O-N 3.33Å; V46-R48 VanDerWaalsContact C-N 3.25Å; V46-R48 PolarHBondContact O-N 2.77Å; V46-K49 PolarHBondContact O-N 2.69Å; V46-S50 CarbonylContact O-C 3.07Å; V46-S50 VanDerWaalsContact O-CA 3.28Å; V46-S50 WeakPolarHBondContact O-CA 3.32Å; V46-S50 PolarHBondContact O-N 3.16Å; V46-S50 VanDerWaalsContact O-O 3.05Å; V46-A53 HydrophobicContact CG1-CB 4.21Å
47A94.2Very high94.1Very high2 Ų259.5 Ų59.52%0.01731%0.311CS..Hα-helixtrans-59.5-34176.700000113.5S43 E45 P51 S54 F98 F99S43-A47 PolarHBondContact O-N 2.95Å; E45-A47 VanDerWaalsContact C-N 3.29Å; E45-A47 PolarHBondContact O-N 3.06Å; A47-P51 WeakPolarHBondContact O-CA 3.36Å; A47-S54 VanDerWaalsContact CA-CB 3.49Å; A47-S54 WeakPolarHBondContact CB-OG 3.47Å; A47-F98 HydrophobicContact CB-CB 4.41Å; A47-F98 HydrophobicContact CB-CD1 3.38Å; A47-F98 HydrophobicContact CB-CE1 3.82Å; A47-F98 HydrophobicContact CB-CG 4.03Å; A47-F99 HydrophobicContact CB-CZ 4.25Å; A47-F99 WeakPolarHBondContact O-CZ 3.42Å
48R94.1Very high94.2Very high198 Ų19859.4 Ų59.475%0.74731%0.31SS*.Hα-helixtrans-85-40.3-179.8-69.2179.1-178.71610.2113.3V44 E45 V46V44-R48 PolarHBondContact O-N 3.12Å; E45-R48 PolarHBondContact O-N 3.42Å; E45-R48 VanDerWaalsContact O-N 3.09Å; V46-R48 VanDerWaalsContact C-N 3.25Å; V46-R48 PolarHBondContact O-N 2.77Å
49K95.6Very high94.3Very high151 Ų15158.1 Ų58.166%0.65731%0.305SS*.Hα-helixtrans-83.8-36.5-177.4-68.5-174.6175.3177.90112.5E45 V46E45-K49 HydrophobicContact CG-CD 3.9Å; E45-K49 HydrophobicContact CG-CG 4.36Å; E45-K49 PolarHBondContact O-N 3.23Å; E45-K49 VanDerWaalsContact OE1-CE 3.24Å; E45-K49 WeakPolarHBondContact OE1-CE 3.29Å; E45-K49 IonicContact OE1-NZ 2.62Å; E45-K49 PolarHBondContact OE1-NZ 3.23Å; V46-K49 PolarHBondContact O-N 2.69Å
50S95.6Very high94.4Very high62 Ų6255.4 Ų55.443%0.43430%0.296SS..  trans-138.768.3-171.8-56.40000110.5V46 V52 A53 S54V46-S50 CarbonylContact O-C 3.07Å; V46-S50 VanDerWaalsContact O-CA 3.28Å; V46-S50 WeakPolarHBondContact O-CA 3.32Å; V46-S50 PolarHBondContact O-N 3.16Å; V46-S50 VanDerWaalsContact O-O 3.05Å; S50-V52 VanDerWaalsContact C-N 3.27Å; S50-V52 PolarHBondContact O-N 3.29Å; S50-A53 WeakPolarHBondContact O-CB 3.3Å; S50-A53 PolarHBondContact O-N 2.91Å; S50-S54 PolarHBondContact O-N 3.45Å; S50-S54 VanDerWaalsContact O-N 3.13Å
51P94.9Very high94.5Very high59 Ų5953.7 Ų53.738%0.38329%0.287SS..Hα-helixtrans-60-34.3-171.722.5-33.8000113.3A47 S54 W55 W94A47-P51 WeakPolarHBondContact O-CA 3.36Å; P51-S54 PolarHBondContact O-N 2.7Å; P51-W55 WeakPolarHBondContact O-CB 3.47Å; P51-W55 PolarHBondContact O-N 3.03Å; P51-W94 HydrophobicContact CB-CH2 4.47Å; P51-W94 WeakPolarHBondContact O-CZ2 3.46Å
52V95.6Very high94.8Very high115 Ų11550 Ų5070%0.69726%0.263SS*.Hα-helixtrans-64.1-41176.6179.50000111.4S50 W55 L56S50-V52 VanDerWaalsContact C-N 3.27Å; S50-V52 PolarHBondContact O-N 3.29Å; V52-W55 PolarHBondContact O-N 2.98Å; V52-L56 WeakPolarHBondContact O-CB 3.44Å; V52-L56 PolarHBondContact O-N 3.32Å
53A94.6Very high95.1Very high26 Ų2648 Ų4822%0.21524%0.243CC..Hα-helixtrans-66-42.2177.200000110.9V46 S50 L56 C57V46-A53 HydrophobicContact CG1-CB 4.21Å; S50-A53 WeakPolarHBondContact O-CB 3.3Å; S50-A53 PolarHBondContact O-N 2.91Å; A53-L56 PolarHBondContact O-N 3.37Å; A53-C57 PolarHBondContact O-N 3.4Å; A53-C57 PolarHBondContact O-SG 3.35Å
54S96.3Very high95.2Very high3 Ų347.9 Ų47.92%0.02124%0.242CC..Hα-helixtrans-61.9-42.9174.8177.10000112.6A47 S50 P51 C57 A58 W94A47-S54 VanDerWaalsContact CA-CB 3.49Å; A47-S54 WeakPolarHBondContact CB-OG 3.47Å; S50-S54 PolarHBondContact O-N 3.45Å; S50-S54 VanDerWaalsContact O-N 3.13Å; P51-S54 PolarHBondContact O-N 2.7Å; S54-C57 WeakPolarHBondContact O-CB 3.49Å; S54-C57 PolarHBondContact O-N 2.89Å; S54-A58 PolarHBondContact O-N 3.2Å; S54-W94 PolarHBondContact OG-NE1 2.91Å
55W97.4Very high95.3Very high75 Ų7545.3 Ų45.328%0.28423%0.227SC..Hα-helixtrans-61.2-45.2175.3176.483.3000111.2P51 V52 C57 A58 M59 I87 S91 W94P51-W55 WeakPolarHBondContact O-CB 3.47Å; P51-W55 PolarHBondContact O-N 3.03Å; V52-W55 PolarHBondContact O-N 2.98Å; W55-C57 VanDerWaalsContact C-N 3.34Å; W55-C57 PolarHBondContact O-N 3.23Å; W55-A58 WeakPolarHBondContact O-CA 3.46Å; W55-A58 WeakPolarHBondContact O-CB 3.17Å; W55-A58 PolarHBondContact O-N 3.02Å; W55-M59 HydrophobicContact CD2-CG 3.93Å; W55-M59 HydrophobicContact CE3-CG 4.11Å; W55-M59 HydrophobicContact CH2-CG 3.82Å; W55-M59 HydrophobicContact CH2-SD 4.39Å; W55-M59 HydrophobicContact CZ2-CG 3.61Å; W55-M59 HydrophobicContact CZ2-SD 3.69Å; W55-M59 HydrophobicContact CZ3-CG 4.06Å; W55-M59 WeakPolarHBondContact O-CG 3.31Å; W55-M59 PolarHBondContact O-N 3.32Å; W55-I87 HydrophobicContact CZ2-CG2 4.27Å; W55-S91 PolarHBondContact NE1-OG 3.39Å; W55-W94 HydrophobicContact CB-CD2 4.22Å; W55-W94 HydrophobicContact CB-CE3 4.4Å; W55-W94 HydrophobicContact CB-CH2 3.97Å; W55-W94 HydrophobicContact CB-CZ2 3.77Å; W55-W94 HydrophobicContact CB-CZ3 4.29Å; W55-W94 AromaticContact CD1-CD2 3.97Å; W55-W94 AromaticContact CD1-CE3 3.7Å; W55-W94 HydrophobicContact CG-CE3 4.46Å
56L95.7Very high95.4Very high69 Ų6942 Ų4236%0.36121%0.21SC..Hα-helixtrans-63.2-40.1177.7-174.361.4000111.8V52 A53 A58 M59 L60 L169V52-L56 WeakPolarHBondContact O-CB 3.44Å; V52-L56 PolarHBondContact O-N 3.32Å; A53-L56 PolarHBondContact O-N 3.37Å; L56-A58 VanDerWaalsContact C-N 3.31Å; L56-A58 PolarHBondContact O-N 3.41Å; L56-M59 WeakPolarHBondContact O-CB 3.35Å; L56-M59 PolarHBondContact O-N 3.26Å; L56-L60 WeakPolarHBondContact O-CG 3.46Å; L56-L60 PolarHBondContact O-N 3.28Å; L56-L169 HydrophobicContact CB-CD2 4.04Å; L56-L169 HydrophobicContact CD2-CD1 4.02Å; L56-L169 HydrophobicContact CD2-CD2 3.73Å; L56-L169 HydrophobicContact CG-CD2 3.7Å
57C95.4Very high95.5Very high1 Ų142 Ų421%0.00721%0.208CC..Hα-helixtrans-58.7-44.1171.3-62.90000111L37 A53 S54 W55 M59 L60 Y61 L169 R170L37-C57 HydrophobicContact CD1-CB 3.98Å; L37-C57 HydrophobicContact CD2-CB 3.96Å; A53-C57 PolarHBondContact O-N 3.4Å; A53-C57 PolarHBondContact O-SG 3.35Å; S54-C57 WeakPolarHBondContact O-CB 3.49Å; S54-C57 PolarHBondContact O-N 2.89Å; W55-C57 VanDerWaalsContact C-N 3.34Å; W55-C57 PolarHBondContact O-N 3.23Å; C57-M59 VanDerWaalsContact C-N 3.31Å; C57-M59 PolarHBondContact O-N 2.93Å; C57-L60 WeakPolarHBondContact O-CB 3.27Å; C57-L60 PolarHBondContact O-N 3Å; C57-L60 VanDerWaalsContact O-N 3.15Å; C57-Y61 WeakPolarHBondContact O-CD2 3.29Å; C57-Y61 PolarHBondContact O-N 3.37Å; C57-L169 VanDerWaalsContact SG-CD2 3.59Å; C57-R170 VanDerWaalsContact SG-CG 3.53Å
58A96.8Very high95.5Very high0 Ų043.4 Ų43.40%022%0.215CC..Hα-helixtrans-61.7-39.2176.700000112.3I34 L37 S54 W55 L56 Y61 C62 W94I34-A58 HydrophobicContact CG1-CB 4.22Å; L37-A58 HydrophobicContact CD2-CB 3.82Å; S54-A58 PolarHBondContact O-N 3.2Å; W55-A58 WeakPolarHBondContact O-CA 3.46Å; W55-A58 WeakPolarHBondContact O-CB 3.17Å; W55-A58 PolarHBondContact O-N 3.02Å; L56-A58 VanDerWaalsContact C-N 3.31Å; L56-A58 PolarHBondContact O-N 3.41Å; A58-Y61 PolarHBondContact O-N 3Å; A58-C62 PolarHBondContact O-N 3.44Å; A58-C62 PolarHBondContact O-SG 3.16Å; A58-W94 HydrophobicContact CB-CB 4.06Å; A58-W94 VanDerWaalsContact CB-CD1 3.46Å; A58-W94 HydrophobicContact CB-CG 3.92Å
59M96.9Very high95.5Very high1 Ų134 Ų341%0.00518%0.18CC..Hα-helixtrans-63.6-41.1173.8-62.7-56.395.900111.4W55 L56 C57 Y61 C62 F63 F81 I87 A90W55-M59 HydrophobicContact CD2-CG 3.93Å; W55-M59 HydrophobicContact CE3-CG 4.11Å; W55-M59 HydrophobicContact CH2-CG 3.82Å; W55-M59 HydrophobicContact CH2-SD 4.39Å; W55-M59 HydrophobicContact CZ2-CG 3.61Å; W55-M59 HydrophobicContact CZ2-SD 3.69Å; W55-M59 HydrophobicContact CZ3-CG 4.06Å; W55-M59 WeakPolarHBondContact O-CG 3.31Å; W55-M59 PolarHBondContact O-N 3.32Å; L56-M59 WeakPolarHBondContact O-CB 3.35Å; L56-M59 PolarHBondContact O-N 3.26Å; C57-M59 VanDerWaalsContact C-N 3.31Å; C57-M59 PolarHBondContact O-N 2.93Å; M59-Y61 PolarHBondContact O-N 3.45Å; M59-C62 PolarHBondContact O-N 3.42Å; M59-F63 HydrophobicContact CB-CD2 4.22Å; M59-F63 HydrophobicContact CE-CE2 4.43Å; M59-F63 WeakPolarHBondContact O-CB 3.31Å; M59-F63 WeakPolarHBondContact O-CD2 3.32Å; M59-F63 PolarHBondContact O-N 3.16Å; M59-F63 HydrophobicContact SD-CD2 4.09Å; M59-F63 HydrophobicContact SD-CE2 3.63Å; M59-F81 HydrophobicContact CB-CE1 4.37Å; M59-F81 HydrophobicContact CB-CZ 4.24Å; M59-F81 HydrophobicContact CG-CE1 4.38Å; M59-I87 HydrophobicContact SD-CG2 4.34Å; M59-A90 HydrophobicContact CE-CB 3.78Å; M59-A90 HydrophobicContact SD-CB 4.45Å
60L95.3Very high95.5Very high30 Ų3027.9 Ų27.916%0.15715%0.154CC..Hα-helixtrans-62-41.2174-67.6177.3000112L56 C57 C62 G64 I67 V159 I162 E166 L169L56-L60 WeakPolarHBondContact O-CG 3.46Å; L56-L60 PolarHBondContact O-N 3.28Å; C57-L60 WeakPolarHBondContact O-CB 3.27Å; C57-L60 PolarHBondContact O-N 3Å; C57-L60 VanDerWaalsContact O-N 3.15Å; L60-C62 VanDerWaalsContact C-N 3.29Å; L60-C62 PolarHBondContact O-N 3.27Å; L60-G64 WeakPolarHBondContact O-CA 3.35Å; L60-G64 PolarHBondContact O-N 3.2Å; L60-I67 HydrophobicContact CD2-CD1 3.83Å; L60-V159 HydrophobicContact CB-CG2 4.26Å; L60-I162 HydrophobicContact CD2-CD1 4.41Å; L60-E166 HydrophobicContact CD1-CB 4.36Å; L60-E166 HydrophobicContact CD1-CG 4.35Å; L60-L169 HydrophobicContact CD1-CD2 3.81Å
61Y95.5Very high95.5Very high25 Ų2528.6 Ų28.610%0.09816%0.156CC..Hα-helixtrans-64.1-31.8175-92.1-101.4000113.3S33 L37 E40 C57 A58 M59 V159 E166S33-Y61 VanDerWaalsContact O-CD1 3.23Å; S33-Y61 WeakPolarHBondContact O-CD1 3.3Å; L37-Y61 HydrophobicContact CB-CD1 4.24Å; L37-Y61 HydrophobicContact CB-CD2 4Å; L37-Y61 HydrophobicContact CB-CE1 4.25Å; L37-Y61 HydrophobicContact CB-CE2 3.98Å; L37-Y61 HydrophobicContact CB-CG 4.12Å; L37-Y61 HydrophobicContact CD1-CD2 4.1Å; L37-Y61 HydrophobicContact CD1-CE2 3.69Å; L37-Y61 HydrophobicContact CD2-CD2 4.44Å; L37-Y61 HydrophobicContact CG-CD2 4.4Å; L37-Y61 HydrophobicContact CG-CE2 4.34Å; E40-Y61 WeakPolarHBondContact CG-OH 3.07Å; C57-Y61 WeakPolarHBondContact O-CD2 3.29Å; C57-Y61 PolarHBondContact O-N 3.37Å; A58-Y61 PolarHBondContact O-N 3Å; M59-Y61 PolarHBondContact O-N 3.45Å; Y61-V159 HydrophobicContact CD1-CG1 3.82Å; Y61-V159 HydrophobicContact CD2-CG1 4.46Å; Y61-V159 HydrophobicContact CD2-CG2 4.09Å; Y61-V159 HydrophobicContact CE1-CG1 4.1Å; Y61-V159 HydrophobicContact CE2-CG2 4.36Å; Y61-V159 HydrophobicContact CG-CG1 4.03Å; Y61-V159 HydrophobicContact CG-CG2 4.38Å; Y61-E166 HydrophobicContact CD2-CG 4.19Å; Y61-E166 HydrophobicContact CE2-CG 3.77Å; Y61-E166 WeakPolarHBondContact CE2-OE1 3.02Å
62C95.7Very high95.5Very high0 Ų030 Ų300%016%0.16CC..Hα-helixtrans-87.3-39.3-178.6-64.80000113Y29 Y30 A58 M59 L60 A90Y29-C62 VanDerWaalsContact CE1-O 3.3Å; Y29-C62 WeakPolarHBondContact CE1-O 3.43Å; Y30-C62 HydrophobicContact CD1-CB 3.64Å; Y30-C62 HydrophobicContact CE1-CB 3.92Å; A58-C62 PolarHBondContact O-N 3.44Å; A58-C62 PolarHBondContact O-SG 3.16Å; M59-C62 PolarHBondContact O-N 3.42Å; L60-C62 VanDerWaalsContact C-N 3.29Å; L60-C62 PolarHBondContact O-N 3.27Å; C62-A90 HydrophobicContact CB-CB 4.38Å
63F95.8Very high95.4Very high0 Ų026.4 Ų26.40%014%0.137CC..Hα-helixtrans-118.1-1.6-168.4-52.9-63.2000113.8Y30 M59 S65 Y66 I67 Y80 F81 H86 I87 A90Y30-F63 AromaticContact CE1-CE1 3.78Å; Y30-F63 HydrophobicContact CE1-CE1 3.78Å; Y30-F63 HydrophobicContact CE1-CZ 4.02Å; Y30-F63 AromaticContact CZ-CE1 3.84Å; Y30-F63 WeakPolarHBondContact OH-CE1 3.21Å; M59-F63 HydrophobicContact CB-CD2 4.22Å; M59-F63 HydrophobicContact CE-CE2 4.43Å; M59-F63 WeakPolarHBondContact O-CB 3.31Å; M59-F63 WeakPolarHBondContact O-CD2 3.32Å; M59-F63 PolarHBondContact O-N 3.16Å; M59-F63 HydrophobicContact SD-CD2 4.09Å; M59-F63 HydrophobicContact SD-CE2 3.63Å; F63-S65 PolarHBondContact O-N 3.5Å; F63-Y66 HydrophobicContact CB-CD2 4.45Å; F63-Y66 HydrophobicContact CD1-CD2 4.2Å; F63-Y66 HydrophobicContact CD1-CE2 4.42Å; F63-Y66 PolarHBondContact O-N 3.46Å; F63-I67 HydrophobicContact CB-CD1 4.36Å; F63-I67 WeakPolarHBondContact O-CG1 3.1Å; F63-I67 PolarHBondContact O-N 3.48Å; F63-I67 VanDerWaalsContact O-N 3.09Å; F63-Y80 AromaticContact CD1-CD1 3.49Å; F63-Y80 HydrophobicContact CD1-CD1 3.49Å; F63-Y80 VanDerWaalsContact CD1-CD1 3.49Å; F63-Y80 AromaticContact CD1-CE1 3.56Å; F63-Y80 HydrophobicContact CD1-CE1 3.56Å; F63-Y80 AromaticContact CE1-CD1 3.87Å; F63-Y80 HydrophobicContact CE1-CD1 3.87Å; F63-Y80 AromaticContact CE1-CE1 3.58Å; F63-Y80 HydrophobicContact CE1-CE1 3.58Å; F63-Y80 HydrophobicContact CG-CD1 4.3Å; F63-F81 HydrophobicContact CD2-CZ 4.47Å; F63-H86 HydrophobicContact CE1-CB 4.26Å; F63-H86 HydrophobicContact CZ-CB 4.39Å; F63-I87 HydrophobicContact CD2-CD1 3.92Å; F63-I87 HydrophobicContact CE1-CD1 4.29Å; F63-I87 HydrophobicContact CE2-CD1 3.42Å; F63-I87 VanDerWaalsContact CE2-CD1 3.42Å; F63-I87 HydrophobicContact CZ-CD1 3.64Å; F63-A90 HydrophobicContact CE2-CB 3.84Å; F63-A90 HydrophobicContact CZ-CB 3.73Å
64G94.8Very high95.3Very high1 Ų128.6 Ų28.61%0.0116%0.161CC..Hα-helixtrans-54.6-29.3-178.400000114.2L60 Y66 L68L60-G64 WeakPolarHBondContact O-CA 3.35Å; L60-G64 PolarHBondContact O-N 3.2Å; G64-Y66 PolarHBondContact O-N 3.33Å; G64-L68 WeakPolarHBondContact O-CB 3.28Å; G64-L68 PolarHBondContact O-N 3.22Å
65S94.3Very high95.1Very high0 Ų030.3 Ų30.30%018%0.18CC..Hα-helixtrans-63.5-36.6172.558.80000114F63 A69 K129 K155F63-S65 PolarHBondContact O-N 3.5Å; S65-A69 VanDerWaalsContact O-CB 3.3Å; S65-A69 WeakPolarHBondContact O-CB 3.39Å; S65-A69 PolarHBondContact O-N 3.2Å; S65-K129 WeakPolarHBondContact OG-CE 3.31Å; S65-K129 PolarHBondContact OG-NZ 3.31Å; S65-K155 VanDerWaalsContact CB-O 3.29Å; S65-K155 WeakPolarHBondContact CB-O 3.47Å
66Y95Very high94.9Very high37 Ų3730.2 Ų30.215%0.14519%0.19CC..Hα-helixtrans-79.5-50.3179.4-60.5-67.6000109.6F63 G64 L68 A69 D70 Y80 K129F63-Y66 HydrophobicContact CB-CD2 4.45Å; F63-Y66 HydrophobicContact CD1-CD2 4.2Å; F63-Y66 HydrophobicContact CD1-CE2 4.42Å; F63-Y66 PolarHBondContact O-N 3.46Å; G64-Y66 PolarHBondContact O-N 3.33Å; Y66-L68 VanDerWaalsContact C-N 3.3Å; Y66-L68 PolarHBondContact O-N 3.33Å; Y66-A69 PolarHBondContact O-N 3.39Å; Y66-D70 VanDerWaalsContact O-CG 3.29Å; Y66-D70 PolarHBondContact O-N 3.24Å; Y66-Y80 AromaticContact CD1-CD2 3.73Å; Y66-Y80 HydrophobicContact CD1-CD2 3.73Å; Y66-Y80 AromaticContact CD1-CE2 3.92Å; Y66-Y80 HydrophobicContact CD1-CE2 3.92Å; Y66-Y80 HydrophobicContact CD1-CG 4.41Å; Y66-Y80 AromaticContact CD2-CD1 3.79Å; Y66-Y80 HydrophobicContact CD2-CD1 3.79Å; Y66-Y80 AromaticContact CD2-CD2 3.69Å; Y66-Y80 HydrophobicContact CD2-CD2 3.69Å; Y66-Y80 AromaticContact CD2-CE1 3.94Å; Y66-Y80 HydrophobicContact CD2-CE1 3.94Å; Y66-Y80 AromaticContact CD2-CE2 3.8Å; Y66-Y80 HydrophobicContact CD2-CE2 3.8Å; Y66-Y80 AromaticContact CD2-CG 3.67Å; Y66-Y80 HydrophobicContact CD2-CG 3.67Å; Y66-Y80 AromaticContact CD2-CZ 3.92Å; Y66-Y80 AromaticContact CE1-CD2 3.96Å; Y66-Y80 HydrophobicContact CE1-CD2 3.96Å; Y66-Y80 AromaticContact CE1-CE2 3.63Å; Y66-Y80 HydrophobicContact CE1-CE2 3.63Å; Y66-Y80 HydrophobicContact CE2-CD1 4.05Å; Y66-Y80 AromaticContact CE2-CD2 3.88Å; Y66-Y80 HydrophobicContact CE2-CD2 3.88Å; Y66-Y80 AromaticContact CE2-CE1 3.69Å; Y66-Y80 HydrophobicContact CE2-CE1 3.69Å; Y66-Y80 AromaticContact CE2-CE2 3.47Å; Y66-Y80 HydrophobicContact CE2-CE2 3.47Å; Y66-Y80 VanDerWaalsContact CE2-CE2 3.47Å; Y66-Y80 HydrophobicContact CE2-CG 4.14Å; Y66-Y80 AromaticContact CE2-CZ 3.36Å; Y66-Y80 HydrophobicContact CG-CD1 4.4Å; Y66-Y80 AromaticContact CG-CD2 3.59Å; Y66-Y80 HydrophobicContact CG-CD2 3.59Å; Y66-Y80 HydrophobicContact CG-CE2 4Å; Y66-Y80 AromaticContact CG-CG 3.8Å; Y66-Y80 HydrophobicContact CG-CG 3.8Å; Y66-Y80 AromaticContact CZ-CD2 4Å; Y66-Y80 AromaticContact CZ-CE2 3.36Å; Y66-Y80 AromaticContact CZ-CZ 3.58Å; Y66-Y80 PolarHBondContact OH-OH 2.94Å; Y66-K129 VanDerWaalsContact CE2-CE 3.46Å; Y66-K129 VanDerWaalsContact OH-CE 3.22Å; Y66-K129 WeakPolarHBondContact OH-CE 3.49Å
67I95.6Very high94.8Very high27 Ų2729.4 Ų29.414%0.13819%0.188CC..Hα-helixtrans-50.1-51.2176.7-59.1171.6000110.6L60 F63 D70 V71 P77 F81L60-I67 HydrophobicContact CD2-CD1 3.83Å; F63-I67 HydrophobicContact CB-CD1 4.36Å; F63-I67 WeakPolarHBondContact O-CG1 3.1Å; F63-I67 PolarHBondContact O-N 3.48Å; F63-I67 VanDerWaalsContact O-N 3.09Å; I67-D70 PolarHBondContact O-N 3.3Å; I67-V71 VanDerWaalsContact O-CG2 3.22Å; I67-V71 WeakPolarHBondContact O-CG2 3.26Å; I67-V71 PolarHBondContact O-N 3.05Å; I67-P77 WeakPolarHBondContact CG1-O 3.41Å; I67-P77 HydrophobicContact CG2-CB 3.94Å; I67-F81 HydrophobicContact CD1-CE2 4.08Å; I67-F81 HydrophobicContact CD1-CZ 4.47Å; I67-F81 HydrophobicContact CG1-CE2 4.28Å
68L94.6Very high94.7Very high31 Ų3134.6 Ų34.616%0.16222%0.216CC..Hα-helixtrans-70.5-34.2-177.1-170.160.6000112.5G64 Y66 L72 V154 L161 I162G64-L68 WeakPolarHBondContact O-CB 3.28Å; G64-L68 PolarHBondContact O-N 3.22Å; Y66-L68 VanDerWaalsContact C-N 3.3Å; Y66-L68 PolarHBondContact O-N 3.33Å; L68-L72 VanDerWaalsContact O-CG 3.29Å; L68-L72 WeakPolarHBondContact O-CG 3.35Å; L68-L72 PolarHBondContact O-N 2.85Å; L68-V154 HydrophobicContact CB-CG1 3.58Å; L68-V154 HydrophobicContact CD2-CB 4.38Å; L68-V154 HydrophobicContact CD2-CG1 3.7Å; L68-V154 HydrophobicContact CD2-CG2 4.02Å; L68-V154 HydrophobicContact CG-CB 4.49Å; L68-V154 HydrophobicContact CG-CG1 3.48Å; L68-V154 VanDerWaalsContact CG-CG1 3.48Å; L68-V154 HydrophobicContact CG-CG2 4.26Å; L68-L161 HydrophobicContact CD2-CB 3.74Å; L68-L161 HydrophobicContact CD2-CD1 4.02Å; L68-I162 HydrophobicContact CD1-CG2 3.91Å; L68-I162 HydrophobicContact CD2-CG2 3.98Å; L68-I162 HydrophobicContact CG-CG2 4.49Å
69A95.1Very high94.5Very high0 Ų038.2 Ų38.20%024%0.235CC..Hα-helixtrans-67-42.6174.900000111.6S65 Y66 L72 L73 I151 V154 K155S65-A69 VanDerWaalsContact O-CB 3.3Å; S65-A69 WeakPolarHBondContact O-CB 3.39Å; S65-A69 PolarHBondContact O-N 3.2Å; Y66-A69 PolarHBondContact O-N 3.39Å; A69-L72 PolarHBondContact O-N 3.01Å; A69-L73 WeakPolarHBondContact O-CB 3.35Å; A69-L73 WeakPolarHBondContact O-CG 3.29Å; A69-L73 PolarHBondContact O-N 3.49Å; A69-I151 HydrophobicContact CB-CG2 4.4Å; A69-V154 HydrophobicContact CB-CG1 4.22Å; A69-K155 HydrophobicContact CB-CD 4.34Å; A69-K155 HydrophobicContact CB-CG 3.85Å
70D94.6Very high94.3Very high23 Ų2339.6 Ų39.612%0.12324%0.24CC..Hα-helixtrans-67.7-40.7179.4-63.1-28.1000111Y66 I67 L72 L73 G74 G75 C76Y66-D70 VanDerWaalsContact O-CG 3.29Å; Y66-D70 PolarHBondContact O-N 3.24Å; I67-D70 PolarHBondContact O-N 3.3Å; D70-L72 VanDerWaalsContact C-N 3.32Å; D70-L72 PolarHBondContact O-N 3.38Å; D70-L73 PolarHBondContact O-N 3.31Å; D70-G74 PolarHBondContact O-N 3.01Å; D70-G75 PolarHBondContact O-N 2.96Å; D70-C76 WeakPolarHBondContact CB-O 3.45Å
71V94.9Very high94.2Very high77 Ų7740.5 Ų40.547%0.46724%0.243SC..Hα-helixtrans-56-46.1172.5168.60000111.4I67 L73 G74 P77I67-V71 VanDerWaalsContact O-CG2 3.22Å; I67-V71 WeakPolarHBondContact O-CG2 3.26Å; I67-V71 PolarHBondContact O-N 3.05Å; V71-L73 VanDerWaalsContact C-N 3.35Å; V71-G74 PolarHBondContact O-N 3.45Å; V71-P77 HydrophobicContact CG2-CB 3.82Å; V71-P77 HydrophobicContact CG2-CG 3.57Å
72L94.7Very high94.1Very high89 Ų8944.4 Ų44.447%0.46626%0.262SS..Hα-helixtrans-71.7-28.7-177.9-70.8173.9000113.5L68 A69 D70 G74 I150 I151 V154L68-L72 VanDerWaalsContact O-CG 3.29Å; L68-L72 WeakPolarHBondContact O-CG 3.35Å; L68-L72 PolarHBondContact O-N 2.85Å; A69-L72 PolarHBondContact O-N 3.01Å; D70-L72 VanDerWaalsContact C-N 3.32Å; D70-L72 PolarHBondContact O-N 3.38Å; L72-G74 VanDerWaalsContact C-N 3.32Å; L72-I150 HydrophobicContact CD1-CG2 3.95Å; L72-I151 HydrophobicContact CB-CD1 3.72Å; L72-I151 HydrophobicContact CD1-CD1 4.24Å; L72-V154 HydrophobicContact CD1-CB 4.29Å; L72-V154 HydrophobicContact CD1-CG1 4.27Å; L72-V154 HydrophobicContact CD1-CG2 3.58Å
73L93.5Very high94Very high40 Ų4050 Ų5021%0.20928%0.284CS..Hα-helixtrans-87.6-0.7176-69171.2000113.2A69 D70 V71 G75 H136 Y141 I147 I151A69-L73 WeakPolarHBondContact O-CB 3.35Å; A69-L73 WeakPolarHBondContact O-CG 3.29Å; A69-L73 PolarHBondContact O-N 3.49Å; D70-L73 PolarHBondContact O-N 3.31Å; V71-L73 VanDerWaalsContact C-N 3.35Å; L73-G75 VanDerWaalsContact C-N 3.27Å; L73-G75 PolarHBondContact O-N 2.91Å; L73-H136 WeakPolarHBondContact CD1-CD2 3.42Å; L73-Y141 HydrophobicContact CD2-CE2 4.12Å; L73-I147 HydrophobicContact CD2-CG2 4.5Å; L73-I151 HydrophobicContact CD1-CD1 4.2Å; L73-I151 HydrophobicContact CD1-CG1 4.38Å; L73-I151 HydrophobicContact CD1-CG2 4.31Å; L73-I151 HydrophobicContact CD2-CD1 3.95Å; L73-I151 HydrophobicContact CD2-CG1 3.98Å; L73-I151 HydrophobicContact CG-CD1 3.7Å; L73-I151 HydrophobicContact CG-CG1 4.15Å
74G93.5Very high93.9Very high71 Ų7155.5 Ų55.573%0.73231%0.313SS*.THydrogen-bonded Turntrans72.418.8-177.300000114.1D70 V71 L72D70-G74 PolarHBondContact O-N 3.01Å; V71-G74 PolarHBondContact O-N 3.45Å; L72-G74 VanDerWaalsContact C-N 3.32Å
75G91.4Very high94Very high40 Ų4059 Ų5941%0.41234%0.338SS..SBendtrans-82.6-179.6173.100000113D70 L73 P77D70-G75 PolarHBondContact O-N 2.96Å; L73-G75 VanDerWaalsContact C-N 3.27Å; L73-G75 PolarHBondContact O-N 2.91Å; G75-P77 WeakPolarHBondContact O-CD 3.26Å
76C93.9Very high94Very high73 Ų7360.3 Ų60.349%0.49334%0.344SS..  trans-74.7120.4173.3-177.60000109.7D70 L78 D79D70-C76 WeakPolarHBondContact CB-O 3.45Å; C76-L78 PolarHBondContact O-N 3.46Å; C76-D79 HydrophobicContact CB-CB 4.3Å; C76-D79 VanDerWaalsContact O-CB 3.3Å; C76-D79 WeakPolarHBondContact O-CB 3.13Å; C76-D79 PolarHBondContact O-N 3.18Å
77P93.1Very high94Very high51 Ų5159.6 Ų59.633%0.33134%0.343SS..THydrogen-bonded Turntrans-62.1-16.1179.2-21.633.6000113.6I67 V71 G75I67-P77 WeakPolarHBondContact CG1-O 3.41Å; I67-P77 HydrophobicContact CG2-CB 3.94Å; V71-P77 HydrophobicContact CG2-CB 3.82Å; V71-P77 HydrophobicContact CG2-CG 3.57Å; G75-P77 WeakPolarHBondContact O-CD 3.26Å
78L92.9Very high94Very high110 Ų11064.2 Ų64.258%0.57637%0.367SS*.THydrogen-bonded Turntrans-100.36.5179.4-57.8179.8000112.8C76 Y80 F81C76-L78 PolarHBondContact O-N 3.46Å; L78-Y80 PolarHBondContact O-N 2.88Å; L78-F81 HydrophobicContact CB-CD2 4.3Å; L78-F81 HydrophobicContact CD2-CD2 3.92Å; L78-F81 HydrophobicContact CD2-CE2 3.92Å; L78-F81 VanDerWaalsContact O-CB 3.31Å; L78-F81 WeakPolarHBondContact O-CB 3.42Å; L78-F81 PolarHBondContact O-N 3.16Å
79D93.3Very high94.1Very high77 Ų7764.7 Ų64.741%0.41237%0.37SS..G310 helixtrans-56.8-40.2-176.2-171.467.4000111.9C76 F81 Q82C76-D79 HydrophobicContact CB-CB 4.3Å; C76-D79 VanDerWaalsContact O-CB 3.3Å; C76-D79 WeakPolarHBondContact O-CB 3.13Å; C76-D79 PolarHBondContact O-N 3.18Å; D79-F81 PolarHBondContact O-N 3.25Å; D79-F81 VanDerWaalsContact O-N 3.16Å; D79-Q82 WeakPolarHBondContact O-CB 3.33Å; D79-Q82 WeakPolarHBondContact O-CG 3.42Å; D79-Q82 PolarHBondContact O-N 3.44Å; D79-Q82 PolarHBondContact O-NE2 3.46Å; D79-Q82 PolarHBondContact OD1-NE2 3.46Å; D79-Q82 PolarHBondContact OD2-NE2 2.89Å; D79-Q82 VanDerWaalsContact OD2-NE2 3.11Å
80Y92.7Very high94.2Very high30 Ų3064.7 Ų64.712%0.11837%0.37CS..G310 helixtrans-66.4-17.5177.3-156.4-91.8000114.1F63 Y66 L78 Q82 Y83 H86F63-Y80 AromaticContact CD1-CD1 3.49Å; F63-Y80 HydrophobicContact CD1-CD1 3.49Å; F63-Y80 VanDerWaalsContact CD1-CD1 3.49Å; F63-Y80 AromaticContact CD1-CE1 3.56Å; F63-Y80 HydrophobicContact CD1-CE1 3.56Å; F63-Y80 AromaticContact CE1-CD1 3.87Å; F63-Y80 HydrophobicContact CE1-CD1 3.87Å; F63-Y80 AromaticContact CE1-CE1 3.58Å; F63-Y80 HydrophobicContact CE1-CE1 3.58Å; F63-Y80 HydrophobicContact CG-CD1 4.3Å; Y66-Y80 AromaticContact CD1-CD2 3.73Å; Y66-Y80 HydrophobicContact CD1-CD2 3.73Å; Y66-Y80 AromaticContact CD1-CE2 3.92Å; Y66-Y80 HydrophobicContact CD1-CE2 3.92Å; Y66-Y80 HydrophobicContact CD1-CG 4.41Å; Y66-Y80 AromaticContact CD2-CD1 3.79Å; Y66-Y80 HydrophobicContact CD2-CD1 3.79Å; Y66-Y80 AromaticContact CD2-CD2 3.69Å; Y66-Y80 HydrophobicContact CD2-CD2 3.69Å; Y66-Y80 AromaticContact CD2-CE1 3.94Å; Y66-Y80 HydrophobicContact CD2-CE1 3.94Å; Y66-Y80 AromaticContact CD2-CE2 3.8Å; Y66-Y80 HydrophobicContact CD2-CE2 3.8Å; Y66-Y80 AromaticContact CD2-CG 3.67Å; Y66-Y80 HydrophobicContact CD2-CG 3.67Å; Y66-Y80 AromaticContact CD2-CZ 3.92Å; Y66-Y80 AromaticContact CE1-CD2 3.96Å; Y66-Y80 HydrophobicContact CE1-CD2 3.96Å; Y66-Y80 AromaticContact CE1-CE2 3.63Å; Y66-Y80 HydrophobicContact CE1-CE2 3.63Å; Y66-Y80 HydrophobicContact CE2-CD1 4.05Å; Y66-Y80 AromaticContact CE2-CD2 3.88Å; Y66-Y80 HydrophobicContact CE2-CD2 3.88Å; Y66-Y80 AromaticContact CE2-CE1 3.69Å; Y66-Y80 HydrophobicContact CE2-CE1 3.69Å; Y66-Y80 AromaticContact CE2-CE2 3.47Å; Y66-Y80 HydrophobicContact CE2-CE2 3.47Å; Y66-Y80 VanDerWaalsContact CE2-CE2 3.47Å; Y66-Y80 HydrophobicContact CE2-CG 4.14Å; Y66-Y80 AromaticContact CE2-CZ 3.36Å; Y66-Y80 HydrophobicContact CG-CD1 4.4Å; Y66-Y80 AromaticContact CG-CD2 3.59Å; Y66-Y80 HydrophobicContact CG-CD2 3.59Å; Y66-Y80 HydrophobicContact CG-CE2 4Å; Y66-Y80 AromaticContact CG-CG 3.8Å; Y66-Y80 HydrophobicContact CG-CG 3.8Å; Y66-Y80 AromaticContact CZ-CD2 4Å; Y66-Y80 AromaticContact CZ-CE2 3.36Å; Y66-Y80 AromaticContact CZ-CZ 3.58Å; Y66-Y80 PolarHBondContact OH-OH 2.94Å; L78-Y80 PolarHBondContact O-N 2.88Å; Y80-Q82 PolarHBondContact O-N 2.69Å; Y80-Y83 HydrophobicContact CD1-CD2 4.42Å; Y80-Y83 AromaticContact CD2-CD2 3.94Å; Y80-Y83 HydrophobicContact CD2-CD2 3.94Å; Y80-Y83 HydrophobicContact CD2-CE2 4.11Å; Y80-Y83 HydrophobicContact CE1-CD2 4.48Å; Y80-Y83 HydrophobicContact CE2-CD2 4.05Å; Y80-Y83 HydrophobicContact CE2-CE2 4.26Å; Y80-Y83 HydrophobicContact CG-CD2 4.14Å; Y80-Y83 WeakPolarHBondContact O-CD2 3.36Å; Y80-Y83 PolarHBondContact O-N 3.5Å; Y80-H86 HydrophobicContact CE1-CB 4.23Å
81F92.4Very high94.3Very high49 Ų4964.8 Ų64.822%0.21537%0.372CS..G310 helixtrans-73.6-9177.5-73.3-105.5000113M59 F63 I67 L78 D79 Y83 I87M59-F81 HydrophobicContact CB-CE1 4.37Å; M59-F81 HydrophobicContact CB-CZ 4.24Å; M59-F81 HydrophobicContact CG-CE1 4.38Å; F63-F81 HydrophobicContact CD2-CZ 4.47Å; I67-F81 HydrophobicContact CD1-CE2 4.08Å; I67-F81 HydrophobicContact CD1-CZ 4.47Å; I67-F81 HydrophobicContact CG1-CE2 4.28Å; L78-F81 HydrophobicContact CB-CD2 4.3Å; L78-F81 HydrophobicContact CD2-CD2 3.92Å; L78-F81 HydrophobicContact CD2-CE2 3.92Å; L78-F81 VanDerWaalsContact O-CB 3.31Å; L78-F81 WeakPolarHBondContact O-CB 3.42Å; L78-F81 PolarHBondContact O-N 3.16Å; D79-F81 PolarHBondContact O-N 3.25Å; D79-F81 VanDerWaalsContact O-N 3.16Å; F81-Y83 PolarHBondContact O-N 3.23Å; F81-I87 HydrophobicContact CD1-CD1 3.66Å; F81-I87 HydrophobicContact CD1-CG1 4.17Å; F81-I87 HydrophobicContact CE1-CD1 4.01Å; F81-I87 HydrophobicContact CG-CD1 4.09Å
82Q94.3Very high94.4Very high106 Ų10663.4 Ų63.450%0.49537%0.369SS..G310 helixtrans-63.5-23.4169.776.9-170.4-53.700112.5D79 Y80 N84D79-Q82 WeakPolarHBondContact O-CB 3.33Å; D79-Q82 WeakPolarHBondContact O-CG 3.42Å; D79-Q82 PolarHBondContact O-N 3.44Å; D79-Q82 PolarHBondContact O-NE2 3.46Å; D79-Q82 PolarHBondContact OD1-NE2 3.46Å; D79-Q82 PolarHBondContact OD2-NE2 2.89Å; D79-Q82 VanDerWaalsContact OD2-NE2 3.11Å; Y80-Q82 PolarHBondContact O-N 2.69Å; Q82-N84 VanDerWaalsContact C-N 3.34Å; Q82-N84 PolarHBondContact O-N 3.41Å
83Y93.5Very high94.5Very high118 Ų11859.4 Ų59.446%0.46335%0.347SS..  trans-81.875-179.9-63.4-71.5000112.1Y80 F81 S85 H86 I87Y80-Y83 HydrophobicContact CD1-CD2 4.42Å; Y80-Y83 AromaticContact CD2-CD2 3.94Å; Y80-Y83 HydrophobicContact CD2-CD2 3.94Å; Y80-Y83 HydrophobicContact CD2-CE2 4.11Å; Y80-Y83 HydrophobicContact CE1-CD2 4.48Å; Y80-Y83 HydrophobicContact CE2-CD2 4.05Å; Y80-Y83 HydrophobicContact CE2-CE2 4.26Å; Y80-Y83 HydrophobicContact CG-CD2 4.14Å; Y80-Y83 WeakPolarHBondContact O-CD2 3.36Å; Y80-Y83 PolarHBondContact O-N 3.5Å; F81-Y83 PolarHBondContact O-N 3.23Å; Y83-S85 VanDerWaalsContact C-N 3.25Å; Y83-S85 PolarHBondContact O-N 3.13Å; Y83-S85 VanDerWaalsContact O-N 3.1Å; Y83-H86 PolarHBondContact O-N 2.9Å; Y83-I87 PolarHBondContact O-N 2.87Å
84N94.7Very high94.7Very high115 Ų11558.8 Ų58.862%0.61534%0.343SS*.Hα-helixtrans-48.7-40.9-176.2-66.9-52.7000114Q82 H86 I87 L88Q82-N84 VanDerWaalsContact C-N 3.34Å; Q82-N84 PolarHBondContact O-N 3.41Å; N84-H86 VanDerWaalsContact C-N 3.33Å; N84-H86 PolarHBondContact O-N 2.7Å; N84-I87 PolarHBondContact O-N 3.32Å; N84-L88 WeakPolarHBondContact O-CB 3.38Å; N84-L88 VanDerWaalsContact O-CG 3.3Å; N84-L88 WeakPolarHBondContact O-CG 3.19Å; N84-L88 PolarHBondContact O-N 2.92Å
85S95.1Very high94.9Very high76 Ų7661.8 Ų61.853%0.53133%0.333SS..Hα-helixtrans-61.1-38.5178.9-54.20000113.1Y83 L89Y83-S85 VanDerWaalsContact C-N 3.25Å; Y83-S85 PolarHBondContact O-N 3.13Å; Y83-S85 VanDerWaalsContact O-N 3.1Å; S85-L89 VanDerWaalsContact O-CB 3.28Å; S85-L89 WeakPolarHBondContact O-CB 3.29Å; S85-L89 PolarHBondContact O-N 3.08Å
86H94.5Very high95.2Very high27 Ų2763 Ų6313%0.12533%0.329CS..Hα-helixtrans-71.8-41178-71.8-100.2000111.1F22 D26 Y30 F63 Y80 Y83 N84 L89 A90F22-H86 AromaticContact CD2-CE1 3.46Å; F22-H86 VanDerWaalsContact CD2-CE1 3.46Å; F22-H86 WeakPolarHBondContact CD2-CE1 3.46Å; F22-H86 AromaticContact CD2-ND1 3.95Å; F22-H86 AromaticContact CD2-NE2 3.72Å; D26-H86 IonicContact OD2-CE1 2.58Å; D26-H86 PolarHBondContact OD2-CE1 3.39Å; D26-H86 IonicContact OD2-ND1 2.76Å; Y30-H86 WeakPolarHBondContact OH-CB 3.24Å; Y30-H86 PolarHBondContact OH-ND1 3.48Å; F63-H86 HydrophobicContact CE1-CB 4.26Å; F63-H86 HydrophobicContact CZ-CB 4.39Å; Y80-H86 HydrophobicContact CE1-CB 4.23Å; Y83-H86 PolarHBondContact O-N 2.9Å; N84-H86 VanDerWaalsContact C-N 3.33Å; N84-H86 PolarHBondContact O-N 2.7Å; H86-L89 PolarHBondContact O-N 3.39Å; H86-A90 WeakPolarHBondContact O-CB 3.38Å; H86-A90 PolarHBondContact O-N 2.95Å
87I95.4Very high95.3Very high22 Ų2259.5 Ų59.511%0.11331%0.306CS..Hα-helixtrans-65-44.8177.4-56.6-52.5000111W55 M59 F63 F81 Y83 N84 L89 A90 S91W55-I87 HydrophobicContact CZ2-CG2 4.27Å; M59-I87 HydrophobicContact SD-CG2 4.34Å; F63-I87 HydrophobicContact CD2-CD1 3.92Å; F63-I87 HydrophobicContact CE1-CD1 4.29Å; F63-I87 HydrophobicContact CE2-CD1 3.42Å; F63-I87 VanDerWaalsContact CE2-CD1 3.42Å; F63-I87 HydrophobicContact CZ-CD1 3.64Å; F81-I87 HydrophobicContact CD1-CD1 3.66Å; F81-I87 HydrophobicContact CD1-CG1 4.17Å; F81-I87 HydrophobicContact CE1-CD1 4.01Å; F81-I87 HydrophobicContact CG-CD1 4.09Å; Y83-I87 PolarHBondContact O-N 2.87Å; N84-I87 PolarHBondContact O-N 3.32Å; I87-L89 PolarHBondContact O-N 3.43Å; I87-A90 PolarHBondContact O-N 3.29Å; I87-S91 VanDerWaalsContact O-CB 3.26Å; I87-S91 WeakPolarHBondContact O-CB 3.33Å; I87-S91 PolarHBondContact O-N 3.04Å; I87-S91 PolarHBondContact O-OG 2.82Å
88L96.3Very high95.4Very high123 Ų12358.3 Ų58.364%0.64430%0.295SS*.Hα-helixtrans-61.6-43.8176.1-74.2173.5000111.5N84 S91 A92N84-L88 WeakPolarHBondContact O-CB 3.38Å; N84-L88 VanDerWaalsContact O-CG 3.3Å; N84-L88 WeakPolarHBondContact O-CG 3.19Å; N84-L88 PolarHBondContact O-N 2.92Å; L88-S91 PolarHBondContact O-N 3.01Å; L88-A92 WeakPolarHBondContact O-CB 3.26Å; L88-A92 PolarHBondContact O-N 3.13Å
89L96Very high95.5Very high42 Ų4256.5 Ų56.522%0.2228%0.283CS..Hα-helixtrans-63-48.2178-174.559.9000111.8F22 L27 Y30 S85 H86 I87 S91 A92 I93F22-L89 HydrophobicContact CE2-CD2 3.88Å; L27-L89 HydrophobicContact CB-CD2 4.46Å; L27-L89 HydrophobicContact CD1-CD1 4.15Å; Y30-L89 HydrophobicContact CD2-CB 4.49Å; Y30-L89 HydrophobicContact CD2-CD2 4.14Å; Y30-L89 HydrophobicContact CD2-CG 4.06Å; Y30-L89 HydrophobicContact CE2-CB 4.31Å; Y30-L89 HydrophobicContact CE2-CD2 4.01Å; Y30-L89 HydrophobicContact CE2-CG 4.2Å; S85-L89 VanDerWaalsContact O-CB 3.28Å; S85-L89 WeakPolarHBondContact O-CB 3.29Å; S85-L89 PolarHBondContact O-N 3.08Å; H86-L89 PolarHBondContact O-N 3.39Å; I87-L89 PolarHBondContact O-N 3.43Å; L89-S91 VanDerWaalsContact C-N 3.31Å; L89-S91 PolarHBondContact O-N 3.08Å; L89-A92 PolarHBondContact O-N 2.9Å; L89-I93 HydrophobicContact CD1-CD1 4.26Å; L89-I93 HydrophobicContact CG-CD1 4.02Å; L89-I93 WeakPolarHBondContact O-CD1 3.14Å; L89-I93 WeakPolarHBondContact O-CG1 3.28Å; L89-I93 PolarHBondContact O-N 3.08Å
90A96.8Very high95.5Very high0 Ų054 Ų540%027%0.271CS..Hα-helixtrans-62.3-39.217700000111.9Y30 I34 M59 C62 F63 H86 I87 I93 W94Y30-A90 HydrophobicContact CD1-CB 4.34Å; Y30-A90 HydrophobicContact CD2-CB 4.07Å; Y30-A90 HydrophobicContact CE2-CB 4.27Å; Y30-A90 HydrophobicContact CG-CB 4.12Å; I34-A90 WeakPolarHBondContact CD1-O 3.31Å; M59-A90 HydrophobicContact CE-CB 3.78Å; M59-A90 HydrophobicContact SD-CB 4.45Å; C62-A90 HydrophobicContact CB-CB 4.38Å; F63-A90 HydrophobicContact CE2-CB 3.84Å; F63-A90 HydrophobicContact CZ-CB 3.73Å; H86-A90 WeakPolarHBondContact O-CB 3.38Å; H86-A90 PolarHBondContact O-N 2.95Å; I87-A90 PolarHBondContact O-N 3.29Å; A90-I93 PolarHBondContact O-N 3.18Å; A90-W94 WeakPolarHBondContact O-CB 3.29Å; A90-W94 PolarHBondContact O-N 3.29Å
91S97.5Very high95.4Very high25 Ų2557.5 Ų57.518%0.17530%0.298CS..Hα-helixtrans-66.5-42.1176.9-58.70000112.2W55 I87 L88 L89 I93 W94 Y95W55-S91 PolarHBondContact NE1-OG 3.39Å; I87-S91 VanDerWaalsContact O-CB 3.26Å; I87-S91 WeakPolarHBondContact O-CB 3.33Å; I87-S91 PolarHBondContact O-N 3.04Å; I87-S91 PolarHBondContact O-OG 2.82Å; L88-S91 PolarHBondContact O-N 3.01Å; L89-S91 VanDerWaalsContact C-N 3.31Å; L89-S91 PolarHBondContact O-N 3.08Å; S91-I93 VanDerWaalsContact C-N 3.35Å; S91-W94 PolarHBondContact O-N 3.29Å; S91-Y95 PolarHBondContact O-N 3.48Å
92A97.3Very high95.3Very high48 Ų4862.5 Ų62.540%0.39733%0.326SS..Hα-helixtrans-62.2-43.6175.600000111.1L88 L89 Y95 L96L88-A92 WeakPolarHBondContact O-CB 3.26Å; L88-A92 PolarHBondContact O-N 3.13Å; L89-A92 PolarHBondContact O-N 2.9Å; A92-Y95 PolarHBondContact O-N 3.49Å; A92-L96 WeakPolarHBondContact O-CB 3.47Å; A92-L96 VanDerWaalsContact O-CG 3.27Å; A92-L96 WeakPolarHBondContact O-CG 3.41Å; A92-L96 PolarHBondContact O-N 3.27Å
93I97.3Very high95.2Very high4 Ų459.9 Ų59.92%0.02132%0.315CS..Hα-helixtrans-65-43.2176.8-64160000110.8L27 Y30 I31 I34 L89 A90 S91 Y95 L96 V97 F105L27-I93 HydrophobicContact CD1-CD1 3.44Å; L27-I93 VanDerWaalsContact CD1-CD1 3.44Å; L27-I93 HydrophobicContact CD1-CG1 3.9Å; Y30-I93 VanDerWaalsContact CB-CD1 3.43Å; Y30-I93 HydrophobicContact CD2-CD1 3.85Å; Y30-I93 HydrophobicContact CG-CD1 4.15Å; I31-I93 HydrophobicContact CB-CG2 4.33Å; I31-I93 HydrophobicContact CG1-CD1 4.26Å; I31-I93 HydrophobicContact CG1-CG1 4.34Å; I31-I93 HydrophobicContact CG1-CG2 3.7Å; I34-I93 HydrophobicContact CD1-CB 4.03Å; I34-I93 HydrophobicContact CD1-CG2 3.74Å; L89-I93 HydrophobicContact CD1-CD1 4.26Å; L89-I93 HydrophobicContact CG-CD1 4.02Å; L89-I93 WeakPolarHBondContact O-CD1 3.14Å; L89-I93 WeakPolarHBondContact O-CG1 3.28Å; L89-I93 PolarHBondContact O-N 3.08Å; A90-I93 PolarHBondContact O-N 3.18Å; S91-I93 VanDerWaalsContact C-N 3.35Å; I93-Y95 VanDerWaalsContact C-N 3.3Å; I93-Y95 PolarHBondContact O-N 3.31Å; I93-L96 PolarHBondContact O-N 2.76Å; I93-V97 HydrophobicContact CG2-CG2 4.1Å; I93-V97 WeakPolarHBondContact O-CB 3.41Å; I93-V97 VanDerWaalsContact O-CG2 3.25Å; I93-V97 WeakPolarHBondContact O-CG2 3.42Å; I93-V97 PolarHBondContact O-N 3.27Å; I93-F105 HydrophobicContact CG2-CE1 4.47Å
94W97.9Very high95.2Very high28 Ų2859.3 Ų59.311%0.10632%0.32CS..Hα-helixtrans-55.7-48.4174.1165.179.5000111I34 P51 S54 W55 A58 A90 S91 L96 V97 F98 F99I34-W94 HydrophobicContact CD1-CB 3.99Å; P51-W94 HydrophobicContact CB-CH2 4.47Å; P51-W94 WeakPolarHBondContact O-CZ2 3.46Å; S54-W94 PolarHBondContact OG-NE1 2.91Å; W55-W94 HydrophobicContact CB-CD2 4.22Å; W55-W94 HydrophobicContact CB-CE3 4.4Å; W55-W94 HydrophobicContact CB-CH2 3.97Å; W55-W94 HydrophobicContact CB-CZ2 3.77Å; W55-W94 HydrophobicContact CB-CZ3 4.29Å; W55-W94 AromaticContact CD1-CD2 3.97Å; W55-W94 AromaticContact CD1-CE3 3.7Å; W55-W94 HydrophobicContact CG-CE3 4.46Å; A58-W94 HydrophobicContact CB-CB 4.06Å; A58-W94 VanDerWaalsContact CB-CD1 3.46Å; A58-W94 HydrophobicContact CB-CG 3.92Å; A90-W94 WeakPolarHBondContact O-CB 3.29Å; A90-W94 PolarHBondContact O-N 3.29Å; S91-W94 PolarHBondContact O-N 3.29Å; W94-L96 PolarHBondContact O-N 3.26Å; W94-V97 PolarHBondContact O-N 3.46Å; W94-F98 AromaticContact CD1-CD2 3.5Å; W94-F98 VanDerWaalsContact CD1-CD2 3.5Å; W94-F98 AromaticContact CD1-CE2 3.75Å; W94-F98 HydrophobicContact CG-CD2 4.34Å; W94-F98 AromaticContact NE1-CD2 3.71Å; W94-F98 WeakPolarHBondContact O-CD2 3.32Å; W94-F98 PolarHBondContact O-N 3.39Å; W94-F99 AromaticContact CH2-CE2 3.71Å; W94-F99 HydrophobicContact CH2-CE2 3.71Å; W94-F99 HydrophobicContact CH2-CZ 4.32Å; W94-F99 AromaticContact CZ2-CE2 3.61Å; W94-F99 HydrophobicContact CZ2-CE2 3.61Å; W94-F99 HydrophobicContact CZ2-CZ 4.16Å; W94-F99 HydrophobicContact CZ3-CE2 4.26Å
95Y97.1Very high95.2Very high134 Ų13456.2 Ų56.253%0.52530%0.301SS..Hα-helixtrans-60.8-47.2178.8-175.9-96.8000111.8S91 A92 I93 V97 F98 F99S91-Y95 PolarHBondContact O-N 3.48Å; A92-Y95 PolarHBondContact O-N 3.49Å; I93-Y95 VanDerWaalsContact C-N 3.3Å; I93-Y95 PolarHBondContact O-N 3.31Å; Y95-V97 PolarHBondContact O-N 2.85Å; Y95-F98 PolarHBondContact O-N 2.99Å; Y95-F99 HydrophobicContact CD2-CB 4.15Å; Y95-F99 AromaticContact CD2-CD2 3.75Å; Y95-F99 HydrophobicContact CD2-CD2 3.75Å; Y95-F99 HydrophobicContact CD2-CG 4.21Å; Y95-F99 HydrophobicContact CE2-CB 3.89Å; Y95-F99 HydrophobicContact CE2-CD2 4.13Å; Y95-F99 HydrophobicContact CE2-CG 4.14Å; Y95-F99 HydrophobicContact CG-CD2 4.41Å; Y95-F99 WeakPolarHBondContact O-CA 3.19Å; Y95-F99 WeakPolarHBondContact O-CB 3.16Å; Y95-F99 PolarHBondContact O-N 3.07Å
96L96.6Very high95.1Very high65 Ų6555.3 Ų55.334%0.3429%0.286SS..Hα-helixtrans-64.1-38.6178.4-70.3173.4000112.6A92 I93 W94 C100 F105A92-L96 WeakPolarHBondContact O-CB 3.47Å; A92-L96 VanDerWaalsContact O-CG 3.27Å; A92-L96 WeakPolarHBondContact O-CG 3.41Å; A92-L96 PolarHBondContact O-N 3.27Å; I93-L96 PolarHBondContact O-N 2.76Å; W94-L96 PolarHBondContact O-N 3.26Å; L96-C100 WeakPolarHBondContact O-CB 3.49Å; L96-C100 PolarHBondContact O-N 2.88Å; L96-F105 HydrophobicContact CB-CB 4.24Å; L96-F105 HydrophobicContact CB-CD1 3.71Å; L96-F105 HydrophobicContact CB-CD2 4.13Å; L96-F105 HydrophobicContact CB-CE1 4.05Å; L96-F105 HydrophobicContact CB-CE2 4.43Å; L96-F105 HydrophobicContact CB-CG 3.75Å; L96-F105 HydrophobicContact CB-CZ 4.39Å; L96-F105 HydrophobicContact CD1-CD2 4.13Å; L96-F105 HydrophobicContact CD1-CE2 3.99Å; L96-F105 HydrophobicContact CD1-CZ 4.33Å
97V96.4Very high95.1Very high0 Ų060.1 Ų60.10%031%0.307CS..Hα-helixtrans-69.6-39.5179.3171.90000111.4I34 L35 K38 I93 W94 Y95 F105I34-V97 HydrophobicContact CG2-CB 3.83Å; I34-V97 HydrophobicContact CG2-CG1 3.89Å; I34-V97 HydrophobicContact CG2-CG2 4.01Å; L35-V97 HydrophobicContact CD2-CG1 4.32Å; K38-V97 HydrophobicContact CB-CG1 4.23Å; K38-V97 HydrophobicContact CD-CG1 3.52Å; K38-V97 PolarHBondContact NZ-O 2.9Å; I93-V97 HydrophobicContact CG2-CG2 4.1Å; I93-V97 WeakPolarHBondContact O-CB 3.41Å; I93-V97 VanDerWaalsContact O-CG2 3.25Å; I93-V97 WeakPolarHBondContact O-CG2 3.42Å; I93-V97 PolarHBondContact O-N 3.27Å; W94-V97 PolarHBondContact O-N 3.46Å; Y95-V97 PolarHBondContact O-N 2.85Å; V97-F105 HydrophobicContact CG2-CD1 3.76Å; V97-F105 HydrophobicContact CG2-CE1 3.61Å
98F95.3Very high95Very high26 Ų2662.3 Ų62.311%0.11432%0.323CS..Hα-helixtrans-92.2-35.9-174.5-80.2-85.2000114.7I34 L37 K38 V44 A47 W94 Y95I34-F98 HydrophobicContact CG2-CD2 4.35Å; I34-F98 HydrophobicContact CG2-CE2 3.94Å; L37-F98 HydrophobicContact CD2-CE2 4.33Å; L37-F98 HydrophobicContact CD2-CZ 4.37Å; L37-F98 HydrophobicContact CG-CZ 4.23Å; K38-F98 HydrophobicContact CB-CE1 4.23Å; K38-F98 HydrophobicContact CB-CE2 4.4Å; K38-F98 HydrophobicContact CB-CZ 3.85Å; K38-F98 HydrophobicContact CD-CE1 4.5Å; K38-F98 HydrophobicContact CG-CE1 4.25Å; K38-F98 HydrophobicContact CG-CZ 4.38Å; V44-F98 HydrophobicContact CG2-CE1 4.42Å; A47-F98 HydrophobicContact CB-CB 4.41Å; A47-F98 HydrophobicContact CB-CD1 3.38Å; A47-F98 HydrophobicContact CB-CE1 3.82Å; A47-F98 HydrophobicContact CB-CG 4.03Å; W94-F98 AromaticContact CD1-CD2 3.5Å; W94-F98 VanDerWaalsContact CD1-CD2 3.5Å; W94-F98 AromaticContact CD1-CE2 3.75Å; W94-F98 HydrophobicContact CG-CD2 4.34Å; W94-F98 AromaticContact NE1-CD2 3.71Å; W94-F98 WeakPolarHBondContact O-CD2 3.32Å; W94-F98 PolarHBondContact O-N 3.39Å; Y95-F98 PolarHBondContact O-N 2.99Å
99F95.3Very high95Very high71 Ų7157 Ų5731%0.31130%0.296SS..Hα-helixtrans-119.5-2.2-167.1-55.4-83.9000114.8A47 W94 Y95A47-F99 HydrophobicContact CB-CZ 4.25Å; A47-F99 WeakPolarHBondContact O-CZ 3.42Å; W94-F99 AromaticContact CH2-CE2 3.71Å; W94-F99 HydrophobicContact CH2-CE2 3.71Å; W94-F99 HydrophobicContact CH2-CZ 4.32Å; W94-F99 AromaticContact CZ2-CE2 3.61Å; W94-F99 HydrophobicContact CZ2-CE2 3.61Å; W94-F99 HydrophobicContact CZ2-CZ 4.16Å; W94-F99 HydrophobicContact CZ3-CE2 4.26Å; Y95-F99 HydrophobicContact CD2-CB 4.15Å; Y95-F99 AromaticContact CD2-CD2 3.75Å; Y95-F99 HydrophobicContact CD2-CD2 3.75Å; Y95-F99 HydrophobicContact CD2-CG 4.21Å; Y95-F99 HydrophobicContact CE2-CB 3.89Å; Y95-F99 HydrophobicContact CE2-CD2 4.13Å; Y95-F99 HydrophobicContact CE2-CG 4.14Å; Y95-F99 HydrophobicContact CG-CD2 4.41Å; Y95-F99 WeakPolarHBondContact O-CA 3.19Å; Y95-F99 WeakPolarHBondContact O-CB 3.16Å; Y95-F99 PolarHBondContact O-N 3.07Å
100C94.1Very high94.8Very high24 Ų2456.2 Ų56.216%0.16230%0.295CS..  trans-57.8131.2177.9178.10000111.4L96 N103 F105L96-C100 WeakPolarHBondContact O-CB 3.49Å; L96-C100 PolarHBondContact O-N 2.88Å; C100-N103 WeakPolarHBondContact O-CA 3.25Å; C100-N103 PolarHBondContact O-N 3.49Å; C100-F105 HydrophobicContact CB-CB 3.96Å
101P90.7Very high94.6Very high104 Ų10462.2 Ų62.268%0.67532%0.322SS*.G310 helixtrans-57.4143.7-179.424.5-34.7000110.9N103 L104P101-N103 PolarHBondContact O-N 3.44Å; P101-L104 PolarHBondContact O-N 2.92Å
102L89.6Confident94.3Very high154 Ų15464.6 Ų64.681%0.80633%0.332SS*.G310 helixtrans58.510.3-176.8-52.9174000114.9L104 K107L102-L104 PolarHBondContact O-N 2.95Å; L102-K107 PolarHBondContact O-NZ 3.23Å; L102-K107 VanDerWaalsContact O-NZ 3.11Å
103N91.3Very high94.1Very high52 Ų5265.6 Ų65.628%0.27834%0.335SS..G310 helixtrans55.132.6-174.8-156.426.7000111.7K38 C100 P101 Y106 K107K38-N103 PolarHBondContact NZ-OD1 3.26Å; C100-N103 WeakPolarHBondContact O-CA 3.25Å; C100-N103 PolarHBondContact O-N 3.49Å; P101-N103 PolarHBondContact O-N 3.44Å; N103-Y106 WeakPolarHBondContact ND2-CD1 3.43Å; N103-Y106 WeakPolarHBondContact OD1-CB 3.42Å; N103-K107 WeakPolarHBondContact O-CG 3.42Å; N103-K107 PolarHBondContact O-N 3.15Å
104L93.3Very high94Very high106 Ų10668.3 Ų68.356%0.55535%0.351SS*.Hα-helixtrans-62.8-49.5-171.6-178.265.7000111.6P101 L102 Y106 K107 C108P101-L104 PolarHBondContact O-N 2.92Å; L102-L104 PolarHBondContact O-N 2.95Å; L104-Y106 PolarHBondContact O-N 3.24Å; L104-K107 WeakPolarHBondContact O-CB 3.36Å; L104-K107 PolarHBondContact O-N 2.93Å; L104-K107 VanDerWaalsContact O-N 3.1Å; L104-C108 PolarHBondContact O-N 3.45Å; L104-C108 PolarHBondContact O-SG 3.35Å
105F94.7Very high93.8Very high49 Ų4968.9 Ų68.922%0.21535%0.354CS..Hα-helixtrans-56.6-50-179.9-174.3-98.1000111.6I31 I93 L96 V97 C100 K107 C108 V109I31-F105 HydrophobicContact CD1-CZ 4.16Å; I31-F105 HydrophobicContact CG1-CE1 4.47Å; I31-F105 HydrophobicContact CG1-CZ 4.17Å; I93-F105 HydrophobicContact CG2-CE1 4.47Å; L96-F105 HydrophobicContact CB-CB 4.24Å; L96-F105 HydrophobicContact CB-CD1 3.71Å; L96-F105 HydrophobicContact CB-CD2 4.13Å; L96-F105 HydrophobicContact CB-CE1 4.05Å; L96-F105 HydrophobicContact CB-CE2 4.43Å; L96-F105 HydrophobicContact CB-CG 3.75Å; L96-F105 HydrophobicContact CB-CZ 4.39Å; L96-F105 HydrophobicContact CD1-CD2 4.13Å; L96-F105 HydrophobicContact CD1-CE2 3.99Å; L96-F105 HydrophobicContact CD1-CZ 4.33Å; V97-F105 HydrophobicContact CG2-CD1 3.76Å; V97-F105 HydrophobicContact CG2-CE1 3.61Å; C100-F105 HydrophobicContact CB-CB 3.96Å; F105-K107 VanDerWaalsContact C-N 3.35Å; F105-K107 PolarHBondContact O-N 3.49Å; F105-C108 WeakPolarHBondContact O-CB 3.35Å; F105-C108 PolarHBondContact O-N 2.92Å; F105-V109 HydrophobicContact CD1-CG1 4.49Å; F105-V109 HydrophobicContact CD1-CG2 4.37Å; F105-V109 HydrophobicContact CE1-CG1 4.04Å; F105-V109 HydrophobicContact CE1-CG2 4.3Å; F105-V109 HydrophobicContact CE2-CG1 4.37Å; F105-V109 HydrophobicContact CZ-CG1 3.98Å; F105-V109 WeakPolarHBondContact O-CG2 3.47Å; F105-V109 PolarHBondContact O-N 3.28Å
106Y94.3Very high93.7Very high57 Ų5764.3 Ų64.322%0.22434%0.339CS..Hα-helixtrans-55.4-46.7174.8168.8-96.1000112.2L35 K38 Y39 N103 L104 C108 V109 A110L35-Y106 HydrophobicContact CD2-CD2 3.51Å; L35-Y106 HydrophobicContact CD2-CE2 3.8Å; K38-Y106 HydrophobicContact CD-CD2 3.89Å; K38-Y106 HydrophobicContact CD-CE2 4.2Å; Y39-Y106 AromaticContact CE1-CE2 3.9Å; Y39-Y106 HydrophobicContact CE1-CE2 3.9Å; N103-Y106 WeakPolarHBondContact ND2-CD1 3.43Å; N103-Y106 WeakPolarHBondContact OD1-CB 3.42Å; L104-Y106 PolarHBondContact O-N 3.24Å; Y106-C108 VanDerWaalsContact C-N 3.3Å; Y106-C108 PolarHBondContact O-N 3.47Å; Y106-V109 PolarHBondContact O-N 3.21Å; Y106-A110 HydrophobicContact CD2-CB 4.44Å; Y106-A110 HydrophobicContact CE1-CB 4.29Å; Y106-A110 HydrophobicContact CE2-CB 4.14Å; Y106-A110 WeakPolarHBondContact O-CB 3.43Å; Y106-A110 PolarHBondContact O-N 3.28Å
107K93.1Very high93.6Very high128 Ų12865.5 Ų65.556%0.55735%0.349SS*.Hα-helixtrans-59.7-41.2178.4-73.5170178.3169.40111.7L102 N103 L104 F105 F111L102-K107 PolarHBondContact O-NZ 3.23Å; L102-K107 VanDerWaalsContact O-NZ 3.11Å; N103-K107 WeakPolarHBondContact O-CG 3.42Å; N103-K107 PolarHBondContact O-N 3.15Å; L104-K107 WeakPolarHBondContact O-CB 3.36Å; L104-K107 PolarHBondContact O-N 2.93Å; L104-K107 VanDerWaalsContact O-N 3.1Å; F105-K107 VanDerWaalsContact C-N 3.35Å; F105-K107 PolarHBondContact O-N 3.49Å; K107-F111 PolarHBondContact O-N 3.43Å; K107-F111 VanDerWaalsContact O-N 3.12Å
108C95.1Very high93.6Very high68 Ų6866.5 Ų66.546%0.45935%0.354SS..Hα-helixtrans-64-47.9177.2-64.20000112.2L104 F105 Y106 F111L104-C108 PolarHBondContact O-N 3.45Å; L104-C108 PolarHBondContact O-SG 3.35Å; F105-C108 WeakPolarHBondContact O-CB 3.35Å; F105-C108 PolarHBondContact O-N 2.92Å; Y106-C108 VanDerWaalsContact C-N 3.3Å; Y106-C108 PolarHBondContact O-N 3.47Å; C108-F111 WeakPolarHBondContact O-CB 3.46Å; C108-F111 PolarHBondContact O-N 3.34Å
109V94.9Very high93.5Very high11 Ų1165.3 Ų65.37%0.06735%0.349CS..Hα-helixtrans-80.8-20.8-176.8-600000113.6I31 L35 F105 Y106 L118I31-V109 HydrophobicContact CD1-CG1 4.41Å; I31-V109 HydrophobicContact CG2-CB 3.76Å; I31-V109 HydrophobicContact CG2-CG1 3.85Å; I31-V109 HydrophobicContact CG2-CG2 3.95Å; L35-V109 HydrophobicContact CD1-CB 4.21Å; L35-V109 HydrophobicContact CD1-CG2 3.73Å; L35-V109 HydrophobicContact CD2-CG2 3.84Å; L35-V109 HydrophobicContact CG-CG2 4.1Å; F105-V109 HydrophobicContact CD1-CG1 4.49Å; F105-V109 HydrophobicContact CD1-CG2 4.37Å; F105-V109 HydrophobicContact CE1-CG1 4.04Å; F105-V109 HydrophobicContact CE1-CG2 4.3Å; F105-V109 HydrophobicContact CE2-CG1 4.37Å; F105-V109 HydrophobicContact CZ-CG1 3.98Å; F105-V109 WeakPolarHBondContact O-CG2 3.47Å; F105-V109 PolarHBondContact O-N 3.28Å; Y106-V109 PolarHBondContact O-N 3.21Å; V109-L118 HydrophobicContact CB-CD1 3.96Å; V109-L118 HydrophobicContact CG1-CD1 4.23Å
110A92.8Very high93.5Very high26 Ų2663.2 Ų63.222%0.21535%0.345CS..Hα-helixtrans-85.4-13.6174.200000112.7Y106 L112Y106-A110 HydrophobicContact CD2-CB 4.44Å; Y106-A110 HydrophobicContact CE1-CB 4.29Å; Y106-A110 HydrophobicContact CE2-CB 4.14Å; Y106-A110 WeakPolarHBondContact O-CB 3.43Å; Y106-A110 PolarHBondContact O-N 3.28Å; A110-L112 PolarHBondContact O-N 3.01Å
111F92.5Very high93.5Very high126 Ų12664.1 Ų64.155%0.55335%0.348SS*.SBendtrans-57.9125.5172.8-179.6-126.5000109.9K107 C108 P113 V114 K115K107-F111 PolarHBondContact O-N 3.43Å; K107-F111 VanDerWaalsContact O-N 3.12Å; C108-F111 WeakPolarHBondContact O-CB 3.46Å; C108-F111 PolarHBondContact O-N 3.34Å; F111-P113 HydrophobicContact CD1-CB 4.37Å; F111-P113 HydrophobicContact CD1-CG 4.1Å; F111-P113 HydrophobicContact CE1-CB 4.02Å; F111-P113 VanDerWaalsContact CE1-CD 3.47Å; F111-P113 HydrophobicContact CE1-CG 3.5Å; F111-P113 VanDerWaalsContact CE1-CG 3.5Å; F111-P113 HydrophobicContact CE2-CG 4.34Å; F111-P113 HydrophobicContact CZ-CG 3.63Å; F111-V114 HydrophobicContact CD1-CG2 3.98Å; F111-V114 PolarHBondContact O-N 3.34Å; F111-K115 WeakPolarHBondContact O-CB 3.47Å; F111-K115 PolarHBondContact O-N 3.17Å
112L91.3Very high93.7Very high75 Ų7560 Ų6039%0.39332%0.319SS..Hα-helixtrans-53-49.9-164.2-178.770.4000113.6A110 V114 K115 L116A110-L112 PolarHBondContact O-N 3.01Å; L112-V114 VanDerWaalsContact C-N 3.32Å; L112-V114 PolarHBondContact O-N 3.5Å; L112-K115 WeakPolarHBondContact O-CB 3.33Å; L112-K115 PolarHBondContact O-N 2.88Å; L112-K115 VanDerWaalsContact O-N 3.17Å; L112-L116 HydrophobicContact CD1-CD2 4.24Å; L112-L116 HydrophobicContact CD1-CG 4.2Å; L112-L116 HydrophobicContact CG-CD1 4.31Å; L112-L116 HydrophobicContact CG-CG 4.36Å; L112-L116 VanDerWaalsContact O-CG 3.31Å; L112-L116 WeakPolarHBondContact O-CG 3.37Å; L112-L116 PolarHBondContact O-N 3.01Å
113P93.6Very high94Very high70 Ų7052.8 Ų52.846%0.45528%0.282SS..Hα-helixtrans-56.4-43.6177.5-26.435.8000113.6F111 L116 V117F111-P113 HydrophobicContact CD1-CB 4.37Å; F111-P113 HydrophobicContact CD1-CG 4.1Å; F111-P113 HydrophobicContact CE1-CB 4.02Å; F111-P113 VanDerWaalsContact CE1-CD 3.47Å; F111-P113 HydrophobicContact CE1-CG 3.5Å; F111-P113 VanDerWaalsContact CE1-CG 3.5Å; F111-P113 HydrophobicContact CE2-CG 4.34Å; F111-P113 HydrophobicContact CZ-CG 3.63Å; P113-L116 PolarHBondContact O-N 3.15Å; P113-V117 PolarHBondContact O-N 3.48Å
114V95.2Very high94.1Very high61 Ų6150.8 Ų50.837%0.3727%0.271SS..Hα-helixtrans-67.1-44.9177.9175.60000110.1F111 L112 L116 V117 L118F111-V114 HydrophobicContact CD1-CG2 3.98Å; F111-V114 PolarHBondContact O-N 3.34Å; L112-V114 VanDerWaalsContact C-N 3.32Å; L112-V114 PolarHBondContact O-N 3.5Å; V114-L116 VanDerWaalsContact C-N 3.3Å; V114-L116 PolarHBondContact O-N 2.9Å; V114-V117 PolarHBondContact O-N 3.12Å; V114-L118 HydrophobicContact CG1-CD1 3.86Å; V114-L118 HydrophobicContact CG1-CG 4.28Å; V114-L118 VanDerWaalsContact O-CG 3.3Å; V114-L118 WeakPolarHBondContact O-CG 3.42Å; V114-L118 PolarHBondContact O-N 2.85Å
115K93.6Very high94.2Very high39 Ų3945.9 Ų45.917%0.1725%0.246CC..Hα-helixtrans-58.4-40.9177.8-172.4177.4178.7177.70111.9Y39 F111 L112 L118 V119 T228Y39-K115 PolarHBondContact OH-NZ 3.01Å; F111-K115 WeakPolarHBondContact O-CB 3.47Å; F111-K115 PolarHBondContact O-N 3.17Å; L112-K115 WeakPolarHBondContact O-CB 3.33Å; L112-K115 PolarHBondContact O-N 2.88Å; L112-K115 VanDerWaalsContact O-N 3.17Å; K115-L118 PolarHBondContact O-N 2.88Å; K115-V119 HydrophobicContact CG-CG2 4.43Å; K115-V119 WeakPolarHBondContact O-CB 3.39Å; K115-V119 VanDerWaalsContact O-CG2 3.25Å; K115-V119 WeakPolarHBondContact O-CG2 3.41Å; K115-V119 PolarHBondContact O-N 3.34Å; K115-T228 HydrophobicContact CD-CG2 4.46Å
116L93.8Very high94.2Very high38 Ų3844.5 Ų44.520%0.19924%0.239CC..Hα-helixtrans-64-42.9178.5-67.5-179.7000111.9L112 P113 V114 V119 A120 V225 T228 A229L112-L116 HydrophobicContact CD1-CD2 4.24Å; L112-L116 HydrophobicContact CD1-CG 4.2Å; L112-L116 HydrophobicContact CG-CD1 4.31Å; L112-L116 HydrophobicContact CG-CG 4.36Å; L112-L116 VanDerWaalsContact O-CG 3.31Å; L112-L116 WeakPolarHBondContact O-CG 3.37Å; L112-L116 PolarHBondContact O-N 3.01Å; P113-L116 PolarHBondContact O-N 3.15Å; V114-L116 VanDerWaalsContact C-N 3.3Å; V114-L116 PolarHBondContact O-N 2.9Å; L116-V119 PolarHBondContact O-N 2.97Å; L116-A120 PolarHBondContact O-N 3.06Å; L116-V225 HydrophobicContact CD2-CG1 4.24Å; L116-T228 HydrophobicContact CD2-CG2 3.81Å; L116-A229 HydrophobicContact CD1-CB 4.46Å; L116-A229 HydrophobicContact CD2-CB 4.23Å
117V95.4Very high94.3Very high90 Ų9041.8 Ų41.855%0.54523%0.228SC..Hα-helixtrans-62.5-47175175.70000110.7P113 V114 V119 A120 L121P113-V117 PolarHBondContact O-N 3.48Å; V114-V117 PolarHBondContact O-N 3.12Å; V117-V119 VanDerWaalsContact C-N 3.32Å; V117-V119 PolarHBondContact O-N 2.89Å; V117-A120 PolarHBondContact O-N 3.35Å; V117-L121 HydrophobicContact CG1-CD1 4.15Å; V117-L121 HydrophobicContact CG1-CG 4.48Å; V117-L121 WeakPolarHBondContact O-CG 3.37Å; V117-L121 PolarHBondContact O-N 2.95Å
118L95.3Very high94.3Very high21 Ų2137.7 Ų37.711%0.1121%0.209CC..Hα-helixtrans-61.9-40179.1-66.7171.7000112.2A28 I31 V32 V109 V114 K115 L121 K122A28-L118 HydrophobicContact CB-CD2 3.73Å; I31-L118 HydrophobicContact CD1-CD2 4.31Å; I31-L118 HydrophobicContact CG2-CD1 3.81Å; V32-L118 HydrophobicContact CG2-CB 3.55Å; V109-L118 HydrophobicContact CB-CD1 3.96Å; V109-L118 HydrophobicContact CG1-CD1 4.23Å; V114-L118 HydrophobicContact CG1-CD1 3.86Å; V114-L118 HydrophobicContact CG1-CG 4.28Å; V114-L118 VanDerWaalsContact O-CG 3.3Å; V114-L118 WeakPolarHBondContact O-CG 3.42Å; V114-L118 PolarHBondContact O-N 2.85Å; K115-L118 PolarHBondContact O-N 2.88Å; L118-L121 PolarHBondContact O-N 2.98Å; L118-K122 WeakPolarHBondContact O-CB 3.35Å; L118-K122 PolarHBondContact O-N 3.11Å
119V94.6Very high94.3Very high1 Ų135 Ų351%0.00619%0.19CC..Hα-helixtrans-62.9-44.9175.11670000110.7V32 K115 L116 V117 L121 K122 E123 K224 T228V32-V119 HydrophobicContact CG1-CG2 4.2Å; V32-V119 HydrophobicContact CG2-CG2 4.39Å; K115-V119 HydrophobicContact CG-CG2 4.43Å; K115-V119 WeakPolarHBondContact O-CB 3.39Å; K115-V119 VanDerWaalsContact O-CG2 3.25Å; K115-V119 WeakPolarHBondContact O-CG2 3.41Å; K115-V119 PolarHBondContact O-N 3.34Å; L116-V119 PolarHBondContact O-N 2.97Å; V117-V119 VanDerWaalsContact C-N 3.32Å; V117-V119 PolarHBondContact O-N 2.89Å; V119-L121 PolarHBondContact O-N 3.1Å; V119-K122 WeakPolarHBondContact O-CB 3.1Å; V119-K122 PolarHBondContact O-N 2.77Å; V119-E123 WeakPolarHBondContact O-CG 3.49Å; V119-E123 PolarHBondContact O-N 2.93Å; V119-E123 VanDerWaalsContact O-N 3.16Å; V119-K224 HydrophobicContact CG1-CB 3.82Å; V119-T228 HydrophobicContact CG2-CG2 4.43Å
120A94.3Very high94.4Very high28 Ų2834.5 Ų34.523%0.23119%0.187CC..Hα-helixtrans-59.1-46.7176.600000111.7L116 V117 K122 E123 V124 A221 V225L116-A120 PolarHBondContact O-N 3.06Å; V117-A120 PolarHBondContact O-N 3.35Å; A120-K122 VanDerWaalsContact C-N 3.35Å; A120-K122 PolarHBondContact O-N 2.74Å; A120-E123 PolarHBondContact O-N 2.78Å; A120-E123 VanDerWaalsContact O-N 3.16Å; A120-V124 PolarHBondContact O-N 3.19Å; A120-A221 HydrophobicContact CB-CB 4.33Å; A120-V225 HydrophobicContact CB-CG2 3.94Å
121L94.7Very high94.5Very high42 Ų4233.5 Ų33.522%0.2218%0.179CC..Hα-helixtrans-62-39.6177.4-66.7174.2000112.5F25 A28 V117 L118 V119 E123 V124 V125F25-L121 HydrophobicContact CD1-CB 4.34Å; F25-L121 HydrophobicContact CD1-CD2 3.72Å; F25-L121 HydrophobicContact CE1-CD2 3.48Å; F25-L121 VanDerWaalsContact CE1-CD2 3.48Å; F25-L121 HydrophobicContact CZ-CD2 4.29Å; A28-L121 HydrophobicContact CB-CB 3.57Å; A28-L121 HydrophobicContact CB-CD1 3.79Å; A28-L121 HydrophobicContact CB-CG 4.35Å; V117-L121 HydrophobicContact CG1-CD1 4.15Å; V117-L121 HydrophobicContact CG1-CG 4.48Å; V117-L121 WeakPolarHBondContact O-CG 3.37Å; V117-L121 PolarHBondContact O-N 2.95Å; L118-L121 PolarHBondContact O-N 2.98Å; V119-L121 PolarHBondContact O-N 3.1Å; L121-E123 VanDerWaalsContact C-N 3.27Å; L121-E123 PolarHBondContact O-N 3.39Å; L121-V124 WeakPolarHBondContact O-CB 3.44Å; L121-V124 PolarHBondContact O-N 3.29Å; L121-V125 WeakPolarHBondContact O-CG2 3.13Å; L121-V125 PolarHBondContact O-N 3.42Å
122K94.6Very high94.6Very high19 Ų1929.9 Ų29.98%0.08317%0.172CC..Hα-helixtrans-58.2-39.7174.4167.4167.5-179.2159.80112Y29 V32 S33 L118 V119 A120 V124 V125 R126Y29-K122 HydrophobicContact CD2-CD 4.38Å; Y29-K122 HydrophobicContact CD2-CG 3.8Å; Y29-K122 HydrophobicContact CE2-CG 4.31Å; V32-K122 HydrophobicContact CB-CB 4.48Å; V32-K122 HydrophobicContact CB-CD 3.73Å; V32-K122 HydrophobicContact CG1-CD 3.43Å; V32-K122 VanDerWaalsContact CG1-CD 3.43Å; S33-K122 PolarHBondContact OG-NZ 3.32Å; L118-K122 WeakPolarHBondContact O-CB 3.35Å; L118-K122 PolarHBondContact O-N 3.11Å; V119-K122 WeakPolarHBondContact O-CB 3.1Å; V119-K122 PolarHBondContact O-N 2.77Å; A120-K122 VanDerWaalsContact C-N 3.35Å; A120-K122 PolarHBondContact O-N 2.74Å; K122-V124 VanDerWaalsContact C-N 3.33Å; K122-V125 WeakPolarHBondContact O-CB 3.39Å; K122-V125 PolarHBondContact O-N 3.31Å; K122-R126 PolarHBondContact O-N 3.42Å
123E95Very high94.8Very high2 Ų226.3 Ų26.31%0.00915%0.153CC..Hα-helixtrans-72-27.8-179.7-61.5-51.9140.300112.6V119 A120 L121 V125 R126 T127 M220 A221 K224V119-E123 WeakPolarHBondContact O-CG 3.49Å; V119-E123 PolarHBondContact O-N 2.93Å; V119-E123 VanDerWaalsContact O-N 3.16Å; A120-E123 PolarHBondContact O-N 2.78Å; A120-E123 VanDerWaalsContact O-N 3.16Å; L121-E123 VanDerWaalsContact C-N 3.27Å; L121-E123 PolarHBondContact O-N 3.39Å; E123-V125 VanDerWaalsContact C-N 3.32Å; E123-V125 PolarHBondContact O-N 3.49Å; E123-R126 PolarHBondContact O-N 3.48Å; E123-R126 IonicContact OE1-CZ 2.84Å; E123-R126 IonicContact OE1-NE 3.67Å; E123-R126 IonicContact OE1-NH2 2.69Å; E123-R126 PolarHBondContact OE1-NH2 3.23Å; E123-R126 VanDerWaalsContact OE1-NH2 3.11Å; E123-R126 WeakPolarHBondContact OE2-CD 3.48Å; E123-R126 IonicContact OE2-CZ 3.15Å; E123-R126 IonicContact OE2-NE 3.84Å; E123-R126 PolarHBondContact OE2-NE 3.49Å; E123-R126 IonicContact OE2-NH2 3.59Å; E123-T127 PolarHBondContact O-N 2.67Å; E123-T127 PolarHBondContact O-OG1 3.36Å; E123-M220 HydrophobicContact CB-CB 4.08Å; E123-M220 WeakPolarHBondContact OE2-CE 3.36Å; E123-A221 HydrophobicContact CB-CB 4.44Å; E123-K224 HydrophobicContact CG-CB 3.85Å; E123-K224 HydrophobicContact CG-CG 3.71Å; E123-K224 WeakPolarHBondContact OE1-CE 3.49Å
124V94.6Very high95Very high10 Ų1023 Ų236%0.06113%0.131CC..Hα-helixtrans-59.3-45.1167.5-1760000111.1F16 F25 A120 L121 K122 R126 T127 R128 T217F16-V124 HydrophobicContact CE1-CG1 4.19Å; F16-V124 HydrophobicContact CE2-CG1 4.42Å; F16-V124 HydrophobicContact CZ-CB 4.4Å; F16-V124 HydrophobicContact CZ-CG1 3.61Å; F16-V124 HydrophobicContact CZ-CG2 4Å; F25-V124 HydrophobicContact CD1-CB 3.97Å; F25-V124 HydrophobicContact CD1-CG1 3.98Å; F25-V124 HydrophobicContact CD1-CG2 4.37Å; F25-V124 HydrophobicContact CE1-CB 4.06Å; F25-V124 HydrophobicContact CE1-CG1 3.86Å; F25-V124 HydrophobicContact CE1-CG2 4.08Å; A120-V124 PolarHBondContact O-N 3.19Å; L121-V124 WeakPolarHBondContact O-CB 3.44Å; L121-V124 PolarHBondContact O-N 3.29Å; K122-V124 VanDerWaalsContact C-N 3.33Å; V124-R126 VanDerWaalsContact C-N 3.34Å; V124-R126 PolarHBondContact O-N 3.01Å; V124-T127 PolarHBondContact O-N 3.37Å; V124-R128 PolarHBondContact O-N 2.83Å; V124-T217 HydrophobicContact CB-CG2 4.05Å; V124-T217 HydrophobicContact CG1-CG2 4.32Å; V124-T217 HydrophobicContact CG2-CG2 3.66Å
125V94.6Very high94.9Very high3 Ų324.1 Ų24.12%0.01813%0.133CC..Hα-helixtrans-63.6-42.5178.6-176.40000110.8M21 F25 Y29 L121 K122 E123 R128 K129M21-V125 HydrophobicContact CE-CB 3.61Å; M21-V125 HydrophobicContact CE-CG1 3.88Å; M21-V125 HydrophobicContact CE-CG2 3.22Å; F25-V125 HydrophobicContact CB-CG2 3.7Å; F25-V125 WeakPolarHBondContact O-CG2 3.36Å; Y29-V125 HydrophobicContact CD2-CB 3.82Å; Y29-V125 HydrophobicContact CD2-CG1 3.69Å; Y29-V125 HydrophobicContact CD2-CG2 4.42Å; Y29-V125 HydrophobicContact CE2-CG1 4.27Å; Y29-V125 HydrophobicContact CG-CB 4.36Å; Y29-V125 HydrophobicContact CG-CG1 4.01Å; L121-V125 WeakPolarHBondContact O-CG2 3.13Å; L121-V125 PolarHBondContact O-N 3.42Å; K122-V125 WeakPolarHBondContact O-CB 3.39Å; K122-V125 PolarHBondContact O-N 3.31Å; E123-V125 VanDerWaalsContact C-N 3.32Å; E123-V125 PolarHBondContact O-N 3.49Å; V125-R128 PolarHBondContact O-N 3.49Å; V125-K129 HydrophobicContact CG1-CD 4.27Å; V125-K129 HydrophobicContact CG1-CG 4.42Å; V125-K129 WeakPolarHBondContact O-CB 3.39Å; V125-K129 WeakPolarHBondContact O-CG 3.49Å; V125-K129 PolarHBondContact O-N 3.29Å
126R95.2Very high94.9Very high20 Ų2026.6 Ų26.68%0.07515%0.145CC..Hα-helixtrans-59.4-51.2177.9-169-166.9-58.7-97.93111.7K122 E123 V124 R128 K129 I130 G156K122-R126 PolarHBondContact O-N 3.42Å; E123-R126 PolarHBondContact O-N 3.48Å; E123-R126 IonicContact OE1-CZ 2.84Å; E123-R126 IonicContact OE1-NE 3.67Å; E123-R126 IonicContact OE1-NH2 2.69Å; E123-R126 PolarHBondContact OE1-NH2 3.23Å; E123-R126 VanDerWaalsContact OE1-NH2 3.11Å; E123-R126 WeakPolarHBondContact OE2-CD 3.48Å; E123-R126 IonicContact OE2-CZ 3.15Å; E123-R126 IonicContact OE2-NE 3.84Å; E123-R126 PolarHBondContact OE2-NE 3.49Å; E123-R126 IonicContact OE2-NH2 3.59Å; V124-R126 VanDerWaalsContact C-N 3.34Å; V124-R126 PolarHBondContact O-N 3.01Å; R126-R128 VanDerWaalsContact C-N 3.29Å; R126-R128 PolarHBondContact O-N 2.94Å; R126-K129 WeakPolarHBondContact O-CB 3.46Å; R126-K129 PolarHBondContact O-N 3.06Å; R126-K129 VanDerWaalsContact O-N 3.15Å; R126-I130 HydrophobicContact CG-CD1 4.14Å; R126-I130 WeakPolarHBondContact O-CG1 3.48Å; R126-I130 PolarHBondContact O-N 2.92Å; R126-G156 WeakPolarHBondContact CG-O 3.35Å; R126-G156 PolarHBondContact NH1-O 3.43Å
127T95.4Very high95Very high0 Ų024.8 Ų24.80%014%0.135CC..Hα-helixtrans-57.1-44.6179.9-61.30000111.8E123 V124 I130 A131 F197 I213 F216 T217E123-T127 PolarHBondContact O-N 2.67Å; E123-T127 PolarHBondContact O-OG1 3.36Å; V124-T127 PolarHBondContact O-N 3.37Å; T127-I130 PolarHBondContact O-N 3.38Å; T127-A131 PolarHBondContact O-N 3.02Å; T127-F197 HydrophobicContact CG2-CE2 3.99Å; T127-F197 HydrophobicContact CG2-CZ 3.74Å; T127-I213 HydrophobicContact CG2-CG2 4.26Å; T127-F216 HydrophobicContact CG2-CB 4.44Å; T127-F216 HydrophobicContact CG2-CD1 3.63Å; T127-F216 HydrophobicContact CG2-CE1 4.46Å; T127-F216 WeakPolarHBondContact OG1-CD1 3.48Å; T127-T217 VanDerWaalsContact CB-OG1 3.24Å; T127-T217 WeakPolarHBondContact CB-OG1 3.47Å; T127-T217 WeakPolarHBondContact CG2-OG1 3.39Å; T127-T217 PolarHBondContact OG1-OG1 3.03Å
128R94.2Very high94.9Very high42 Ų4222.7 Ų22.716%0.15812%0.119CC..Hα-helixtrans-67.4-37.4178.5-71.7-177.2176.4-156.58.4112.8F16 S17 M19 M21 V124 V125 R126 I130 A131 A132F16-R128 PolarHBondContact O-NH2 3.03Å; S17-R128 PolarHBondContact O-NH2 3.39Å; M19-R128 VanDerWaalsContact O-CZ 3.26Å; M19-R128 PolarHBondContact O-NH1 2.95Å; M19-R128 PolarHBondContact O-NH2 2.91Å; M21-R128 VanDerWaalsContact CG-NH1 3.3Å; M21-R128 WeakPolarHBondContact SD-CD 3.47Å; M21-R128 PolarHBondContact SD-NH1 3.2Å; V124-R128 PolarHBondContact O-N 2.83Å; V125-R128 PolarHBondContact O-N 3.49Å; R126-R128 VanDerWaalsContact C-N 3.29Å; R126-R128 PolarHBondContact O-N 2.94Å; R128-I130 VanDerWaalsContact C-N 3.35Å; R128-A131 PolarHBondContact O-N 3.19Å; R128-A132 WeakPolarHBondContact O-CB 3.41Å; R128-A132 PolarHBondContact O-N 3.31Å
129K95.3Very high94.8Very high11 Ų1128.4 Ų28.45%0.04815%0.145CC..Hα-helixtrans-59.8-43.8172.4-83-177.3160-175.30111.8Y29 S65 Y66 V125 R126 G133 K155Y29-K129 PolarHBondContact OH-NZ 3.3Å; S65-K129 WeakPolarHBondContact OG-CE 3.31Å; S65-K129 PolarHBondContact OG-NZ 3.31Å; Y66-K129 VanDerWaalsContact CE2-CE 3.46Å; Y66-K129 VanDerWaalsContact OH-CE 3.22Å; Y66-K129 WeakPolarHBondContact OH-CE 3.49Å; V125-K129 HydrophobicContact CG1-CD 4.27Å; V125-K129 HydrophobicContact CG1-CG 4.42Å; V125-K129 WeakPolarHBondContact O-CB 3.39Å; V125-K129 WeakPolarHBondContact O-CG 3.49Å; V125-K129 PolarHBondContact O-N 3.29Å; R126-K129 WeakPolarHBondContact O-CB 3.46Å; R126-K129 PolarHBondContact O-N 3.06Å; R126-K129 VanDerWaalsContact O-N 3.15Å; K129-G133 PolarHBondContact O-N 3.46Å; K129-K155 HydrophobicContact CB-CB 4.31Å; K129-K155 WeakPolarHBondContact O-CB 3.5Å; K129-K155 WeakPolarHBondContact O-CD 3.43Å
130I97Very high94.6Very high0 Ų031.1 Ų31.10%017%0.168CC..Hα-helixtrans-61-54.3176.6-62.9163.4000109.8R126 T127 R128 A132 G133 V134 A194 F197 F216R126-I130 HydrophobicContact CG-CD1 4.14Å; R126-I130 WeakPolarHBondContact O-CG1 3.48Å; R126-I130 PolarHBondContact O-N 2.92Å; T127-I130 PolarHBondContact O-N 3.38Å; R128-I130 VanDerWaalsContact C-N 3.35Å; I130-A132 VanDerWaalsContact C-N 3.31Å; I130-A132 PolarHBondContact O-N 3.35Å; I130-G133 PolarHBondContact O-N 3.04Å; I130-V134 WeakPolarHBondContact O-CG2 3.42Å; I130-V134 PolarHBondContact O-N 2.86Å; I130-A194 HydrophobicContact CG2-CB 4.07Å; I130-F197 HydrophobicContact CB-CD2 4.4Å; I130-F197 HydrophobicContact CG2-CD2 3.72Å; I130-F197 HydrophobicContact CG2-CE2 4.29Å; I130-F216 HydrophobicContact CD1-CE1 4.08Å
131A95.1Very high94.5Very high6 Ų635.1 Ų35.15%0.0518%0.177CC..Hα-helixtrans-59.9-40.6-179.200000112.3T127 R128 H135 F197 I213T127-A131 PolarHBondContact O-N 3.02Å; R128-A131 PolarHBondContact O-N 3.19Å; A131-H135 VanDerWaalsContact O-CB 3.32Å; A131-H135 WeakPolarHBondContact O-CB 3.22Å; A131-H135 PolarHBondContact O-N 2.96Å; A131-F197 HydrophobicContact CB-CD1 3.98Å; A131-F197 HydrophobicContact CB-CD2 4.34Å; A131-F197 HydrophobicContact CB-CE1 3.96Å; A131-F197 HydrophobicContact CB-CE2 4.32Å; A131-F197 HydrophobicContact CB-CG 4.21Å; A131-F197 HydrophobicContact CB-CZ 4.14Å; A131-I213 HydrophobicContact CB-CD1 4.38Å; A131-I213 HydrophobicContact CB-CG1 4.36Å
132A94.3Very high94.3Very high49 Ų4938.8 Ų38.841%0.40519%0.193SC..Hα-helixtrans-66.7-35.7175.100000112.3R128 I130 H136R128-A132 WeakPolarHBondContact O-CB 3.41Å; R128-A132 PolarHBondContact O-N 3.31Å; I130-A132 VanDerWaalsContact C-N 3.31Å; I130-A132 PolarHBondContact O-N 3.35Å; A132-H136 WeakPolarHBondContact O-CB 3.34Å; A132-H136 PolarHBondContact O-N 2.98Å
133G95.6Very high94Very high0 Ų044.5 Ų44.50%023%0.225CC..Hα-helixtrans-65.4-48.2175.400000112.6K129 I130 H136 A137 I151K129-G133 PolarHBondContact O-N 3.46Å; I130-G133 PolarHBondContact O-N 3.04Å; G133-H136 PolarHBondContact O-N 2.91Å; G133-A137 WeakPolarHBondContact O-CB 3.37Å; G133-A137 PolarHBondContact O-N 3.12Å; G133-I151 WeakPolarHBondContact O-CG2 3.32Å
134V96.4Very high93.9Very high0 Ų045.2 Ų45.20%023%0.233CC..Hα-helixtrans-60-47.6176.4172.40000110.6I130 H136 A137 H138 M148 F197 E201I130-V134 WeakPolarHBondContact O-CG2 3.42Å; I130-V134 PolarHBondContact O-N 2.86Å; V134-H136 PolarHBondContact O-N 3.46Å; V134-A137 PolarHBondContact O-N 2.98Å; V134-H138 WeakPolarHBondContact O-CB 3.46Å; V134-H138 PolarHBondContact O-N 2.58Å; V134-M148 HydrophobicContact CG1-CB 4.15Å; V134-F197 HydrophobicContact CB-CB 4.31Å; V134-F197 HydrophobicContact CG1-CB 4.27Å; V134-F197 HydrophobicContact CG2-CB 4.04Å; V134-E201 HydrophobicContact CG1-CG 3.87Å
135H94.6Very high93.9Very high86 Ų8649.8 Ų49.840%0.39825%0.252SS..Hα-helixtrans-63.6-41.4178.6-174.267.7000112.8A131 H138 H139 E201A131-H135 VanDerWaalsContact O-CB 3.32Å; A131-H135 WeakPolarHBondContact O-CB 3.22Å; A131-H135 PolarHBondContact O-N 2.96Å; H135-H138 PolarHBondContact O-N 2.76Å; H135-H139 PolarHBondContact O-N 3.11Å; H135-E201 IonicContact CE1-OE2 3.96Å; H135-E201 IonicContact ND1-OE1 3.68Å; H135-E201 IonicContact ND1-OE2 3.03Å; H135-E201 PolarHBondContact ND1-OE2 3.48Å
136H93.6Very high93.9Very high91 Ų9155.7 Ų55.742%0.42128%0.283SS..Hα-helixtrans-64.2-42.9176.6-179.272000112.1L73 A132 G133 V134 H139 A140L73-H136 WeakPolarHBondContact CD1-CD2 3.42Å; A132-H136 WeakPolarHBondContact O-CB 3.34Å; A132-H136 PolarHBondContact O-N 2.98Å; G133-H136 PolarHBondContact O-N 2.91Å; V134-H136 PolarHBondContact O-N 3.46Å; H136-H139 PolarHBondContact O-N 3.01Å; H136-A140 PolarHBondContact O-N 2.76Å
137A94.9Very high93.9Very high0 Ų057.6 Ų57.60%029%0.294CS..Hα-helixtrans-65.5-38.4174.800000112.3G133 V134 H139 A140 Y141 I147 M148 I151G133-A137 WeakPolarHBondContact O-CB 3.37Å; G133-A137 PolarHBondContact O-N 3.12Å; V134-A137 PolarHBondContact O-N 2.98Å; A137-H139 VanDerWaalsContact C-N 3.32Å; A137-H139 PolarHBondContact O-N 3.25Å; A137-A140 PolarHBondContact O-N 2.98Å; A137-Y141 PolarHBondContact O-N 3.27Å; A137-I147 HydrophobicContact CB-CG2 4.4Å; A137-M148 HydrophobicContact CB-CB 4.46Å; A137-M148 HydrophobicContact CB-CG 4.17Å; A137-I151 HydrophobicContact CB-CB 3.9Å; A137-I151 HydrophobicContact CB-CG1 3.98Å; A137-I151 HydrophobicContact CB-CG2 4.18Å
138H94.5Very high93.9Very high45 Ų4557.6 Ų57.621%0.20829%0.294CS..Hα-helixtrans-63.6-37.7175.3173.9-99.2000112.2V134 H135 A140 Y141 H142 M148V134-H138 WeakPolarHBondContact O-CB 3.46Å; V134-H138 PolarHBondContact O-N 2.58Å; H135-H138 PolarHBondContact O-N 2.76Å; H138-A140 VanDerWaalsContact C-N 3.29Å; H138-A140 PolarHBondContact O-N 3.45Å; H138-Y141 CarbonylContact O-C 2.93Å; H138-Y141 VanDerWaalsContact O-C 3.32Å; H138-Y141 PolarHBondContact O-N 3.28Å; H138-H142 PolarHBondContact CD2-O 3.32Å; H138-H142 AromaticContact CE1-ND1 3.81Å; H138-H142 AromaticContact NE2-ND1 3.93Å; H138-H142 WeakPolarHBondContact O-CA 3.37Å; H138-H142 PolarHBondContact O-N 3.17Å; H138-H142 PolarHBondContact O-ND1 3.39Å; H138-M148 HydrophobicContact CB-CE 3.96Å; H138-M148 HydrophobicContact CB-CG 4.18Å; H138-M148 HydrophobicContact CB-SD 3.83Å; H138-M148 VanDerWaalsContact CD2-CE 3.46Å; H138-M148 WeakPolarHBondContact CD2-CE 3.4Å
139H92.3Very high94.1Very high141 Ų14156.7 Ų56.765%0.65329%0.293SS*.Hα-helixtrans-63.3-35174.7-173.1-78.6000112.5H135 H136 A137H135-H139 PolarHBondContact O-N 3.11Å; H136-H139 PolarHBondContact O-N 3.01Å; A137-H139 VanDerWaalsContact C-N 3.32Å; A137-H139 PolarHBondContact O-N 3.25Å
140A91.4Very high94.2Very high58 Ų5859.6 Ų59.648%0.47931%0.308SS..Hα-helixtrans-81.6-34.3175.900000112.9H136 A137 H138H136-A140 PolarHBondContact O-N 2.76Å; A137-A140 PolarHBondContact O-N 2.98Å; H138-A140 VanDerWaalsContact C-N 3.29Å; H138-A140 PolarHBondContact O-N 3.45Å
141Y92.1Very high94.2Very high112 Ų11259.7 Ų59.744%0.43931%0.309SS..  trans-138.782.3-173.3-59-82.5000111.1L73 A137 H138 N143 G144 I147 M148L73-Y141 HydrophobicContact CD2-CE2 4.12Å; A137-Y141 PolarHBondContact O-N 3.27Å; H138-Y141 CarbonylContact O-C 2.93Å; H138-Y141 VanDerWaalsContact O-C 3.32Å; H138-Y141 PolarHBondContact O-N 3.28Å; Y141-N143 VanDerWaalsContact C-N 3.26Å; Y141-N143 PolarHBondContact O-N 2.97Å; Y141-N143 VanDerWaalsContact O-N 3.1Å; Y141-G144 PolarHBondContact O-N 3.39Å; Y141-I147 HydrophobicContact CD1-CD1 3.85Å; Y141-I147 HydrophobicContact CD2-CD1 3.99Å; Y141-I147 HydrophobicContact CD2-CG2 3.86Å; Y141-I147 HydrophobicContact CE1-CD1 4.18Å; Y141-I147 HydrophobicContact CE2-CD1 4.31Å; Y141-I147 HydrophobicContact CE2-CG2 4.25Å; Y141-I147 HydrophobicContact CG-CD1 3.74Å; Y141-M148 WeakPolarHBondContact O-CE 3.48Å
142H88.9Confident94.2Very high120 Ų12059.4 Ų59.456%0.55631%0.306SS*.THydrogen-bonded Turntrans-51.8-37.5-174.9-68.5-60000115.1H138 M148H138-H142 PolarHBondContact CD2-O 3.32Å; H138-H142 AromaticContact CE1-ND1 3.81Å; H138-H142 AromaticContact NE2-ND1 3.93Å; H138-H142 WeakPolarHBondContact O-CA 3.37Å; H138-H142 PolarHBondContact O-N 3.17Å; H138-H142 PolarHBondContact O-ND1 3.39Å; H142-M148 WeakPolarHBondContact O-CE 3.24Å
143N90Very high94.4Very high138 Ų13858.3 Ų58.374%0.73829%0.292SS*.THydrogen-bonded Turntrans-107.59.2179.8-63.2-43.3000113.3Y141 F145Y141-N143 VanDerWaalsContact C-N 3.26Å; Y141-N143 PolarHBondContact O-N 2.97Å; Y141-N143 VanDerWaalsContact O-N 3.1Å; N143-F145 VanDerWaalsContact C-N 3.3Å; N143-F145 WeakPolarHBondContact O-CD2 3.18Å; N143-F145 PolarHBondContact O-N 3.34Å
144G92.4Very high94.4Very high17 Ų1758.7 Ų58.718%0.17529%0.294CS..  trans-82.961.8-176.700000113.1Y141 L146 I147 M148Y141-G144 PolarHBondContact O-N 3.39Å; G144-L146 VanDerWaalsContact C-N 3.27Å; G144-L146 PolarHBondContact O-N 3.1Å; G144-I147 WeakPolarHBondContact O-CA 3.22Å; G144-I147 WeakPolarHBondContact O-CB 3.37Å; G144-I147 PolarHBondContact O-N 3.01Å; G144-M148 WeakPolarHBondContact O-CG 3.04Å; G144-M148 PolarHBondContact O-N 3.45Å
145F93.9Very high94.3Very high107 Ų10759.7 Ų59.747%0.46930%0.298SS..Hα-helixtrans-52.2-44.4-174.5-54.7-68.3000113.1N143 I147 M148 V149 T198 T202N143-F145 VanDerWaalsContact C-N 3.3Å; N143-F145 WeakPolarHBondContact O-CD2 3.18Å; N143-F145 PolarHBondContact O-N 3.34Å; F145-I147 VanDerWaalsContact C-N 3.33Å; F145-I147 PolarHBondContact O-N 3.4Å; F145-M148 WeakPolarHBondContact O-CB 3.37Å; F145-M148 PolarHBondContact O-N 3.38Å; F145-V149 WeakPolarHBondContact O-CG2 3.37Å; F145-V149 PolarHBondContact O-N 2.8Å; F145-T198 HydrophobicContact CB-CG2 4.41Å; F145-T198 HydrophobicContact CD1-CG2 4.37Å; F145-T202 HydrophobicContact CD1-CG2 3.49Å; F145-T202 VanDerWaalsContact CD1-CG2 3.49Å; F145-T202 HydrophobicContact CE1-CG2 3.26Å
146L95.1Very high94.3Very high127 Ų12755.7 Ų55.767%0.66528%0.281SS*.Hα-helixtrans-64.9-39178.8-173.465.8000111.7G144 V149 I150G144-L146 VanDerWaalsContact C-N 3.27Å; G144-L146 PolarHBondContact O-N 3.1Å; L146-V149 PolarHBondContact O-N 3.35Å; L146-I150 HydrophobicContact CD1-CD1 4.31Å; L146-I150 HydrophobicContact CD2-CD1 4.43Å; L146-I150 HydrophobicContact CG-CD1 3.87Å; L146-I150 HydrophobicContact CG-CG1 4.49Å; L146-I150 WeakPolarHBondContact O-CB 3.11Å; L146-I150 VanDerWaalsContact O-CG1 3.24Å; L146-I150 WeakPolarHBondContact O-CG1 3.24Å; L146-I150 PolarHBondContact O-N 3.47Å
147I95.3Very high94.2Very high59 Ų5951.7 Ų51.730%0.30326%0.263SS..Hα-helixtrans-64.2-44.7177-56.8174.3000109.4L73 A137 Y141 G144 F145 V149 I150 I151L73-I147 HydrophobicContact CD2-CG2 4.5Å; A137-I147 HydrophobicContact CB-CG2 4.4Å; Y141-I147 HydrophobicContact CD1-CD1 3.85Å; Y141-I147 HydrophobicContact CD2-CD1 3.99Å; Y141-I147 HydrophobicContact CD2-CG2 3.86Å; Y141-I147 HydrophobicContact CE1-CD1 4.18Å; Y141-I147 HydrophobicContact CE2-CD1 4.31Å; Y141-I147 HydrophobicContact CE2-CG2 4.25Å; Y141-I147 HydrophobicContact CG-CD1 3.74Å; G144-I147 WeakPolarHBondContact O-CA 3.22Å; G144-I147 WeakPolarHBondContact O-CB 3.37Å; G144-I147 PolarHBondContact O-N 3.01Å; F145-I147 VanDerWaalsContact C-N 3.33Å; F145-I147 PolarHBondContact O-N 3.4Å; I147-V149 PolarHBondContact O-N 3Å; I147-I150 PolarHBondContact O-N 2.94Å; I147-I151 HydrophobicContact CG2-CG1 4.16Å; I147-I151 WeakPolarHBondContact O-CB 3.34Å; I147-I151 VanDerWaalsContact O-CG1 3.29Å; I147-I151 WeakPolarHBondContact O-CG1 3.29Å; I147-I151 PolarHBondContact O-N 2.86Å
148M96Very high94Very high0 Ų051.8 Ų51.80%026%0.264CS..Hα-helixtrans-57.1-48.1175.9-64.5174.3-14700112V134 A137 H138 Y141 H142 G144 F145 I151 G152 T198 T202V134-M148 HydrophobicContact CG1-CB 4.15Å; A137-M148 HydrophobicContact CB-CB 4.46Å; A137-M148 HydrophobicContact CB-CG 4.17Å; H138-M148 HydrophobicContact CB-CE 3.96Å; H138-M148 HydrophobicContact CB-CG 4.18Å; H138-M148 HydrophobicContact CB-SD 3.83Å; H138-M148 VanDerWaalsContact CD2-CE 3.46Å; H138-M148 WeakPolarHBondContact CD2-CE 3.4Å; Y141-M148 WeakPolarHBondContact O-CE 3.48Å; H142-M148 WeakPolarHBondContact O-CE 3.24Å; G144-M148 WeakPolarHBondContact O-CG 3.04Å; G144-M148 PolarHBondContact O-N 3.45Å; F145-M148 WeakPolarHBondContact O-CB 3.37Å; F145-M148 PolarHBondContact O-N 3.38Å; M148-I151 PolarHBondContact O-N 2.89Å; M148-G152 PolarHBondContact O-N 3.42Å; M148-T198 HydrophobicContact CB-CG2 3.86Å; M148-T198 HydrophobicContact SD-CG2 3.92Å; M148-T202 HydrophobicContact SD-CG2 4.47Å
149V97.2Very high93.8Very high24 Ų2450.6 Ų50.615%0.14526%0.26CS..Hα-helixtrans-61.7-47.2177.9174.10000111F145 L146 I147 I151 G152 Y153 L191 A194 I195 T198F145-V149 WeakPolarHBondContact O-CG2 3.37Å; F145-V149 PolarHBondContact O-N 2.8Å; L146-V149 PolarHBondContact O-N 3.35Å; I147-V149 PolarHBondContact O-N 3Å; V149-I151 PolarHBondContact O-N 3.43Å; V149-G152 PolarHBondContact O-N 3.5Å; V149-Y153 WeakPolarHBondContact O-CB 3.24Å; V149-Y153 PolarHBondContact O-N 3.37Å; V149-L191 HydrophobicContact CG1-CD1 3.92Å; V149-A194 HydrophobicContact CG1-CB 4.34Å; V149-A194 WeakPolarHBondContact O-CB 3.44Å; V149-I195 HydrophobicContact CG1-CG1 3.89Å; V149-I195 HydrophobicContact CG2-CG1 4.19Å; V149-T198 HydrophobicContact CG2-CG2 4.08Å; V149-T198 WeakPolarHBondContact CG2-OG1 3.49Å
150I96.7Very high93.7Very high72 Ų7245.1 Ų45.137%0.36924%0.239SC..Hα-helixtrans-61.5-47-179.2-71.3169.1000111L72 L146 I147 Y153 V154L72-I150 HydrophobicContact CD1-CG2 3.95Å; L146-I150 HydrophobicContact CD1-CD1 4.31Å; L146-I150 HydrophobicContact CD2-CD1 4.43Å; L146-I150 HydrophobicContact CG-CD1 3.87Å; L146-I150 HydrophobicContact CG-CG1 4.49Å; L146-I150 WeakPolarHBondContact O-CB 3.11Å; L146-I150 VanDerWaalsContact O-CG1 3.24Å; L146-I150 WeakPolarHBondContact O-CG1 3.24Å; L146-I150 PolarHBondContact O-N 3.47Å; I147-I150 PolarHBondContact O-N 2.94Å; I150-Y153 WeakPolarHBondContact O-CB 3.28Å; I150-Y153 PolarHBondContact O-N 2.92Å; I150-V154 WeakPolarHBondContact O-CB 3.48Å; I150-V154 VanDerWaalsContact O-CG2 3.3Å; I150-V154 WeakPolarHBondContact O-CG2 3.17Å; I150-V154 PolarHBondContact O-N 3.19Å
151I97.2Very high93.6Very high2 Ų244 Ų441%0.0122%0.224CC..Hα-helixtrans-67.9-42-179.4-62.4-56000111.2A69 L72 L73 G133 A137 I147 M148 V149 V154 K155A69-I151 HydrophobicContact CB-CG2 4.4Å; L72-I151 HydrophobicContact CB-CD1 3.72Å; L72-I151 HydrophobicContact CD1-CD1 4.24Å; L73-I151 HydrophobicContact CD1-CD1 4.2Å; L73-I151 HydrophobicContact CD1-CG1 4.38Å; L73-I151 HydrophobicContact CD1-CG2 4.31Å; L73-I151 HydrophobicContact CD2-CD1 3.95Å; L73-I151 HydrophobicContact CD2-CG1 3.98Å; L73-I151 HydrophobicContact CG-CD1 3.7Å; L73-I151 HydrophobicContact CG-CG1 4.15Å; G133-I151 WeakPolarHBondContact O-CG2 3.32Å; A137-I151 HydrophobicContact CB-CB 3.9Å; A137-I151 HydrophobicContact CB-CG1 3.98Å; A137-I151 HydrophobicContact CB-CG2 4.18Å; I147-I151 HydrophobicContact CG2-CG1 4.16Å; I147-I151 WeakPolarHBondContact O-CB 3.34Å; I147-I151 VanDerWaalsContact O-CG1 3.29Å; I147-I151 WeakPolarHBondContact O-CG1 3.29Å; I147-I151 PolarHBondContact O-N 2.86Å; M148-I151 PolarHBondContact O-N 2.89Å; V149-I151 PolarHBondContact O-N 3.43Å; I151-V154 PolarHBondContact O-N 2.77Å; I151-K155 WeakPolarHBondContact O-CB 3.46Å; I151-K155 WeakPolarHBondContact O-CG 3.3Å; I151-K155 PolarHBondContact O-N 3.36Å
152G96.9Very high93.5Very high0 Ų039.8 Ų39.80%021%0.209CC..Hα-helixtrans-58.8-46.9173.200000112.3M148 V149 V154 K155 G156M148-G152 PolarHBondContact O-N 3.42Å; V149-G152 PolarHBondContact O-N 3.5Å; G152-V154 PolarHBondContact O-N 2.98Å; G152-K155 PolarHBondContact O-N 2.9Å; G152-G156 PolarHBondContact O-N 2.89Å
153Y96.5Very high93.5Very high26 Ų2635.1 Ų35.110%0.10219%0.19CC..Hα-helixtrans-58.7-48.1178.2167.1-125.9000111.5V149 I150 G156 S157 L161 M183 T187 L191V149-Y153 WeakPolarHBondContact O-CB 3.24Å; V149-Y153 PolarHBondContact O-N 3.37Å; I150-Y153 WeakPolarHBondContact O-CB 3.28Å; I150-Y153 PolarHBondContact O-N 2.92Å; Y153-G156 PolarHBondContact O-N 3.43Å; Y153-S157 WeakPolarHBondContact CD2-OG 3.29Å; Y153-S157 WeakPolarHBondContact CE2-OG 3.5Å; Y153-S157 WeakPolarHBondContact O-CB 3.39Å; Y153-S157 PolarHBondContact O-N 2.88Å; Y153-S157 PolarHBondContact O-OG 2.9Å; Y153-S157 VanDerWaalsContact O-OG 3.11Å; Y153-L161 HydrophobicContact CD1-CD1 4.15Å; Y153-L161 HydrophobicContact CE1-CD1 3.74Å; Y153-L161 HydrophobicContact CE1-CD2 3.82Å; Y153-L161 HydrophobicContact CE1-CG 4.42Å; Y153-L161 HydrophobicContact CE2-CD2 4.48Å; Y153-L161 WeakPolarHBondContact OH-CD2 3.49Å; Y153-M183 HydrophobicContact CE2-CE 3.92Å; Y153-M183 WeakPolarHBondContact OH-CE 3.3Å; Y153-T187 HydrophobicContact CE2-CG2 3.54Å; Y153-T187 WeakPolarHBondContact OH-CG2 3.45Å; Y153-L191 HydrophobicContact CD2-CB 3.74Å; Y153-L191 HydrophobicContact CD2-CD1 4.24Å; Y153-L191 HydrophobicContact CE2-CB 4.03Å; Y153-L191 HydrophobicContact CG-CB 4.46Å; Y153-L191 HydrophobicContact CG-CD1 4.14Å
154V96.2Very high93.5Very high7 Ų729.8 Ų29.84%0.04216%0.162CC..Hα-helixtrans-63.1-42.9177.8158.80000112.1L68 A69 L72 I150 I151 G152 G156 G158 L161L68-V154 HydrophobicContact CB-CG1 3.58Å; L68-V154 HydrophobicContact CD2-CB 4.38Å; L68-V154 HydrophobicContact CD2-CG1 3.7Å; L68-V154 HydrophobicContact CD2-CG2 4.02Å; L68-V154 HydrophobicContact CG-CB 4.49Å; L68-V154 HydrophobicContact CG-CG1 3.48Å; L68-V154 VanDerWaalsContact CG-CG1 3.48Å; L68-V154 HydrophobicContact CG-CG2 4.26Å; A69-V154 HydrophobicContact CB-CG1 4.22Å; L72-V154 HydrophobicContact CD1-CB 4.29Å; L72-V154 HydrophobicContact CD1-CG1 4.27Å; L72-V154 HydrophobicContact CD1-CG2 3.58Å; I150-V154 WeakPolarHBondContact O-CB 3.48Å; I150-V154 VanDerWaalsContact O-CG2 3.3Å; I150-V154 WeakPolarHBondContact O-CG2 3.17Å; I150-V154 PolarHBondContact O-N 3.19Å; I151-V154 PolarHBondContact O-N 2.77Å; G152-V154 PolarHBondContact O-N 2.98Å; V154-G156 VanDerWaalsContact C-N 3.26Å; V154-G156 PolarHBondContact O-N 3.37Å; V154-G158 WeakPolarHBondContact O-CA 3.49Å; V154-G158 PolarHBondContact O-N 2.92Å; V154-L161 HydrophobicContact CB-CD1 4.38Å; V154-L161 HydrophobicContact CG2-CD1 3.73Å
155K95.2Very high93.3Very high21 Ų2136 Ų369%0.09118%0.184CC..Hα-helixtrans-65-31.1176.9-72.7-144.2-177.3-169.90112.7S65 A69 K129 I151 G152S65-K155 VanDerWaalsContact CB-O 3.29Å; S65-K155 WeakPolarHBondContact CB-O 3.47Å; A69-K155 HydrophobicContact CB-CD 4.34Å; A69-K155 HydrophobicContact CB-CG 3.85Å; K129-K155 HydrophobicContact CB-CB 4.31Å; K129-K155 WeakPolarHBondContact O-CB 3.5Å; K129-K155 WeakPolarHBondContact O-CD 3.43Å; I151-K155 WeakPolarHBondContact O-CB 3.46Å; I151-K155 WeakPolarHBondContact O-CG 3.3Å; I151-K155 PolarHBondContact O-N 3.36Å; G152-K155 PolarHBondContact O-N 2.9Å
156G93.3Very high93.2Very high3 Ų331 Ų313%0.03116%0.162CC..Hα-helixtrans-78.1-45.3176.400000114.4R126 G152 Y153 V154 S190R126-G156 WeakPolarHBondContact CG-O 3.35Å; R126-G156 PolarHBondContact NH1-O 3.43Å; G152-G156 PolarHBondContact O-N 2.89Å; Y153-G156 PolarHBondContact O-N 3.43Å; V154-G156 VanDerWaalsContact C-N 3.26Å; V154-G156 PolarHBondContact O-N 3.37Å; G156-S190 VanDerWaalsContact C-OG 3.27Å; G156-S190 PolarHBondContact O-OG 3.18Å
157S92.4Very high93Very high7 Ų726.1 Ų26.15%0.04914%0.136CC..Hα-helixtrans-79.4-35-176.1-57.10000112.4Y153 V159 A160 S190Y153-S157 WeakPolarHBondContact CD2-OG 3.29Å; Y153-S157 WeakPolarHBondContact CE2-OG 3.5Å; Y153-S157 WeakPolarHBondContact O-CB 3.39Å; Y153-S157 PolarHBondContact O-N 2.88Å; Y153-S157 PolarHBondContact O-OG 2.9Å; Y153-S157 VanDerWaalsContact O-OG 3.11Å; S157-V159 PolarHBondContact O-N 2.92Å; S157-A160 WeakPolarHBondContact O-CB 3.43Å; S157-A160 PolarHBondContact O-N 3.43Å; S157-S190 WeakPolarHBondContact OG-CB 3.41Å
158G90.5Very high92.8Very high1 Ų127.7 Ų27.71%0.0115%0.145CC..G310 helixtrans57.6-129.417500000113.3V154 A160 L161V154-G158 WeakPolarHBondContact O-CA 3.49Å; V154-G158 PolarHBondContact O-N 2.92Å; G158-A160 PolarHBondContact O-N 2.55Å; G158-A160 VanDerWaalsContact O-N 3.08Å; G158-L161 PolarHBondContact O-N 3.11Å
159V89.8Confident92.5Very high21 Ų2130.7 Ų30.713%0.12716%0.16CC..G310 helixtrans-57.9-24.4-176.173.60000113.6L60 Y61 S157 L161 I162 S163 E166L60-V159 HydrophobicContact CB-CG2 4.26Å; Y61-V159 HydrophobicContact CD1-CG1 3.82Å; Y61-V159 HydrophobicContact CD2-CG1 4.46Å; Y61-V159 HydrophobicContact CD2-CG2 4.09Å; Y61-V159 HydrophobicContact CE1-CG1 4.1Å; Y61-V159 HydrophobicContact CE2-CG2 4.36Å; Y61-V159 HydrophobicContact CG-CG1 4.03Å; Y61-V159 HydrophobicContact CG-CG2 4.38Å; S157-V159 PolarHBondContact O-N 2.92Å; V159-L161 PolarHBondContact O-N 2.91Å; V159-I162 HydrophobicContact CB-CG1 4.5Å; V159-I162 HydrophobicContact CG2-CD1 4.42Å; V159-I162 HydrophobicContact CG2-CG1 4.14Å; V159-I162 CarbonylContact O-C 3.32Å; V159-I162 VanDerWaalsContact O-C 3.28Å; V159-I162 WeakPolarHBondContact O-CG1 3.15Å; V159-I162 PolarHBondContact O-N 3.29Å; V159-S163 PolarHBondContact O-N 3.46Å; V159-E166 HydrophobicContact CG2-CB 4.3Å; V159-E166 HydrophobicContact CG2-CG 4.25Å
160A90.3Very high92Very high25 Ų2530.9 Ų30.921%0.20716%0.158CC..G310 helixtrans-57.9-36.8179.500000111.6S157 G158 I162 S163 E179S157-A160 WeakPolarHBondContact O-CB 3.43Å; S157-A160 PolarHBondContact O-N 3.43Å; G158-A160 PolarHBondContact O-N 2.55Å; G158-A160 VanDerWaalsContact O-N 3.08Å; A160-I162 VanDerWaalsContact C-N 3.28Å; A160-I162 PolarHBondContact O-N 2.92Å; A160-S163 WeakPolarHBondContact O-CB 3.35Å; A160-S163 PolarHBondContact O-N 3.28Å; A160-S163 PolarHBondContact O-OG 2.65Å; A160-E179 HydrophobicContact CB-CG 3.89Å; A160-E179 WeakPolarHBondContact O-CB 3.46Å; A160-E179 WeakPolarHBondContact O-CG 3.17Å
161L90.1Very high91.6Very high34 Ų3430.7 Ų30.718%0.17817%0.174CC..G310 helixtrans-72.4-21.4178.5-68.6172.5000114.1L68 Y153 V154 G158 V159 E179 I180 T187L68-L161 HydrophobicContact CD2-CB 3.74Å; L68-L161 HydrophobicContact CD2-CD1 4.02Å; Y153-L161 HydrophobicContact CD1-CD1 4.15Å; Y153-L161 HydrophobicContact CE1-CD1 3.74Å; Y153-L161 HydrophobicContact CE1-CD2 3.82Å; Y153-L161 HydrophobicContact CE1-CG 4.42Å; Y153-L161 HydrophobicContact CE2-CD2 4.48Å; Y153-L161 WeakPolarHBondContact OH-CD2 3.49Å; V154-L161 HydrophobicContact CB-CD1 4.38Å; V154-L161 HydrophobicContact CG2-CD1 3.73Å; G158-L161 PolarHBondContact O-N 3.11Å; V159-L161 PolarHBondContact O-N 2.91Å; L161-E179 HydrophobicContact CD2-CG 4.48Å; L161-I180 HydrophobicContact CD2-CG1 4.25Å; L161-T187 HydrophobicContact CD2-CG2 4.37Å
162I89.8Confident91.2Very high24 Ų2432.6 Ų32.612%0.12319%0.186CC..G310 helixtrans-111.821.3177.757.1167.7000111.4L60 L68 V159 A160 N164 F165 E166L60-I162 HydrophobicContact CD2-CD1 4.41Å; L68-I162 HydrophobicContact CD1-CG2 3.91Å; L68-I162 HydrophobicContact CD2-CG2 3.98Å; L68-I162 HydrophobicContact CG-CG2 4.49Å; V159-I162 HydrophobicContact CB-CG1 4.5Å; V159-I162 HydrophobicContact CG2-CD1 4.42Å; V159-I162 HydrophobicContact CG2-CG1 4.14Å; V159-I162 CarbonylContact O-C 3.32Å; V159-I162 VanDerWaalsContact O-C 3.28Å; V159-I162 WeakPolarHBondContact O-CG1 3.15Å; V159-I162 PolarHBondContact O-N 3.29Å; A160-I162 VanDerWaalsContact C-N 3.28Å; A160-I162 PolarHBondContact O-N 2.92Å; I162-N164 PolarHBondContact O-N 3.37Å; I162-N164 VanDerWaalsContact O-N 3.16Å; I162-F165 HydrophobicContact CB-CD2 4.35Å; I162-F165 HydrophobicContact CG2-CD2 4.43Å; I162-F165 PolarHBondContact O-N 3.4Å; I162-E166 PolarHBondContact O-N 3.26Å
163S88.7Confident90.8Very high23 Ų2339.8 Ų39.816%0.16121%0.213CC..Hα-helixtrans-55.7-35.6-177.957.70000112.1V159 A160 E166 Q167V159-S163 PolarHBondContact O-N 3.46Å; A160-S163 WeakPolarHBondContact O-CB 3.35Å; A160-S163 PolarHBondContact O-N 3.28Å; A160-S163 PolarHBondContact O-OG 2.65Å; S163-E166 PolarHBondContact O-N 3.38Å; S163-Q167 WeakPolarHBondContact O-CB 3.4Å; S163-Q167 WeakPolarHBondContact O-CG 3.45Å; S163-Q167 PolarHBondContact O-N 2.97Å
164N89.4Confident90.3Very high26 Ų2644.6 Ų44.614%0.13923%0.231CC..Hα-helixtrans-69.3-35.8-179.1-65.133.3000111.5I162 L168 W173 T177I162-N164 PolarHBondContact O-N 3.37Å; I162-N164 VanDerWaalsContact O-N 3.16Å; N164-L168 WeakPolarHBondContact O-CB 3.13Å; N164-L168 PolarHBondContact O-N 2.98Å; N164-W173 HydrophobicContact CB-CZ3 4.35Å; N164-T177 PolarHBondContact ND2-O 2.89Å
165F89.1Confident89.8Confident147 Ų14747.5 Ų47.565%0.64525%0.25SS*.Hα-helixtrans-73-38.5174-69.8-77000111.9I162 L168 L169I162-F165 HydrophobicContact CB-CD2 4.35Å; I162-F165 HydrophobicContact CG2-CD2 4.43Å; I162-F165 PolarHBondContact O-N 3.4Å; F165-L168 WeakPolarHBondContact O-CB 2.99Å; F165-L168 PolarHBondContact O-N 2.82Å; F165-L169 PolarHBondContact O-N 3.26Å
166E91.3Very high89.2Confident2 Ų254.1 Ų54.11%0.00928%0.281CS..Hα-helixtrans-64.1-43.1174.2-175.3-75.9158.400111.1L60 Y61 V159 I162 S163 L168 L169 R170L60-E166 HydrophobicContact CD1-CB 4.36Å; L60-E166 HydrophobicContact CD1-CG 4.35Å; Y61-E166 HydrophobicContact CD2-CG 4.19Å; Y61-E166 HydrophobicContact CE2-CG 3.77Å; Y61-E166 WeakPolarHBondContact CE2-OE1 3.02Å; V159-E166 HydrophobicContact CG2-CB 4.3Å; V159-E166 HydrophobicContact CG2-CG 4.25Å; I162-E166 PolarHBondContact O-N 3.26Å; S163-E166 PolarHBondContact O-N 3.38Å; E166-L168 VanDerWaalsContact C-N 3.3Å; E166-L168 PolarHBondContact O-N 2.95Å; E166-L169 WeakPolarHBondContact O-CB 3.04Å; E166-L169 PolarHBondContact O-N 3.46Å; E166-L169 VanDerWaalsContact O-N 3.15Å; E166-R170 VanDerWaalsContact CD-CZ 3.49Å; E166-R170 PolarHBondContact O-N 2.9Å; E166-R170 WeakPolarHBondContact OE1-CD 3.24Å; E166-R170 IonicContact OE1-CZ 2.84Å; E166-R170 VanDerWaalsContact OE1-CZ 3.24Å; E166-R170 IonicContact OE1-NE 3.68Å; E166-R170 PolarHBondContact OE1-NE 3.04Å; E166-R170 IonicContact OE1-NH1 3.63Å; E166-R170 PolarHBondContact OE1-NH1 3.3Å; E166-R170 IonicContact OE2-CZ 3.34Å; E166-R170 IonicContact OE2-NE 3.42Å; E166-R170 PolarHBondContact OE2-NE 3.1Å; E166-R170 IonicContact OE2-NH1 3.11Å; E166-R170 PolarHBondContact OE2-NH1 3.34Å; E166-R170 IonicContact OE2-NH2 3.24Å; E166-R170 PolarHBondContact OE2-NH2 2.86Å
167Q90.5Very high88.6Confident24 Ų2457.4 Ų57.411%0.11230%0.301CS..Hα-helixtrans-59.6-43.2173.7-761723300111.1S163 L169 R170 G171 V172S163-Q167 WeakPolarHBondContact O-CB 3.4Å; S163-Q167 WeakPolarHBondContact O-CG 3.45Å; S163-Q167 PolarHBondContact O-N 2.97Å; Q167-L169 VanDerWaalsContact C-N 3.28Å; Q167-L169 PolarHBondContact O-N 3.29Å; Q167-R170 CarbonylContact O-C 3.51Å; Q167-R170 WeakPolarHBondContact O-CA 3.18Å; Q167-R170 WeakPolarHBondContact O-CB 3.37Å; Q167-R170 PolarHBondContact O-N 3.42Å; Q167-G171 PolarHBondContact O-N 3.29Å; Q167-V172 CarbonylContact C-O 3.28Å; Q167-V172 HydrophobicContact CB-CB 4.3Å; Q167-V172 WeakPolarHBondContact CB-O 3.28Å; Q167-V172 PolarHBondContact O-N 3.25Å
168L91.6Very high88.2Confident93 Ų9359.9 Ų59.949%0.48731%0.314SS..Hα-helixtrans-59.4-40176.9-178.164.7000111.5N164 F165 E166 R170 G171 V172 W173N164-L168 WeakPolarHBondContact O-CB 3.13Å; N164-L168 PolarHBondContact O-N 2.98Å; F165-L168 WeakPolarHBondContact O-CB 2.99Å; F165-L168 PolarHBondContact O-N 2.82Å; E166-L168 VanDerWaalsContact C-N 3.3Å; E166-L168 PolarHBondContact O-N 2.95Å; L168-R170 PolarHBondContact O-N 3.02Å; L168-G171 WeakPolarHBondContact O-CA 3.21Å; L168-G171 PolarHBondContact O-N 3.29Å; L168-V172 WeakPolarHBondContact CA-O 3.3Å; L168-V172 PolarHBondContact N-O 3.43Å; L168-V172 VanDerWaalsContact N-O 3.12Å; L168-W173 HydrophobicContact CB-CE3 4.35Å; L168-W173 HydrophobicContact CD1-CE3 4.28Å
169L89.1Confident87.9Confident63 Ų6361.4 Ų61.433%0.3332%0.321SS..Hα-helixtrans-62.4-29.4175.4-175.364.5000112.5L56 C57 L60 F165 E166 Q167 G171L56-L169 HydrophobicContact CB-CD2 4.04Å; L56-L169 HydrophobicContact CD2-CD1 4.02Å; L56-L169 HydrophobicContact CD2-CD2 3.73Å; L56-L169 HydrophobicContact CG-CD2 3.7Å; C57-L169 VanDerWaalsContact SG-CD2 3.59Å; L60-L169 HydrophobicContact CD1-CD2 3.81Å; F165-L169 PolarHBondContact O-N 3.26Å; E166-L169 WeakPolarHBondContact O-CB 3.04Å; E166-L169 PolarHBondContact O-N 3.46Å; E166-L169 VanDerWaalsContact O-N 3.15Å; Q167-L169 VanDerWaalsContact C-N 3.28Å; Q167-L169 PolarHBondContact O-N 3.29Å; L169-G171 VanDerWaalsContact C-N 3.3Å
170R88.3Confident87.5Confident27 Ų2766.3 Ų66.310%0.10235%0.345CS..THydrogen-bonded Turntrans-83-2.9172.6-58.9-175.2-57.5-14814.5113.7E40 C57 E166 Q167 L168E40-R170 VanDerWaalsContact CG-NH1 3.28Å; E40-R170 IonicContact OE2-CZ 3.62Å; E40-R170 IonicContact OE2-NH1 3.6Å; E40-R170 IonicContact OE2-NH2 2.74Å; E40-R170 PolarHBondContact OE2-NH2 2.85Å; C57-R170 VanDerWaalsContact SG-CG 3.53Å; E166-R170 VanDerWaalsContact CD-CZ 3.49Å; E166-R170 PolarHBondContact O-N 2.9Å; E166-R170 WeakPolarHBondContact OE1-CD 3.24Å; E166-R170 IonicContact OE1-CZ 2.84Å; E166-R170 VanDerWaalsContact OE1-CZ 3.24Å; E166-R170 IonicContact OE1-NE 3.68Å; E166-R170 PolarHBondContact OE1-NE 3.04Å; E166-R170 IonicContact OE1-NH1 3.63Å; E166-R170 PolarHBondContact OE1-NH1 3.3Å; E166-R170 IonicContact OE2-CZ 3.34Å; E166-R170 IonicContact OE2-NE 3.42Å; E166-R170 PolarHBondContact OE2-NE 3.1Å; E166-R170 IonicContact OE2-NH1 3.11Å; E166-R170 PolarHBondContact OE2-NH1 3.34Å; E166-R170 IonicContact OE2-NH2 3.24Å; E166-R170 PolarHBondContact OE2-NH2 2.86Å; Q167-R170 CarbonylContact O-C 3.51Å; Q167-R170 WeakPolarHBondContact O-CA 3.18Å; Q167-R170 WeakPolarHBondContact O-CB 3.37Å; Q167-R170 PolarHBondContact O-N 3.42Å; L168-R170 PolarHBondContact O-N 3.02Å
171G87.6Confident86.9Confident68 Ų6870.5 Ų70.570%0.70136%0.363SS*.THydrogen-bonded Turntrans80.719.3-175.300000114.3Q167 L168 L169Q167-G171 PolarHBondContact O-N 3.29Å; L168-G171 WeakPolarHBondContact O-CA 3.21Å; L168-G171 PolarHBondContact O-N 3.29Å; L169-G171 VanDerWaalsContact C-N 3.3Å
172V88.5Confident86.6Confident43 Ų4374 Ų7426%0.26138%0.382SS..  trans-110.8131176.9-179.90000109Q167 L168 R174Q167-V172 CarbonylContact C-O 3.28Å; Q167-V172 HydrophobicContact CB-CB 4.3Å; Q167-V172 WeakPolarHBondContact CB-O 3.28Å; Q167-V172 PolarHBondContact O-N 3.25Å; L168-V172 WeakPolarHBondContact CA-O 3.3Å; L168-V172 PolarHBondContact N-O 3.43Å; L168-V172 VanDerWaalsContact N-O 3.12Å; V172-R174 HydrophobicContact CG1-CG 4.14Å
173W88.7Confident86.4Confident150 Ų15075.1 Ų75.157%0.56839%0.387SS*.  trans-125.1119.1174.1-177.1-112.2000110.4N164 L168 P175N164-W173 HydrophobicContact CB-CZ3 4.35Å; L168-W173 HydrophobicContact CB-CE3 4.35Å; L168-W173 HydrophobicContact CD1-CE3 4.28Å; W173-P175 HydrophobicContact CZ2-CB 4.07Å
174R86.2Confident86.3Confident127 Ų12776.2 Ų76.248%0.47940%0.395SS..  trans-131.988.2177.3-65.7-178.1-174.6168.91.8109.3V172 E176V172-R174 HydrophobicContact CG1-CG 4.14Å; R174-E176 VanDerWaalsContact C-N 3.31Å
175P85.9Confident86.3Confident68 Ų6875.4 Ų75.444%0.44239%0.39SS..THydrogen-bonded Turntrans-76.7-20-176.730.9-33.4000112.9W173 T177W173-P175 HydrophobicContact CZ2-CB 4.07Å; P175-T177 PolarHBondContact O-N 3.36Å; P175-T177 VanDerWaalsContact O-N 3.15Å
176E83Confident86.4Confident160 Ų16069.3 Ų69.375%0.74837%0.366SS*.THydrogen-bonded Turntrans-60.9-24.7-174.4-51.3-63.517300113.6R174R174-E176 VanDerWaalsContact C-N 3.31Å
177T79.8Confident86.4Confident73 Ų7369.3 Ų69.345%0.44837%0.365SS..  trans-135.2140.3-178.364.70000110N164 P175N164-T177 PolarHBondContact ND2-O 2.89Å; P175-T177 PolarHBondContact O-N 3.36Å; P175-T177 VanDerWaalsContact O-N 3.15Å
178N83.6Confident86.5Confident59 Ų5969.4 Ų69.432%0.31637%0.366SS..  trans-142.7162.6167.16563.6000109.7I180 L181 N182N178-I180 PolarHBondContact O-N 2.71Å; N178-I180 WeakPolarHBondContact OD1-CA 3.27Å; N178-I180 WeakPolarHBondContact OD1-CB 3.12Å; N178-I180 PolarHBondContact OD1-N 3.29Å; N178-L181 PolarHBondContact O-N 3.44Å; N178-L181 VanDerWaalsContact O-N 3.15Å; N178-L181 WeakPolarHBondContact OD1-CB 3.47Å; N178-L181 PolarHBondContact OD1-N 3.5Å; N178-N182 PolarHBondContact O-N 2.95Å
179E84.9Confident86.6Confident32 Ų3265 Ų6515%0.1534%0.342CS..THydrogen-bonded Turntrans-66.5-18.7-175.5-164.466.8-162.700113.2A160 L161 M183 S184 T187A160-E179 HydrophobicContact CB-CG 3.89Å; A160-E179 WeakPolarHBondContact O-CB 3.46Å; A160-E179 WeakPolarHBondContact O-CG 3.17Å; L161-E179 HydrophobicContact CD2-CG 4.48Å; E179-M183 WeakPolarHBondContact O-CA 3.47Å; E179-M183 WeakPolarHBondContact O-CG 3.26Å; E179-M183 PolarHBondContact O-N 3.42Å; E179-S184 WeakPolarHBondContact OE1-CB 3.42Å; E179-S184 PolarHBondContact OE1-N 3.11Å; E179-S184 PolarHBondContact OE1-OG 3.22Å; E179-T187 HydrophobicContact CG-CG2 3.93Å; E179-T187 WeakPolarHBondContact OE1-CB 3.3Å; E179-T187 PolarHBondContact OE1-OG1 3.04Å
180I80.8Confident86.9Confident125 Ų12562 Ų6264%0.64133%0.327SS*.THydrogen-bonded Turntrans-80.7-38175.8-59.1173.5000110.3L161 N178L161-I180 HydrophobicContact CD2-CG1 4.25Å; N178-I180 PolarHBondContact O-N 2.71Å; N178-I180 WeakPolarHBondContact OD1-CA 3.27Å; N178-I180 WeakPolarHBondContact OD1-CB 3.12Å; N178-I180 PolarHBondContact OD1-N 3.29Å
181L78.8Confident87.2Confident113 Ų11363.2 Ų63.259%0.59234%0.335SS*.THydrogen-bonded Turntrans-72.7-46179.1-173.167000111.3N178N178-L181 PolarHBondContact O-N 3.44Å; N178-L181 VanDerWaalsContact O-N 3.15Å; N178-L181 WeakPolarHBondContact OD1-CB 3.47Å; N178-L181 PolarHBondContact OD1-N 3.5Å
182N83.5Confident87.6Confident107 Ų10764 Ų6457%0.57232%0.317SS*.SBendtrans-12780.4179.1-70.8-44.1000109.8N178 S184N178-N182 PolarHBondContact O-N 2.95Å; N182-S184 PolarHBondContact O-N 3.04Å
183M84.8Confident87.9Confident48 Ų4862 Ų6224%0.23631%0.305CS..  trans-64.9129.9-177.5-70.8173.4139.800112.3Y153 E179 T187 K188 L191Y153-M183 HydrophobicContact CE2-CE 3.92Å; Y153-M183 WeakPolarHBondContact OH-CE 3.3Å; E179-M183 WeakPolarHBondContact O-CA 3.47Å; E179-M183 WeakPolarHBondContact O-CG 3.26Å; E179-M183 PolarHBondContact O-N 3.42Å; M183-T187 HydrophobicContact CB-CG2 4.23Å; M183-T187 HydrophobicContact CE-CG2 4.01Å; M183-T187 HydrophobicContact CG-CG2 3.97Å; M183-K188 HydrophobicContact CB-CD 4.21Å; M183-K188 HydrophobicContact CB-CG 3.51Å; M183-K188 HydrophobicContact CG-CG 4.39Å; M183-K188 WeakPolarHBondContact O-CE 3.35Å; M183-K188 HydrophobicContact SD-CG 3.98Å; M183-L191 HydrophobicContact CE-CD2 4.07Å
184S87.6Confident88.3Confident46 Ų4654.8 Ų54.832%0.32228%0.278SS..  trans-71.2160.4168.3710000111.6E179 N182 P186 T187 K188E179-S184 WeakPolarHBondContact OE1-CB 3.42Å; E179-S184 PolarHBondContact OE1-N 3.11Å; E179-S184 PolarHBondContact OE1-OG 3.22Å; N182-S184 PolarHBondContact O-N 3.04Å; S184-P186 WeakPolarHBondContact OG-CD 3.42Å; S184-T187 WeakPolarHBondContact O-CB 3.34Å; S184-T187 PolarHBondContact O-N 3.26Å; S184-T187 PolarHBondContact OG-OG1 3.2Å; S184-K188 PolarHBondContact O-N 3.29Å
185F88.9Confident88.8Confident9 Ų951.9 Ų51.94%0.03927%0.271CS..Hα-helixtrans-50.1-49.2176.5164.3-101.2000113.4T187 K188 A189 F219 M220 T223 K224 L227 P236 F237F185-T187 VanDerWaalsContact C-N 3.26Å; F185-T187 PolarHBondContact O-N 3.26Å; F185-K188 PolarHBondContact O-N 3.16Å; F185-A189 HydrophobicContact CE2-CB 4.13Å; F185-A189 HydrophobicContact CZ-CB 4.13Å; F185-A189 VanDerWaalsContact O-CB 3.29Å; F185-A189 WeakPolarHBondContact O-CB 2.92Å; F185-A189 PolarHBondContact O-N 3.11Å; F185-F219 HydrophobicContact CE2-CZ 4.43Å; F185-F219 HydrophobicContact CZ-CE1 4.37Å; F185-M220 HydrophobicContact CZ-SD 4.31Å; F185-T223 HydrophobicContact CE1-CG2 3.76Å; F185-T223 HydrophobicContact CE2-CG2 3.83Å; F185-T223 HydrophobicContact CZ-CG2 3.32Å; F185-K224 HydrophobicContact CD1-CD 3.84Å; F185-K224 HydrophobicContact CD1-CG 4.49Å; F185-K224 HydrophobicContact CE1-CD 3.78Å; F185-K224 HydrophobicContact CE1-CG 3.92Å; F185-L227 HydrophobicContact CD1-CD1 3.73Å; F185-L227 HydrophobicContact CE1-CD1 4.17Å; F185-L227 HydrophobicContact CG-CD1 4.1Å; F185-P236 VanDerWaalsContact CD2-CD 3.45Å; F185-P236 HydrophobicContact CD2-CG 4Å; F185-P236 HydrophobicContact CE2-CG 3.6Å; F185-P236 HydrophobicContact CZ-CG 4.5Å; F185-F237 AromaticContact CD2-CD2 3.8Å; F185-F237 HydrophobicContact CD2-CD2 3.8Å; F185-F237 AromaticContact CD2-CE2 3.67Å; F185-F237 HydrophobicContact CD2-CE2 3.67Å; F185-F237 AromaticContact CE2-CD2 3.89Å; F185-F237 HydrophobicContact CE2-CD2 3.89Å; F185-F237 AromaticContact CE2-CE2 3.34Å; F185-F237 HydrophobicContact CE2-CE2 3.34Å; F185-F237 HydrophobicContact CE2-CZ 4.12Å; F185-F237 HydrophobicContact CZ-CE2 4.42Å
186P90.6Very high89.3Confident19 Ų1951.7 Ų51.712%0.12327%0.266CS..Hα-helixtrans-59.2-35.4178.7-23.332.2000113.9S184 S190 K224S184-P186 WeakPolarHBondContact OG-CD 3.42Å; P186-S190 VanDerWaalsContact O-CB 3.31Å; P186-S190 WeakPolarHBondContact O-CB 3.25Å; P186-S190 PolarHBondContact O-N 3.45Å; P186-S190 PolarHBondContact O-OG 2.78Å; P186-K224 HydrophobicContact CG-CD 4.23Å
187T92.3Very high89.9Confident1 Ų144.2 Ų44.21%0.00623%0.231CC..Hα-helixtrans-69.9-48.7178.2-610000110.7Y153 L161 E179 M183 S184 F185 A189 S190 L191Y153-T187 HydrophobicContact CE2-CG2 3.54Å; Y153-T187 WeakPolarHBondContact OH-CG2 3.45Å; L161-T187 HydrophobicContact CD2-CG2 4.37Å; E179-T187 HydrophobicContact CG-CG2 3.93Å; E179-T187 WeakPolarHBondContact OE1-CB 3.3Å; E179-T187 PolarHBondContact OE1-OG1 3.04Å; M183-T187 HydrophobicContact CB-CG2 4.23Å; M183-T187 HydrophobicContact CE-CG2 4.01Å; M183-T187 HydrophobicContact CG-CG2 3.97Å; S184-T187 WeakPolarHBondContact O-CB 3.34Å; S184-T187 PolarHBondContact O-N 3.26Å; S184-T187 PolarHBondContact OG-OG1 3.2Å; F185-T187 VanDerWaalsContact C-N 3.26Å; F185-T187 PolarHBondContact O-N 3.26Å; T187-A189 PolarHBondContact O-N 3.05Å; T187-S190 WeakPolarHBondContact O-CB 3.49Å; T187-S190 PolarHBondContact O-N 2.9Å; T187-L191 PolarHBondContact O-N 2.95Å
188K91.8Very high90.7Very high27 Ų2741 Ų4112%0.11721%0.211CC..Hα-helixtrans-58-48.7174.7-65.2-170.5-178.5-177.20111.5M183 S184 F185 S190 L191 Y192 F237 E241M183-K188 HydrophobicContact CB-CD 4.21Å; M183-K188 HydrophobicContact CB-CG 3.51Å; M183-K188 HydrophobicContact CG-CG 4.39Å; M183-K188 WeakPolarHBondContact O-CE 3.35Å; M183-K188 HydrophobicContact SD-CG 3.98Å; S184-K188 PolarHBondContact O-N 3.29Å; F185-K188 PolarHBondContact O-N 3.16Å; K188-S190 VanDerWaalsContact C-N 3.27Å; K188-S190 PolarHBondContact O-N 3.42Å; K188-L191 WeakPolarHBondContact O-CB 3.45Å; K188-L191 PolarHBondContact O-N 2.65Å; K188-L191 VanDerWaalsContact O-N 3.12Å; K188-Y192 HydrophobicContact CB-CE2 4.4Å; K188-Y192 WeakPolarHBondContact O-CD2 3.3Å; K188-Y192 PolarHBondContact O-N 3.27Å; K188-F237 HydrophobicContact CB-CD2 4.31Å; K188-E241 IonicContact NZ-OE1 2.97Å; K188-E241 PolarHBondContact NZ-OE1 3.12Å; K188-E241 IonicContact NZ-OE2 3.48Å; K188-E241 PolarHBondContact NZ-OE2 3.07Å
189A93.5Very high91.2Very high0 Ų041.1 Ų41.10%021%0.212CC..Hα-helixtrans-61.4-38.2179.100000111.7F185 T187 L191 Y192 G193 F216 M220 F237F185-A189 HydrophobicContact CE2-CB 4.13Å; F185-A189 HydrophobicContact CZ-CB 4.13Å; F185-A189 VanDerWaalsContact O-CB 3.29Å; F185-A189 WeakPolarHBondContact O-CB 2.92Å; F185-A189 PolarHBondContact O-N 3.11Å; T187-A189 PolarHBondContact O-N 3.05Å; A189-L191 VanDerWaalsContact C-N 3.33Å; A189-L191 PolarHBondContact O-N 3.46Å; A189-Y192 PolarHBondContact O-N 3.31Å; A189-G193 PolarHBondContact O-N 2.83Å; A189-F216 WeakPolarHBondContact O-CZ 3.44Å; A189-M220 HydrophobicContact CB-CE 3.72Å; A189-M220 HydrophobicContact CB-SD 3.35Å; A189-M220 WeakPolarHBondContact CB-SD 3.36Å; A189-F237 HydrophobicContact CB-CE2 3.9Å; A189-F237 HydrophobicContact CB-CZ 4.41Å
190S95.6Very high91.7Very high0 Ų040.6 Ų40.60%021%0.209CC..Hα-helixtrans-64.4-36.8175.7-610000112.4G156 S157 P186 T187 K188 A194G156-S190 VanDerWaalsContact C-OG 3.27Å; G156-S190 PolarHBondContact O-OG 3.18Å; S157-S190 WeakPolarHBondContact OG-CB 3.41Å; P186-S190 VanDerWaalsContact O-CB 3.31Å; P186-S190 WeakPolarHBondContact O-CB 3.25Å; P186-S190 PolarHBondContact O-N 3.45Å; P186-S190 PolarHBondContact O-OG 2.78Å; T187-S190 WeakPolarHBondContact O-CB 3.49Å; T187-S190 PolarHBondContact O-N 2.9Å; K188-S190 VanDerWaalsContact C-N 3.27Å; K188-S190 PolarHBondContact O-N 3.42Å; S190-A194 WeakPolarHBondContact O-CB 3.5Å; S190-A194 PolarHBondContact O-N 3.19Å
191L95.4Very high92.3Very high52 Ų5235.8 Ų35.827%0.27218%0.184SC..Hα-helixtrans-64.6-49.8174.2179.362000111.3V149 Y153 M183 T187 K188 A189 G193 A194 I195V149-L191 HydrophobicContact CG1-CD1 3.92Å; Y153-L191 HydrophobicContact CD2-CB 3.74Å; Y153-L191 HydrophobicContact CD2-CD1 4.24Å; Y153-L191 HydrophobicContact CE2-CB 4.03Å; Y153-L191 HydrophobicContact CG-CB 4.46Å; Y153-L191 HydrophobicContact CG-CD1 4.14Å; M183-L191 HydrophobicContact CE-CD2 4.07Å; T187-L191 PolarHBondContact O-N 2.95Å; K188-L191 WeakPolarHBondContact O-CB 3.45Å; K188-L191 PolarHBondContact O-N 2.65Å; K188-L191 VanDerWaalsContact O-N 3.12Å; A189-L191 VanDerWaalsContact C-N 3.33Å; A189-L191 PolarHBondContact O-N 3.46Å; L191-G193 VanDerWaalsContact C-N 3.33Å; L191-G193 PolarHBondContact O-N 3.11Å; L191-A194 WeakPolarHBondContact O-CB 3.14Å; L191-A194 PolarHBondContact O-N 3.47Å; L191-I195 HydrophobicContact CG-CD1 4.32Å; L191-I195 WeakPolarHBondContact O-CG1 3.34Å; L191-I195 PolarHBondContact O-N 2.91Å
192Y94.8Very high92.8Very high85 Ų8531.8 Ų31.833%0.33316%0.164SC..Hα-helixtrans-61-42.2176.3-69.5-61.8000112.1K188 A189 A194 I195 L196 F237K188-Y192 HydrophobicContact CB-CE2 4.4Å; K188-Y192 WeakPolarHBondContact O-CD2 3.3Å; K188-Y192 PolarHBondContact O-N 3.27Å; A189-Y192 PolarHBondContact O-N 3.31Å; Y192-A194 VanDerWaalsContact C-N 3.34Å; Y192-A194 PolarHBondContact O-N 2.95Å; Y192-I195 PolarHBondContact O-N 3.04Å; Y192-L196 WeakPolarHBondContact O-CG 3.09Å; Y192-L196 PolarHBondContact O-N 3.31Å; Y192-F237 HydrophobicContact CD2-CD2 4.46Å; Y192-F237 HydrophobicContact CD2-CE1 4.28Å; Y192-F237 HydrophobicContact CD2-CE2 4.21Å; Y192-F237 HydrophobicContact CD2-CZ 4.11Å; Y192-F237 HydrophobicContact CE2-CD1 4.22Å; Y192-F237 HydrophobicContact CE2-CD2 4.29Å; Y192-F237 HydrophobicContact CE2-CE1 4.45Å; Y192-F237 HydrophobicContact CE2-CE2 4.48Å; Y192-F237 HydrophobicContact CE2-CG 4.14Å
193G95.9Very high93.1Very high0 Ų034.7 Ų34.70%017%0.174CC..Hα-helixtrans-57.8-46173.700000111.8A189 L191 I195 L196 F197 F216A189-G193 PolarHBondContact O-N 2.83Å; L191-G193 VanDerWaalsContact C-N 3.33Å; L191-G193 PolarHBondContact O-N 3.11Å; G193-I195 VanDerWaalsContact C-N 3.35Å; G193-I195 PolarHBondContact O-N 3.31Å; G193-L196 PolarHBondContact O-N 2.79Å; G193-F197 WeakPolarHBondContact O-CD2 3.46Å; G193-F197 PolarHBondContact O-N 3.39Å; G193-F216 VanDerWaalsContact CA-CZ 3.43Å
194A96.8Very high93.2Very high0 Ų038.4 Ų38.40%019%0.194CC..Hα-helixtrans-62.2-39.8178.200000112.6I130 V149 S190 L191 Y192 T198I130-A194 HydrophobicContact CG2-CB 4.07Å; V149-A194 HydrophobicContact CG1-CB 4.34Å; V149-A194 WeakPolarHBondContact O-CB 3.44Å; S190-A194 WeakPolarHBondContact O-CB 3.5Å; S190-A194 PolarHBondContact O-N 3.19Å; L191-A194 WeakPolarHBondContact O-CB 3.14Å; L191-A194 PolarHBondContact O-N 3.47Å; Y192-A194 VanDerWaalsContact C-N 3.34Å; Y192-A194 PolarHBondContact O-N 2.95Å; A194-T198 VanDerWaalsContact O-CB 3.31Å; A194-T198 WeakPolarHBondContact O-CB 3.23Å; A194-T198 PolarHBondContact O-N 2.83Å; A194-T198 PolarHBondContact O-OG1 2.99Å
195I96.6Very high93.3Very high66 Ų6638.6 Ų38.634%0.33819%0.191SC..Hα-helixtrans-61.8-50.2173.2-65.1166.3000110.4V149 L191 Y192 G193 F197 T198 L199V149-I195 HydrophobicContact CG1-CG1 3.89Å; V149-I195 HydrophobicContact CG2-CG1 4.19Å; L191-I195 HydrophobicContact CG-CD1 4.32Å; L191-I195 WeakPolarHBondContact O-CG1 3.34Å; L191-I195 PolarHBondContact O-N 2.91Å; Y192-I195 PolarHBondContact O-N 3.04Å; G193-I195 VanDerWaalsContact C-N 3.35Å; G193-I195 PolarHBondContact O-N 3.31Å; I195-F197 PolarHBondContact O-N 3.5Å; I195-T198 PolarHBondContact O-N 3.03Å; I195-T198 VanDerWaalsContact O-N 3.16Å; I195-L199 HydrophobicContact CG2-CD1 4.04Å; I195-L199 HydrophobicContact CG2-CG 4.4Å; I195-L199 WeakPolarHBondContact O-CG 3.17Å; I195-L199 PolarHBondContact O-N 3.09Å
196L96.1Very high93.4Very high64 Ų6444.2 Ų44.234%0.33523%0.229SC..Hα-helixtrans-60.3-45.6179.9-70.6173.8000112.5Y192 G193 T198 L199 Q200 L212 F216Y192-L196 WeakPolarHBondContact O-CG 3.09Å; Y192-L196 PolarHBondContact O-N 3.31Å; G193-L196 PolarHBondContact O-N 2.79Å; L196-T198 VanDerWaalsContact C-N 3.3Å; L196-T198 PolarHBondContact O-N 2.81Å; L196-L199 PolarHBondContact O-N 3.06Å; L196-Q200 WeakPolarHBondContact O-CB 3.2Å; L196-Q200 PolarHBondContact O-N 3.25Å; L196-L212 HydrophobicContact CB-CD1 4.5Å; L196-L212 HydrophobicContact CB-CD2 4.49Å; L196-F216 HydrophobicContact CD1-CD2 4.36Å
197F96.4Very high93.3Very high2 Ų245.9 Ų45.91%0.00924%0.239CC..Hα-helixtrans-66-33.4176.6-76.4-61.3000112.2T127 I130 A131 V134 G193 I195 Q200 E201 L212 I213 F216T127-F197 HydrophobicContact CG2-CE2 3.99Å; T127-F197 HydrophobicContact CG2-CZ 3.74Å; I130-F197 HydrophobicContact CB-CD2 4.4Å; I130-F197 HydrophobicContact CG2-CD2 3.72Å; I130-F197 HydrophobicContact CG2-CE2 4.29Å; A131-F197 HydrophobicContact CB-CD1 3.98Å; A131-F197 HydrophobicContact CB-CD2 4.34Å; A131-F197 HydrophobicContact CB-CE1 3.96Å; A131-F197 HydrophobicContact CB-CE2 4.32Å; A131-F197 HydrophobicContact CB-CG 4.21Å; A131-F197 HydrophobicContact CB-CZ 4.14Å; V134-F197 HydrophobicContact CB-CB 4.31Å; V134-F197 HydrophobicContact CG1-CB 4.27Å; V134-F197 HydrophobicContact CG2-CB 4.04Å; G193-F197 WeakPolarHBondContact O-CD2 3.46Å; G193-F197 PolarHBondContact O-N 3.39Å; I195-F197 PolarHBondContact O-N 3.5Å; F197-Q200 PolarHBondContact O-N 2.86Å; F197-E201 WeakPolarHBondContact O-CG 3.47Å; F197-E201 PolarHBondContact O-N 3.31Å; F197-L212 HydrophobicContact CD1-CD2 3.6Å; F197-L212 HydrophobicContact CD1-CG 4.08Å; F197-L212 HydrophobicContact CE1-CB 4.24Å; F197-L212 HydrophobicContact CE1-CD2 3.76Å; F197-L212 HydrophobicContact CE1-CG 3.69Å; F197-L212 HydrophobicContact CG-CD2 4.32Å; F197-L212 HydrophobicContact CZ-CG 4.24Å; F197-I213 HydrophobicContact CE1-CG1 3.65Å; F197-I213 HydrophobicContact CZ-CG1 3.94Å; F197-F216 HydrophobicContact CE2-CD1 4.01Å; F197-F216 HydrophobicContact CE2-CG 4.37Å; F197-F216 HydrophobicContact CZ-CB 4.41Å; F197-F216 HydrophobicContact CZ-CD1 4.45Å
198T96.3Very high93.2Very high5 Ų548.5 Ų48.53%0.03126%0.257CS..Hα-helixtrans-67.5-47.3174.8-58.50000110.7F145 M148 V149 A194 I195 L196 Q200 E201 T202F145-T198 HydrophobicContact CB-CG2 4.41Å; F145-T198 HydrophobicContact CD1-CG2 4.37Å; M148-T198 HydrophobicContact CB-CG2 3.86Å; M148-T198 HydrophobicContact SD-CG2 3.92Å; V149-T198 HydrophobicContact CG2-CG2 4.08Å; V149-T198 WeakPolarHBondContact CG2-OG1 3.49Å; A194-T198 VanDerWaalsContact O-CB 3.31Å; A194-T198 WeakPolarHBondContact O-CB 3.23Å; A194-T198 PolarHBondContact O-N 2.83Å; A194-T198 PolarHBondContact O-OG1 2.99Å; I195-T198 PolarHBondContact O-N 3.03Å; I195-T198 VanDerWaalsContact O-N 3.16Å; L196-T198 VanDerWaalsContact C-N 3.3Å; L196-T198 PolarHBondContact O-N 2.81Å; T198-Q200 PolarHBondContact O-N 3.27Å; T198-E201 PolarHBondContact O-N 3.18Å; T198-T202 HydrophobicContact CG2-CG2 4.36Å; T198-T202 WeakPolarHBondContact O-CG2 3.41Å; T198-T202 PolarHBondContact O-N 3.04Å; T198-T202 PolarHBondContact O-OG1 3.41Å; T198-T202 VanDerWaalsContact O-OG1 3.13Å
199L94.4Very high93Very high63 Ų6350.3 Ų50.333%0.3327%0.265SS..Hα-helixtrans-59.4-32.4175-67.6173.6000112.4I195 L196 T202 H203 L204 L205I195-L199 HydrophobicContact CG2-CD1 4.04Å; I195-L199 HydrophobicContact CG2-CG 4.4Å; I195-L199 WeakPolarHBondContact O-CG 3.17Å; I195-L199 PolarHBondContact O-N 3.09Å; L196-L199 PolarHBondContact O-N 3.06Å; L199-T202 PolarHBondContact O-OG1 3.09Å; L199-H203 PolarHBondContact O-N 3.08Å; L199-L204 HydrophobicContact CD2-CB 4.2Å; L199-L204 HydrophobicContact CD2-CD1 3.89Å; L199-L204 PolarHBondContact O-N 3.35Å; L199-L205 HydrophobicContact CB-CB 4.13Å; L199-L205 PolarHBondContact O-N 3.18Å
200Q94.9Very high92.8Very high20 Ų2052.3 Ų52.39%0.09328%0.277CS..Hα-helixtrans-73.9-44.2175.7-173.9-84.4-64.600112.6L196 F197 T198 T202 H203 L205 V207 L212L196-Q200 WeakPolarHBondContact O-CB 3.2Å; L196-Q200 PolarHBondContact O-N 3.25Å; F197-Q200 PolarHBondContact O-N 2.86Å; T198-Q200 PolarHBondContact O-N 3.27Å; Q200-T202 PolarHBondContact O-N 3.03Å; Q200-H203 PolarHBondContact O-N 3.39Å; Q200-L205 HydrophobicContact CB-CB 4.39Å; Q200-L205 HydrophobicContact CB-CD2 4.37Å; Q200-V207 WeakPolarHBondContact CG-O 3.5Å; Q200-L212 HydrophobicContact CB-CD2 3.56Å; Q200-L212 HydrophobicContact CG-CD2 3.82Å
201E92.4Very high92.5Very high25 Ų2553.3 Ų53.312%0.11728%0.283CS..Hα-helixtrans-63-26.6175.5-72.8-71.414000112V134 H135 F197 T198 H203 K209V134-E201 HydrophobicContact CG1-CG 3.87Å; H135-E201 IonicContact CE1-OE2 3.96Å; H135-E201 IonicContact ND1-OE1 3.68Å; H135-E201 IonicContact ND1-OE2 3.03Å; H135-E201 PolarHBondContact ND1-OE2 3.48Å; F197-E201 WeakPolarHBondContact O-CG 3.47Å; F197-E201 PolarHBondContact O-N 3.31Å; T198-E201 PolarHBondContact O-N 3.18Å; E201-H203 VanDerWaalsContact C-N 3.32Å; E201-K209 WeakPolarHBondContact OE1-CE 3.42Å; E201-K209 IonicContact OE1-NZ 2.7Å; E201-K209 PolarHBondContact OE1-NZ 3.08Å
202T90.6Very high92.4Very high29 Ų2951.5 Ų51.518%0.17827%0.274CS..THydrogen-bonded Turntrans-948.4-177.866.50000113.3F145 M148 T198 L199 Q200 L204F145-T202 HydrophobicContact CD1-CG2 3.49Å; F145-T202 VanDerWaalsContact CD1-CG2 3.49Å; F145-T202 HydrophobicContact CE1-CG2 3.26Å; M148-T202 HydrophobicContact SD-CG2 4.47Å; T198-T202 HydrophobicContact CG2-CG2 4.36Å; T198-T202 WeakPolarHBondContact O-CG2 3.41Å; T198-T202 PolarHBondContact O-N 3.04Å; T198-T202 PolarHBondContact O-OG1 3.41Å; T198-T202 VanDerWaalsContact O-OG1 3.13Å; L199-T202 PolarHBondContact O-OG1 3.09Å; Q200-T202 PolarHBondContact O-N 3.03Å; T202-L204 PolarHBondContact O-N 3.35Å; T202-L204 VanDerWaalsContact O-N 3.13Å
203H88.8Confident92.3Very high168 Ų16848.2 Ų48.278%0.77826%0.262SS*.THydrogen-bonded Turntrans60.215.4-179.1-55.5-73000115.2L199 Q200 E201L199-H203 PolarHBondContact O-N 3.08Å; Q200-H203 PolarHBondContact O-N 3.39Å; E201-H203 VanDerWaalsContact C-N 3.32Å
204L88.6Confident92.1Very high126 Ų12649 Ų4966%0.6627%0.267SS*.  trans-78.4-25.8173.9-67.1178.9000112.3L199 T202L199-L204 HydrophobicContact CD2-CB 4.2Å; L199-L204 HydrophobicContact CD2-CD1 3.89Å; L199-L204 PolarHBondContact O-N 3.35Å; T202-L204 PolarHBondContact O-N 3.35Å; T202-L204 VanDerWaalsContact O-N 3.13Å
205L89.6Confident91.9Very high49 Ų4953.2 Ų53.226%0.25729%0.289SS..SBendtrans-101.1114.2174.6-167.871.3000110L199 Q200 V207 L212L199-L205 HydrophobicContact CB-CB 4.13Å; L199-L205 PolarHBondContact O-N 3.18Å; Q200-L205 HydrophobicContact CB-CB 4.39Å; Q200-L205 HydrophobicContact CB-CD2 4.37Å; L205-V207 HydrophobicContact CD2-CB 4.38Å; L205-V207 HydrophobicContact CD2-CG2 4.44Å; L205-V207 HydrophobicContact CG-CB 4.32Å; L205-V207 HydrophobicContact CG-CG2 4.14Å; L205-V207 PolarHBondContact O-N 3.38Å; L205-L212 HydrophobicContact CD2-CD1 4.37Å; L205-L212 HydrophobicContact CD2-CD2 4.18Å
206P89Confident91.8Very high128 Ų12850.8 Ų50.883%0.83128%0.276SS*.  trans-79.457.4-17833.9-36.7000111.7
207V89.2Confident91.7Very high54 Ų5448 Ų4833%0.32726%0.262SS..SBendtrans-133.1139.4178.4179.10000108.9Q200 L205 T211 L212Q200-V207 WeakPolarHBondContact CG-O 3.5Å; L205-V207 HydrophobicContact CD2-CB 4.38Å; L205-V207 HydrophobicContact CD2-CG2 4.44Å; L205-V207 HydrophobicContact CG-CB 4.32Å; L205-V207 HydrophobicContact CG-CG2 4.14Å; L205-V207 PolarHBondContact O-N 3.38Å; V207-T211 HydrophobicContact CG1-CG2 4.07Å; V207-L212 HydrophobicContact CG1-CB 4.25Å
208S89.8Confident91.5Very high55 Ų5550.3 Ų50.339%0.38528%0.281SS..  trans-65143.717790.10000111.3T210 T211 L212S208-T210 VanDerWaalsContact C-N 3.26Å; S208-T210 PolarHBondContact O-N 2.96Å; S208-T210 PolarHBondContact OG-OG1 3.23Å; S208-T210 VanDerWaalsContact OG-OG1 3.12Å; S208-T211 PolarHBondContact O-N 3.18Å; S208-T211 VanDerWaalsContact OG-CB 3.25Å; S208-T211 WeakPolarHBondContact OG-CB 3.29Å; S208-T211 PolarHBondContact OG-N 3.38Å; S208-T211 VanDerWaalsContact OG-N 3.09Å; S208-T211 PolarHBondContact OG-OG1 3.34Å; S208-L212 PolarHBondContact O-N 3.02Å
209K88.6Confident91.4Very high65 Ų6553.6 Ų53.628%0.28330%0.295SS..Hα-helixtrans-54.4-41.7177.8-176.6167.6-178163.60112.5E201 L212 I213E201-K209 WeakPolarHBondContact OE1-CE 3.42Å; E201-K209 IonicContact OE1-NZ 2.7Å; E201-K209 PolarHBondContact OE1-NZ 3.08Å; K209-L212 PolarHBondContact O-N 3.2Å; K209-I213 HydrophobicContact CG-CD1 4.04Å; K209-I213 VanDerWaalsContact O-CG1 3.25Å; K209-I213 WeakPolarHBondContact O-CG1 3.38Å; K209-I213 PolarHBondContact O-N 2.78Å
210T89.4Confident91.4Very high43 Ų4350.6 Ų50.626%0.26428%0.279SS..Hα-helixtrans-67-44-179.7510000111.5S17 S208 I213 C214S17-T210 WeakPolarHBondContact OG-CG2 3.36Å; S208-T210 VanDerWaalsContact C-N 3.26Å; S208-T210 PolarHBondContact O-N 2.96Å; S208-T210 PolarHBondContact OG-OG1 3.23Å; S208-T210 VanDerWaalsContact OG-OG1 3.12Å; T210-I213 PolarHBondContact O-N 3Å; T210-C214 WeakPolarHBondContact O-CB 3.43Å; T210-C214 PolarHBondContact O-N 3.15Å
211T90Very high91.3Very high20 Ų2050.4 Ų50.412%0.12328%0.282CS..Hα-helixtrans-61.7-44.2174.9-570000111L4 V207 S208 C214 L215L4-T211 HydrophobicContact CD2-CG2 4.2Å; V207-T211 HydrophobicContact CG1-CG2 4.07Å; S208-T211 PolarHBondContact O-N 3.18Å; S208-T211 VanDerWaalsContact OG-CB 3.25Å; S208-T211 WeakPolarHBondContact OG-CB 3.29Å; S208-T211 PolarHBondContact OG-N 3.38Å; S208-T211 VanDerWaalsContact OG-N 3.09Å; S208-T211 PolarHBondContact OG-OG1 3.34Å; T211-C214 PolarHBondContact O-N 3.17Å; T211-L215 HydrophobicContact CG2-CD1 3.86Å; T211-L215 HydrophobicContact CG2-CG 4.22Å; T211-L215 WeakPolarHBondContact O-CB 3.5Å; T211-L215 WeakPolarHBondContact O-CG 3.17Å; T211-L215 PolarHBondContact O-N 3.16Å
212L92.6Very high91.3Very high14 Ų1453 Ų537%0.07330%0.299CS..Hα-helixtrans-63.1-43.8178.2-176.360.7000112L196 F197 Q200 L205 V207 S208 K209 C214 L215 F216L196-L212 HydrophobicContact CB-CD1 4.5Å; L196-L212 HydrophobicContact CB-CD2 4.49Å; F197-L212 HydrophobicContact CD1-CD2 3.6Å; F197-L212 HydrophobicContact CD1-CG 4.08Å; F197-L212 HydrophobicContact CE1-CB 4.24Å; F197-L212 HydrophobicContact CE1-CD2 3.76Å; F197-L212 HydrophobicContact CE1-CG 3.69Å; F197-L212 HydrophobicContact CG-CD2 4.32Å; F197-L212 HydrophobicContact CZ-CG 4.24Å; Q200-L212 HydrophobicContact CB-CD2 3.56Å; Q200-L212 HydrophobicContact CG-CD2 3.82Å; L205-L212 HydrophobicContact CD2-CD1 4.37Å; L205-L212 HydrophobicContact CD2-CD2 4.18Å; V207-L212 HydrophobicContact CG1-CB 4.25Å; S208-L212 PolarHBondContact O-N 3.02Å; K209-L212 PolarHBondContact O-N 3.2Å; L212-C214 VanDerWaalsContact C-N 3.31Å; L212-C214 PolarHBondContact O-N 2.93Å; L212-L215 PolarHBondContact O-N 2.89Å; L212-F216 WeakPolarHBondContact O-CB 3.37Å; L212-F216 PolarHBondContact O-N 3.03Å
213I92.3Very high91.3Very high16 Ų1652.6 Ų52.68%0.08230%0.297CS..Hα-helixtrans-57.2-46.3173.4-71.4168.8000110.5F16 T127 A131 F197 K209 T210 T217F16-I213 HydrophobicContact CD1-CG2 4.45Å; F16-I213 HydrophobicContact CE1-CG2 4.32Å; T127-I213 HydrophobicContact CG2-CG2 4.26Å; A131-I213 HydrophobicContact CB-CD1 4.38Å; A131-I213 HydrophobicContact CB-CG1 4.36Å; F197-I213 HydrophobicContact CE1-CG1 3.65Å; F197-I213 HydrophobicContact CZ-CG1 3.94Å; K209-I213 HydrophobicContact CG-CD1 4.04Å; K209-I213 VanDerWaalsContact O-CG1 3.25Å; K209-I213 WeakPolarHBondContact O-CG1 3.38Å; K209-I213 PolarHBondContact O-N 2.78Å; T210-I213 PolarHBondContact O-N 3Å; I213-T217 WeakPolarHBondContact O-CB 3.35Å; I213-T217 PolarHBondContact O-N 2.98Å; I213-T217 PolarHBondContact O-OG1 3.43Å
214C91.3Very high91.4Very high18 Ų1845.6 Ų45.612%0.12226%0.264CS..Hα-helixtrans-63.8-51.8-178.8-171.10000111.9A13 T210 T211 L212 T217 A218A13-C214 HydrophobicContact CB-CB 3.71Å; T210-C214 WeakPolarHBondContact O-CB 3.43Å; T210-C214 PolarHBondContact O-N 3.15Å; T211-C214 PolarHBondContact O-N 3.17Å; L212-C214 VanDerWaalsContact C-N 3.31Å; L212-C214 PolarHBondContact O-N 2.93Å; C214-T217 PolarHBondContact O-N 3.34Å; C214-A218 WeakPolarHBondContact O-CB 3.42Å; C214-A218 PolarHBondContact O-N 2.87Å
215L92.4Very high91.6Very high88 Ų8841.5 Ų41.546%0.46124%0.244SC..Hα-helixtrans-62.6-47.6-178.9-70.1177.2000111.9L9 T211 L212 T217 A218 F219L9-L215 HydrophobicContact CD2-CD2 4.04Å; T211-L215 HydrophobicContact CG2-CD1 3.86Å; T211-L215 HydrophobicContact CG2-CG 4.22Å; T211-L215 WeakPolarHBondContact O-CB 3.5Å; T211-L215 WeakPolarHBondContact O-CG 3.17Å; T211-L215 PolarHBondContact O-N 3.16Å; L212-L215 PolarHBondContact O-N 2.89Å; L215-T217 VanDerWaalsContact C-N 3.32Å; L215-T217 PolarHBondContact O-N 2.97Å; L215-A218 PolarHBondContact O-N 2.83Å; L215-F219 PolarHBondContact O-N 3.42Å
216F94.4Very high91.5Very high15 Ų1544 Ų447%0.06626%0.257CS..Hα-helixtrans-65.7-37.7179.5-172.3-100.1000111.5T127 I130 A189 G193 L196 F197 L212 F219 M220T127-F216 HydrophobicContact CG2-CB 4.44Å; T127-F216 HydrophobicContact CG2-CD1 3.63Å; T127-F216 HydrophobicContact CG2-CE1 4.46Å; T127-F216 WeakPolarHBondContact OG1-CD1 3.48Å; I130-F216 HydrophobicContact CD1-CE1 4.08Å; A189-F216 WeakPolarHBondContact O-CZ 3.44Å; G193-F216 VanDerWaalsContact CA-CZ 3.43Å; L196-F216 HydrophobicContact CD1-CD2 4.36Å; F197-F216 HydrophobicContact CE2-CD1 4.01Å; F197-F216 HydrophobicContact CE2-CG 4.37Å; F197-F216 HydrophobicContact CZ-CB 4.41Å; F197-F216 HydrophobicContact CZ-CD1 4.45Å; L212-F216 WeakPolarHBondContact O-CB 3.37Å; L212-F216 PolarHBondContact O-N 3.03Å; F216-F219 PolarHBondContact O-N 2.9Å; F216-M220 HydrophobicContact CD1-CG 3.97Å; F216-M220 HydrophobicContact CE1-CG 3.56Å; F216-M220 HydrophobicContact CE1-SD 4.28Å; F216-M220 HydrophobicContact CE2-CG 4.39Å; F216-M220 HydrophobicContact CZ-CG 3.78Å; F216-M220 HydrophobicContact CZ-SD 3.99Å; F216-M220 WeakPolarHBondContact O-CB 3.31Å; F216-M220 VanDerWaalsContact O-CG 3.3Å; F216-M220 WeakPolarHBondContact O-CG 3.45Å; F216-M220 PolarHBondContact O-N 3.4Å
217T94.1Very high91.5Very high4 Ų439.2 Ų39.23%0.02522%0.224CC..Hα-helixtrans-65.6-42.7174.8-58.70000112.2F16 V124 T127 I213 C214 L215 F219 M220 A221F16-T217 HydrophobicContact CE1-CG2 4Å; F16-T217 HydrophobicContact CZ-CG2 3.66Å; V124-T217 HydrophobicContact CB-CG2 4.05Å; V124-T217 HydrophobicContact CG1-CG2 4.32Å; V124-T217 HydrophobicContact CG2-CG2 3.66Å; T127-T217 VanDerWaalsContact CB-OG1 3.24Å; T127-T217 WeakPolarHBondContact CB-OG1 3.47Å; T127-T217 WeakPolarHBondContact CG2-OG1 3.39Å; T127-T217 PolarHBondContact OG1-OG1 3.03Å; I213-T217 WeakPolarHBondContact O-CB 3.35Å; I213-T217 PolarHBondContact O-N 2.98Å; I213-T217 PolarHBondContact O-OG1 3.43Å; C214-T217 PolarHBondContact O-N 3.34Å; L215-T217 VanDerWaalsContact C-N 3.32Å; L215-T217 PolarHBondContact O-N 2.97Å; T217-F219 VanDerWaalsContact C-N 3.32Å; T217-F219 PolarHBondContact O-N 3.19Å; T217-M220 PolarHBondContact O-N 3Å; T217-A221 WeakPolarHBondContact O-CB 3.47Å; T217-A221 PolarHBondContact O-N 3.47Å
218A93Very high91.4Very high51 Ų5137.4 Ų37.442%0.42121%0.213SC..Hα-helixtrans-60-44.6175.800000111C214 L215 T222C214-A218 WeakPolarHBondContact O-CB 3.42Å; C214-A218 PolarHBondContact O-N 2.87Å; L215-A218 PolarHBondContact O-N 2.83Å; A218-T222 VanDerWaalsContact O-CB 3.31Å; A218-T222 WeakPolarHBondContact O-CB 3.49Å; A218-T222 WeakPolarHBondContact O-CG2 3.45Å; A218-T222 PolarHBondContact O-N 3.15Å; A218-T222 PolarHBondContact O-OG1 3.07Å
219F94.2Very high91.3Very high74 Ų7437 Ų3733%0.32521%0.213SC..Hα-helixtrans-59.2-49.3174.6170.4-100000112.5F185 L215 F216 T217 T222 T223 F237F185-F219 HydrophobicContact CE2-CZ 4.43Å; F185-F219 HydrophobicContact CZ-CE1 4.37Å; L215-F219 PolarHBondContact O-N 3.42Å; F216-F219 PolarHBondContact O-N 2.9Å; T217-F219 VanDerWaalsContact C-N 3.32Å; T217-F219 PolarHBondContact O-N 3.19Å; F219-T222 PolarHBondContact O-OG1 2.95Å; F219-T222 VanDerWaalsContact O-OG1 3.12Å; F219-T223 VanDerWaalsContact O-CB 3.28Å; F219-T223 WeakPolarHBondContact O-CB 3.22Å; F219-T223 PolarHBondContact O-N 2.97Å; F219-T223 PolarHBondContact O-OG1 3.3Å; F219-F237 HydrophobicContact CE1-CE1 4.49Å; F219-F237 HydrophobicContact CE1-CE2 4.48Å; F219-F237 AromaticContact CE1-CZ 3.7Å; F219-F237 HydrophobicContact CE1-CZ 3.7Å; F219-F237 AromaticContact CZ-CE1 3.97Å; F219-F237 HydrophobicContact CZ-CE1 3.97Å; F219-F237 HydrophobicContact CZ-CE2 4.35Å; F219-F237 AromaticContact CZ-CZ 3.5Å; F219-F237 HydrophobicContact CZ-CZ 3.5Å
220M94Very high91.1Very high0 Ų043.4 Ų43.40%024%0.235CC..Hα-helixtrans-64.1-48-179.6-73.6-63.6-78.300112.1E123 F185 A189 F216 T217 K224E123-M220 HydrophobicContact CB-CB 4.08Å; E123-M220 WeakPolarHBondContact OE2-CE 3.36Å; F185-M220 HydrophobicContact CZ-SD 4.31Å; A189-M220 HydrophobicContact CB-CE 3.72Å; A189-M220 HydrophobicContact CB-SD 3.35Å; A189-M220 WeakPolarHBondContact CB-SD 3.36Å; F216-M220 HydrophobicContact CD1-CG 3.97Å; F216-M220 HydrophobicContact CE1-CG 3.56Å; F216-M220 HydrophobicContact CE1-SD 4.28Å; F216-M220 HydrophobicContact CE2-CG 4.39Å; F216-M220 HydrophobicContact CZ-CG 3.78Å; F216-M220 HydrophobicContact CZ-SD 3.99Å; F216-M220 WeakPolarHBondContact O-CB 3.31Å; F216-M220 VanDerWaalsContact O-CG 3.3Å; F216-M220 WeakPolarHBondContact O-CG 3.45Å; F216-M220 PolarHBondContact O-N 3.4Å; T217-M220 PolarHBondContact O-N 3Å; M220-K224 VanDerWaalsContact O-CB 3.27Å; M220-K224 WeakPolarHBondContact O-CB 3.24Å; M220-K224 VanDerWaalsContact O-CG 3.29Å; M220-K224 WeakPolarHBondContact O-CG 3.42Å; M220-K224 PolarHBondContact O-N 2.8Å
221A93.9Very high90.6Very high17 Ų1748.4 Ų48.414%0.1426%0.255CS..Hα-helixtrans-64.3-48.7-178.700000111.5A120 E123 T217 K224 V225A120-A221 HydrophobicContact CB-CB 4.33Å; E123-A221 HydrophobicContact CB-CB 4.44Å; T217-A221 WeakPolarHBondContact O-CB 3.47Å; T217-A221 PolarHBondContact O-N 3.47Å; A221-K224 PolarHBondContact O-N 2.94Å; A221-V225 VanDerWaalsContact O-CB 3.32Å; A221-V225 WeakPolarHBondContact O-CB 3.28Å; A221-V225 WeakPolarHBondContact O-CG2 3.49Å; A221-V225 PolarHBondContact O-N 3.44Å
222T92.1Very high89.8Confident79 Ų7950.1 Ų50.149%0.48527%0.268SS..Hα-helixtrans-61.8-49.1179.5520000111.5A218 F219 K224 V225 I226A218-T222 VanDerWaalsContact O-CB 3.31Å; A218-T222 WeakPolarHBondContact O-CB 3.49Å; A218-T222 WeakPolarHBondContact O-CG2 3.45Å; A218-T222 PolarHBondContact O-N 3.15Å; A218-T222 PolarHBondContact O-OG1 3.07Å; F219-T222 PolarHBondContact O-OG1 2.95Å; F219-T222 VanDerWaalsContact O-OG1 3.12Å; T222-K224 PolarHBondContact O-N 3.34Å; T222-V225 PolarHBondContact O-N 3.08Å; T222-I226 VanDerWaalsContact O-CG1 3.27Å; T222-I226 WeakPolarHBondContact O-CG1 3.19Å; T222-I226 PolarHBondContact O-N 3.12Å
223T91.1Very high88.4Confident21 Ų2158 Ų5813%0.12930%0.304CS..Hα-helixtrans-60.6-46179.4-540000111.1F185 F219 V225 I226 L227 P236F185-T223 HydrophobicContact CE1-CG2 3.76Å; F185-T223 HydrophobicContact CE2-CG2 3.83Å; F185-T223 HydrophobicContact CZ-CG2 3.32Å; F219-T223 VanDerWaalsContact O-CB 3.28Å; F219-T223 WeakPolarHBondContact O-CB 3.22Å; F219-T223 PolarHBondContact O-N 2.97Å; F219-T223 PolarHBondContact O-OG1 3.3Å; T223-V225 PolarHBondContact O-N 2.76Å; T223-I226 PolarHBondContact O-N 2.84Å; T223-L227 HydrophobicContact CG2-CD1 3.99Å; T223-L227 HydrophobicContact CG2-CG 4.35Å; T223-L227 WeakPolarHBondContact O-CB 3.35Å; T223-L227 VanDerWaalsContact O-CG 3.26Å; T223-L227 WeakPolarHBondContact O-CG 3.06Å; T223-L227 PolarHBondContact O-N 2.69Å; T223-P236 HydrophobicContact CG2-CG 3.97Å
224K90.9Very high86.9Confident20 Ų2059.3 Ų59.39%0.08732%0.321CS..Hα-helixtrans-67.8-36.1179.8-75.4-71.3-67173.50113.3V119 E123 F185 P186 M220 A221 T222 T228V119-K224 HydrophobicContact CG1-CB 3.82Å; E123-K224 HydrophobicContact CG-CB 3.85Å; E123-K224 HydrophobicContact CG-CG 3.71Å; E123-K224 WeakPolarHBondContact OE1-CE 3.49Å; F185-K224 HydrophobicContact CD1-CD 3.84Å; F185-K224 HydrophobicContact CD1-CG 4.49Å; F185-K224 HydrophobicContact CE1-CD 3.78Å; F185-K224 HydrophobicContact CE1-CG 3.92Å; P186-K224 HydrophobicContact CG-CD 4.23Å; M220-K224 VanDerWaalsContact O-CB 3.27Å; M220-K224 WeakPolarHBondContact O-CB 3.24Å; M220-K224 VanDerWaalsContact O-CG 3.29Å; M220-K224 WeakPolarHBondContact O-CG 3.42Å; M220-K224 PolarHBondContact O-N 2.8Å; A221-K224 PolarHBondContact O-N 2.94Å; T222-K224 PolarHBondContact O-N 3.34Å; K224-T228 VanDerWaalsContact O-CB 3.28Å; K224-T228 WeakPolarHBondContact O-CB 3.38Å; K224-T228 PolarHBondContact O-N 3.34Å; K224-T228 PolarHBondContact O-OG1 3.1Å
225V91.6Very high85.7Confident40 Ų4059.4 Ų59.424%0.24232%0.322CS..Hα-helixtrans-63.6-46.7174166.10000110.1L116 A120 A221 T222 T223 T228 A229L116-V225 HydrophobicContact CD2-CG1 4.24Å; A120-V225 HydrophobicContact CB-CG2 3.94Å; A221-V225 VanDerWaalsContact O-CB 3.32Å; A221-V225 WeakPolarHBondContact O-CB 3.28Å; A221-V225 WeakPolarHBondContact O-CG2 3.49Å; A221-V225 PolarHBondContact O-N 3.44Å; T222-V225 PolarHBondContact O-N 3.08Å; T223-V225 PolarHBondContact O-N 2.76Å; V225-T228 PolarHBondContact O-N 3.37Å; V225-A229 VanDerWaalsContact O-CB 3.32Å; V225-A229 WeakPolarHBondContact O-CB 3.35Å; V225-A229 PolarHBondContact O-N 2.84Å
226I88.7Confident84.8Confident103 Ų10358.5 Ų58.553%0.52832%0.322SS..Hα-helixtrans-61.3-48.4177.6-67.4165.5000110.9T222 T223 T228 A229 R230T222-I226 VanDerWaalsContact O-CG1 3.27Å; T222-I226 WeakPolarHBondContact O-CG1 3.19Å; T222-I226 PolarHBondContact O-N 3.12Å; T223-I226 PolarHBondContact O-N 2.84Å; I226-T228 VanDerWaalsContact C-N 3.32Å; I226-T228 PolarHBondContact O-N 2.97Å; I226-A229 PolarHBondContact O-N 3.16Å; I226-R230 HydrophobicContact CG2-CG 4.3Å; I226-R230 WeakPolarHBondContact O-CB 3.4Å; I226-R230 WeakPolarHBondContact O-CG 3.19Å; I226-R230 PolarHBondContact O-N 2.81Å
227L87.9Confident83.8Confident26 Ų2659 Ų5914%0.13632%0.324CS..Hα-helixtrans-60.7-41.6178.4-70.6175.8000111.9F185 T223 R230 H231 S232 G234F185-L227 HydrophobicContact CD1-CD1 3.73Å; F185-L227 HydrophobicContact CE1-CD1 4.17Å; F185-L227 HydrophobicContact CG-CD1 4.1Å; T223-L227 HydrophobicContact CG2-CD1 3.99Å; T223-L227 HydrophobicContact CG2-CG 4.35Å; T223-L227 WeakPolarHBondContact O-CB 3.35Å; T223-L227 VanDerWaalsContact O-CG 3.26Å; T223-L227 WeakPolarHBondContact O-CG 3.06Å; T223-L227 PolarHBondContact O-N 2.69Å; L227-R230 PolarHBondContact O-N 3.03Å; L227-H231 PolarHBondContact O-N 3.48Å; L227-H231 VanDerWaalsContact O-N 3.08Å; L227-S232 PolarHBondContact O-N 3.42Å; L227-S232 VanDerWaalsContact O-N 3.13Å; L227-G234 VanDerWaalsContact CD2-O 3.26Å; L227-G234 WeakPolarHBondContact CD2-O 3.47Å
228T88.1Confident82.9Confident17 Ų1762.6 Ų62.610%0.10435%0.346CS..Hα-helixtrans-67.2-39.5177.4-55.50000111.7K115 L116 V119 K224 V225 I226 H231K115-T228 HydrophobicContact CD-CG2 4.46Å; L116-T228 HydrophobicContact CD2-CG2 3.81Å; V119-T228 HydrophobicContact CG2-CG2 4.43Å; K224-T228 VanDerWaalsContact O-CB 3.28Å; K224-T228 WeakPolarHBondContact O-CB 3.38Å; K224-T228 PolarHBondContact O-N 3.34Å; K224-T228 PolarHBondContact O-OG1 3.1Å; V225-T228 PolarHBondContact O-N 3.37Å; I226-T228 VanDerWaalsContact C-N 3.32Å; I226-T228 PolarHBondContact O-N 2.97Å; T228-H231 PolarHBondContact O-N 3.41Å
229A87.7Confident81.9Confident45 Ų4567.1 Ų67.137%0.37236%0.362SS..Hα-helixtrans-70.3-33.7178.200000112.8L116 V225 I226L116-A229 HydrophobicContact CD1-CB 4.46Å; L116-A229 HydrophobicContact CD2-CB 4.23Å; V225-A229 VanDerWaalsContact O-CB 3.32Å; V225-A229 WeakPolarHBondContact O-CB 3.35Å; V225-A229 PolarHBondContact O-N 2.84Å; I226-A229 PolarHBondContact O-N 3.16Å
230R84.1Confident81.1Confident201 Ų20168 Ų6876%0.75837%0.369SS*.Hα-helixtrans-86.8-4.1178.7-67-64.2-171.2-1801.6113.9I226 L227 S232I226-R230 HydrophobicContact CG2-CG 4.3Å; I226-R230 WeakPolarHBondContact O-CB 3.4Å; I226-R230 WeakPolarHBondContact O-CG 3.19Å; I226-R230 PolarHBondContact O-N 2.81Å; L227-R230 PolarHBondContact O-N 3.03Å; R230-S232 PolarHBondContact O-N 3.34Å; R230-S232 VanDerWaalsContact O-N 3.08Å
231H79.1Confident80.2Confident148 Ų14871 Ų7169%0.68538%0.383SS*.THydrogen-bonded Turntrans50.328.8-169.7-66.7-83.6000113.2L227 T228L227-H231 PolarHBondContact O-N 3.48Å; L227-H231 VanDerWaalsContact O-N 3.08Å; T228-H231 PolarHBondContact O-N 3.41Å
232S72.3Confident79.4Confident56 Ų5672.2 Ų72.239%0.39239%0.391SS..  trans-99.6142.9-177.9-179.60000110.5L227 R230 G234L227-S232 PolarHBondContact O-N 3.42Å; L227-S232 VanDerWaalsContact O-N 3.13Å; R230-S232 PolarHBondContact O-N 3.34Å; R230-S232 VanDerWaalsContact O-N 3.08Å; S232-G234 PolarHBondContact OG-N 3.15Å
233H64.1Low78.8Confident180 Ų18075.8 Ų75.883%0.83340%0.395SS*.  trans-105.40.1175.8-67.2-88.6000112.8
234G61Low78.2Confident42 Ų4277.2 Ų77.243%0.43340%0.404SS..  trans-63.8133.9-179.200000112.1L227 S232L227-G234 VanDerWaalsContact CD2-O 3.26Å; L227-G234 WeakPolarHBondContact CD2-O 3.47Å; S232-G234 PolarHBondContact OG-N 3.15Å
235S65.4Low77.5Confident21 Ų2178.2 Ų78.215%0.14741%0.413CS..  trans-86.2135.9176.190.30000110.4F237 V238S235-F237 PolarHBondContact O-N 3.34Å; S235-F237 VanDerWaalsContact O-N 3.13Å; S235-V238 WeakPolarHBondContact O-CG2 3.5Å; S235-V238 PolarHBondContact O-N 3.3Å; S235-V238 WeakPolarHBondContact OG-CG2 3.45Å; S235-V238 PolarHBondContact OG-N 3.38Å
236P72.1Confident77Confident69 Ų6980 Ų8045%0.44842%0.418SS..THydrogen-bonded Turntrans-66-10.8172.630-37.5000112.7F185 T223F185-P236 VanDerWaalsContact CD2-CD 3.45Å; F185-P236 HydrophobicContact CD2-CG 4Å; F185-P236 HydrophobicContact CE2-CG 3.6Å; F185-P236 HydrophobicContact CZ-CG 4.5Å; T223-P236 HydrophobicContact CG2-CG 3.97Å
237F73.4Confident76.6Confident24 Ų2480.2 Ų80.211%0.10542%0.42CS..THydrogen-bonded Turntrans-85.8-6.4-178.5-60.1-59.3000114.1F185 K188 A189 Y192 F219 S235 L239 I240 E241F185-F237 AromaticContact CD2-CD2 3.8Å; F185-F237 HydrophobicContact CD2-CD2 3.8Å; F185-F237 AromaticContact CD2-CE2 3.67Å; F185-F237 HydrophobicContact CD2-CE2 3.67Å; F185-F237 AromaticContact CE2-CD2 3.89Å; F185-F237 HydrophobicContact CE2-CD2 3.89Å; F185-F237 AromaticContact CE2-CE2 3.34Å; F185-F237 HydrophobicContact CE2-CE2 3.34Å; F185-F237 HydrophobicContact CE2-CZ 4.12Å; F185-F237 HydrophobicContact CZ-CE2 4.42Å; K188-F237 HydrophobicContact CB-CD2 4.31Å; A189-F237 HydrophobicContact CB-CE2 3.9Å; A189-F237 HydrophobicContact CB-CZ 4.41Å; Y192-F237 HydrophobicContact CD2-CD2 4.46Å; Y192-F237 HydrophobicContact CD2-CE1 4.28Å; Y192-F237 HydrophobicContact CD2-CE2 4.21Å; Y192-F237 HydrophobicContact CD2-CZ 4.11Å; Y192-F237 HydrophobicContact CE2-CD1 4.22Å; Y192-F237 HydrophobicContact CE2-CD2 4.29Å; Y192-F237 HydrophobicContact CE2-CE1 4.45Å; Y192-F237 HydrophobicContact CE2-CE2 4.48Å; Y192-F237 HydrophobicContact CE2-CG 4.14Å; F219-F237 HydrophobicContact CE1-CE1 4.49Å; F219-F237 HydrophobicContact CE1-CE2 4.48Å; F219-F237 AromaticContact CE1-CZ 3.7Å; F219-F237 HydrophobicContact CE1-CZ 3.7Å; F219-F237 AromaticContact CZ-CE1 3.97Å; F219-F237 HydrophobicContact CZ-CE1 3.97Å; F219-F237 HydrophobicContact CZ-CE2 4.35Å; F219-F237 AromaticContact CZ-CZ 3.5Å; F219-F237 HydrophobicContact CZ-CZ 3.5Å; S235-F237 PolarHBondContact O-N 3.34Å; S235-F237 VanDerWaalsContact O-N 3.13Å; F237-L239 PolarHBondContact O-N 2.89Å; F237-I240 HydrophobicContact CD1-CD1 4.4Å; F237-I240 PolarHBondContact O-N 2.96Å; F237-I240 VanDerWaalsContact O-N 3.08Å; F237-E241 WeakPolarHBondContact O-CB 3.42Å; F237-E241 PolarHBondContact O-N 3.27Å
238V75.9Confident76.2Confident80 Ų8084.6 Ų84.649%0.48544%0.443SS..Hα-helixtrans-54.2-40.7-175.9171.40000112.2S235 E241 S242S235-V238 WeakPolarHBondContact O-CG2 3.5Å; S235-V238 PolarHBondContact O-N 3.3Å; S235-V238 WeakPolarHBondContact OG-CG2 3.45Å; S235-V238 PolarHBondContact OG-N 3.38Å; V238-E241 PolarHBondContact O-N 2.95Å; V238-S242 WeakPolarHBondContact O-CB 3.42Å; V238-S242 PolarHBondContact O-N 3.28Å
239L72.7Confident76Confident147 Ų14791.5 Ų91.577%0.7747%0.472SS*.Hα-helixtrans-66.4-43-180-64.4174.9000112.3F237 W243F237-L239 PolarHBondContact O-N 2.89Å; L239-W243 PolarHBondContact O-N 3.32Å
240I76.2Confident75.2Confident93 Ų9392.3 Ų92.348%0.47749%0.485SS..Hα-helixtrans-67.1-44.7178.8-62.3173.9000109.6F237 W243 V244F237-I240 HydrophobicContact CD1-CD1 4.4Å; F237-I240 PolarHBondContact O-N 2.96Å; F237-I240 VanDerWaalsContact O-N 3.08Å; I240-W243 PolarHBondContact O-N 2.96Å; I240-V244 HydrophobicContact CG2-CG2 4.23Å; I240-V244 VanDerWaalsContact O-CG2 3.29Å; I240-V244 WeakPolarHBondContact O-CG2 3.45Å; I240-V244 PolarHBondContact O-N 3.09Å
241E76.3Confident74.6Confident61 Ų6185.5 Ų85.529%0.28547%0.468SS..Hα-helixtrans-64.5-45.1-179.4-176.3176.8-162.200112K188 F237 V238 W243 V244 C245K188-E241 IonicContact NZ-OE1 2.97Å; K188-E241 PolarHBondContact NZ-OE1 3.12Å; K188-E241 IonicContact NZ-OE2 3.48Å; K188-E241 PolarHBondContact NZ-OE2 3.07Å; F237-E241 WeakPolarHBondContact O-CB 3.42Å; F237-E241 PolarHBondContact O-N 3.27Å; V238-E241 PolarHBondContact O-N 2.95Å; E241-W243 PolarHBondContact O-N 3.29Å; E241-V244 PolarHBondContact O-N 3.39Å; E241-C245 WeakPolarHBondContact O-CB 3.41Å; E241-C245 PolarHBondContact O-N 2.92Å; E241-C245 PolarHBondContact O-SG 3.13Å
242S76.9Confident73.6Confident43 Ų4383.5 Ų83.530%0.30147%0.468SS..Hα-helixtrans-58.2-40.3175.8179.40000111.4V238 H246V238-S242 WeakPolarHBondContact O-CB 3.42Å; V238-S242 PolarHBondContact O-N 3.28Å; S242-H246 VanDerWaalsContact O-CB 3.31Å; S242-H246 WeakPolarHBondContact O-CB 3.36Å; S242-H246 PolarHBondContact O-N 3.43Å
243W79.9Confident72.5Confident155 Ų15585.9 Ų85.959%0.58748%0.476SS*.Hα-helixtrans-69-45177.3-166.777.7000112.8L239 I240 E241 H246 L247L239-W243 PolarHBondContact O-N 3.32Å; I240-W243 PolarHBondContact O-N 2.96Å; E241-W243 PolarHBondContact O-N 3.29Å; W243-H246 PolarHBondContact O-N 3.17Å; W243-L247 HydrophobicContact CH2-CD2 3.91Å; W243-L247 HydrophobicContact CZ2-CD2 4.47Å; W243-L247 HydrophobicContact CZ3-CD2 3.96Å; W243-L247 WeakPolarHBondContact O-CB 3.44Å; W243-L247 PolarHBondContact O-N 2.99Å
244V77.9Confident71.7Confident51 Ų5180.2 Ų80.231%0.30947%0.466SS..Hα-helixtrans-65.4-43.3177.3172.20000111.2I240 E241 H246 L247 L248I240-V244 HydrophobicContact CG2-CG2 4.23Å; I240-V244 VanDerWaalsContact O-CG2 3.29Å; I240-V244 WeakPolarHBondContact O-CG2 3.45Å; I240-V244 PolarHBondContact O-N 3.09Å; E241-V244 PolarHBondContact O-N 3.39Å; V244-H246 VanDerWaalsContact C-N 3.31Å; V244-H246 PolarHBondContact O-N 3.3Å; V244-L247 PolarHBondContact O-N 3.23Å; V244-L248 HydrophobicContact CG1-CD1 3.67Å; V244-L248 HydrophobicContact CG1-CG 4.26Å; V244-L248 WeakPolarHBondContact O-CB 3.4Å; V244-L248 PolarHBondContact O-N 3.15Å
245C76.4Confident70.7Confident40 Ų4082.1 Ų82.127%0.2749%0.486SS..Hα-helixtrans-64.3-37.2177.5-72.60000111.9E241 F249 G250 S251E241-C245 WeakPolarHBondContact O-CB 3.41Å; E241-C245 PolarHBondContact O-N 2.92Å; E241-C245 PolarHBondContact O-SG 3.13Å; C245-F249 CarbonylContact O-C 3.32Å; C245-F249 VanDerWaalsContact O-CA 3.32Å; C245-F249 WeakPolarHBondContact O-CA 3.36Å; C245-F249 WeakPolarHBondContact O-CB 3.42Å; C245-F249 PolarHBondContact O-N 3.01Å; C245-G250 PolarHBondContact O-N 3.37Å; C245-G250 VanDerWaalsContact O-N 3.11Å; C245-S251 PolarHBondContact O-N 3.31Å
246H80.4Confident69.2Low77 Ų7783.9 Ų83.936%0.35651%0.508SS..Hα-helixtrans-66.5-48.4171.7-177.3-76.9000111.8S242 W243 V244 G250 S251 L253S242-H246 VanDerWaalsContact O-CB 3.31Å; S242-H246 WeakPolarHBondContact O-CB 3.36Å; S242-H246 PolarHBondContact O-N 3.43Å; W243-H246 PolarHBondContact O-N 3.17Å; V244-H246 VanDerWaalsContact C-N 3.31Å; V244-H246 PolarHBondContact O-N 3.3Å; H246-G250 VanDerWaalsContact O-CA 3.29Å; H246-G250 WeakPolarHBondContact O-CA 3.28Å; H246-G250 PolarHBondContact O-N 3.41Å; H246-S251 VanDerWaalsContact CA-O 3.28Å; H246-S251 WeakPolarHBondContact CA-O 3.49Å; H246-S251 VanDerWaalsContact CB-O 3.26Å; H246-S251 WeakPolarHBondContact CB-O 3.48Å; H246-S251 PolarHBondContact CD2-O 3.19Å; H246-L253 HydrophobicContact CB-CD1 4.04Å; H246-L253 HydrophobicContact CB-CG 3.77Å; H246-L253 WeakPolarHBondContact CD2-CD1 3.49Å; H246-L253 WeakPolarHBondContact CD2-CG 3.24Å; H246-L253 PolarHBondContact CD2-N 3.21Å; H246-L253 VanDerWaalsContact CG-CD1 3.43Å
247L81.1Confident67.8Low108 Ų10890.3 Ų90.357%0.56553%0.531SS*.Hα-helixtrans-67.6-42.3-174.7-172.469.7000113.1W243 V244W243-L247 HydrophobicContact CH2-CD2 3.91Å; W243-L247 HydrophobicContact CZ2-CD2 4.47Å; W243-L247 HydrophobicContact CZ3-CD2 3.96Å; W243-L247 WeakPolarHBondContact O-CB 3.44Å; W243-L247 PolarHBondContact O-N 2.99Å; V244-L247 PolarHBondContact O-N 3.23Å
248L80.1Confident66Low119 Ų11997.9 Ų97.962%0.62357%0.567SS**Hα-helixtrans-95.4-32.6-173.9-63.6-178.6000113.5V244V244-L248 HydrophobicContact CG1-CD1 3.67Å; V244-L248 HydrophobicContact CG1-CG 4.26Å; V244-L248 WeakPolarHBondContact O-CB 3.4Å; V244-L248 PolarHBondContact O-N 3.15Å
249F83.4Confident63.9Low161 Ų161102.2 Ų102.271%0.70658%0.582SS**Hα-helixtrans-120.21.9-172.2-55.1-68.2000113.5C245 S251C245-F249 CarbonylContact O-C 3.32Å; C245-F249 VanDerWaalsContact O-CA 3.32Å; C245-F249 WeakPolarHBondContact O-CA 3.36Å; C245-F249 WeakPolarHBondContact O-CB 3.42Å; C245-F249 PolarHBondContact O-N 3.01Å; F249-S251 VanDerWaalsContact C-N 3.27Å; F249-S251 PolarHBondContact O-N 2.89Å
250G71.4Confident62Low62 Ų62104.2 Ų104.264%0.63959%0.587SS**  trans68.819.7174.400000114.9C245 H246C245-G250 PolarHBondContact O-N 3.37Å; C245-G250 VanDerWaalsContact O-N 3.11Å; H246-G250 VanDerWaalsContact O-CA 3.29Å; H246-G250 WeakPolarHBondContact O-CA 3.28Å; H246-G250 PolarHBondContact O-N 3.41Å
251S69.9Low59.9Low59 Ų59108.1 Ų108.141%0.41360%0.603SS.*  trans-68.9136.4176.8-174.20000110.8C245 H246 F249 L253C245-S251 PolarHBondContact O-N 3.31Å; H246-S251 VanDerWaalsContact CA-O 3.28Å; H246-S251 WeakPolarHBondContact CA-O 3.49Å; H246-S251 VanDerWaalsContact CB-O 3.26Å; H246-S251 WeakPolarHBondContact CB-O 3.48Å; H246-S251 PolarHBondContact CD2-O 3.19Å; F249-S251 VanDerWaalsContact C-N 3.27Å; F249-S251 PolarHBondContact O-N 2.89Å; S251-L253 PolarHBondContact O-N 3.12Å
252P59.7Low57.7Low106 Ų106109.8 Ų109.869%0.68863%0.627SS**  trans-59.7135.1-17921.1-30.4000112.5G254P252-G254 PolarHBondContact O-N 3.03Å
253L48.6Very low55.5Low105 Ų105113 Ų11355%0.5566%0.656SS.*SBendtrans-74.487.8178.2-99155.9000108.5H246 S251H246-L253 HydrophobicContact CB-CD1 4.04Å; H246-L253 HydrophobicContact CB-CG 3.77Å; H246-L253 WeakPolarHBondContact CD2-CD1 3.49Å; H246-L253 WeakPolarHBondContact CD2-CG 3.24Å; H246-L253 PolarHBondContact CD2-N 3.21Å; H246-L253 VanDerWaalsContact CG-CD1 3.43Å; S251-L253 PolarHBondContact O-N 3.12Å
254G46.3Very low53.2Low61 Ų61111 Ų11163%0.62967%0.666SS**  trans145.380.317500000112.7P252 G256P252-G254 PolarHBondContact O-N 3.03Å; G254-G256 VanDerWaalsContact C-N 3.3Å; G254-G256 PolarHBondContact O-N 2.9Å
255G40.3Very low50.9Low82 Ų82113 Ų11385%0.84569%0.688SS**  trans-93.367.3156.600000108.8
256G35.3Very low49.4Very low59 Ų59117.2 Ų117.261%0.60872%0.715SS**  trans-61.4139.9156.800000107.5G254 E258G254-G256 VanDerWaalsContact C-N 3.3Å; G254-G256 PolarHBondContact O-N 2.9Å; G256-E258 PolarHBondContact O-N 3.04Å
257E41.8Very low47.1Very low203 Ų203118.1 Ų118.195%0.94974%0.736SS**  trans-60.384.5166.1-66.8173.4147.600108.1E259E257-E259 PolarHBondContact O-N 3.49Å
258E35.2Very low45Very low183 Ų183118.3 Ų118.386%0.85574%0.744SS**  trans-79.2101.4163.3-77.9-168.7169.500107.5G256 H260G256-E258 PolarHBondContact O-N 3.04Å; E258-H260 PolarHBondContact O-N 2.78Å
259E33Very low42.7Very low171 Ų171119.6 Ų119.680%0.79976%0.756SS**  trans-9.3108.1154.7-63.7178.3144.600114E257 H261E257-E259 PolarHBondContact O-N 3.49Å; E259-H261 PolarHBondContact O-N 2.62Å
260H32.7Very low40.3Very low190 Ų190115.7 Ų115.788%0.8875%0.753SS**SBendtrans-6871157.2-90.8-78.5000109.8E258E258-H260 PolarHBondContact O-N 2.78Å
261H32Very low38.8Very low174 Ų174118.2 Ų118.281%0.80676%0.758SS**  trans-142.6135.1163.3-77.2-55.2000110.6E259E259-H261 PolarHBondContact O-N 2.62Å
262A29.2Very low36.9Very low96 Ų96122 Ų12279%0.79378%0.779SS**  trans81.569.3175.700000117.1S264A262-S264 PolarHBondContact O-N 2.91Å; A262-S264 VanDerWaalsContact O-N 3.17Å
263A30.1Very low35.4Very low110 Ų110122.1 Ų122.191%0.90978%0.782SS**  trans-66.2104.6141.200000108.1
264S31.5Very low35.1Very low113 Ų113122.5 Ų122.579%0.7979%0.791SS**PPolyproline II helixtrans-64.8135.9172.947.90000111.3A262A262-S264 PolarHBondContact O-N 2.91Å; A262-S264 VanDerWaalsContact O-N 3.17Å
265A30.7Very low34.2Very low94 Ų94125.2 Ų125.278%0.77780%0.795SS**PPolyproline II helixtrans-61.6171.1-175.900000115.3
266P45.8Very low33.6Very low129 Ų129130.2 Ų130.284%0.83879%0.793SS**PPolyproline II helixtrans-100169.7-154.439.8-34.2000114.7
267A31.3Very low33.1Very low96 Ų96133.7 Ų133.779%0.79380%0.803SS**  trans-155.3164.1169.100000111.6
268P37.8Very low32.4Very low112 Ų112132.2 Ų132.273%0.72779%0.793SS**  -128.2160.4-109.820.14.7000117.3
269V31.8Very low32.1Very low145 Ų145130.8 Ų130.888%0.87979%0.787SS**  trans57.8137135.8177.60000118.6
270A32.6Very low31.7Very low79 Ų79131.7 Ų131.765%0.65379%0.791SS**  cis-177.6-150.63.900000108.5
271P40.1Very low31.5Very low115 Ų115132.8 Ų132.875%0.74779%0.794SS**  -118.2178.3-71.932.2-15.4000113.3
272V29.2Very low31.2Very low140 Ų140127.8 Ų127.885%0.84879%0.789SS**  trans164.8131.2135.3162.90000111.2
273S28.4Very low31Very low107 Ų107132.2 Ų132.275%0.74879%0.794SS**  trans-90.8-163.2-176.4-36.20000113
274P42.6Very low30.9Very low114 Ų114130.8 Ų130.874%0.7479%0.789SS**  -124.1-174.2-58.328.1-7000112.2
275V26.8Very low30.8Very low117 Ų117130.7 Ų130.771%0.70978%0.784SS**  trans142.6131.2137.4171.80000116.6
276K27.3Very low30.9Very low187 Ų187138.2 Ų138.281%0.81379%0.792SS**  trans95.693150.5-87.3162.6-164.2-178.30123.7
277T24.6Very low30.3Very low132 Ų132141.3 Ų141.381%0.8179%0.793SS**  31.9126.2113.1-27.10000123.9
278K27.8Very low30.3Very low172 Ų172148.4 Ų148.475%0.74880%0.799SS**  154.4140.6130-95.3-170160.7-1540108.2
279E27.8Very low30Very low154 Ų154152.5 Ų152.572%0.7281%0.805SS**  cis-164.2141.922.2-124.9160.6-165.200108.3
280E26.5Very low30.1Very low189 Ų189151.7 Ų151.788%0.88381%0.806SS**  trans-80.9148.7168.9-73.1176.613700111.2
281F26.6Very low30Very low214 Ų214157.2 Ų157.294%0.93982%0.815SS**  trans-149.2108.7146.8-140.6-92.8000112.3
282G26.7Very low29.4Very low69 Ų69161.4 Ų161.471%0.71182%0.822SS**  93.792.9123.700000119.5
283E25.6Very low29.4Very low189 Ų189159.3 Ų159.388%0.88382%0.819SS**  trans-54.6154.7159.3-77.6179.6115.700114.9
284G27.5Very low29.5Very low79 Ų79166.9 Ų166.981%0.81484%0.843SS**  trans-154.758.6168.900000113.4
285T30.5Very low28.8Very low112 Ų112169.6 Ų169.669%0.68785%0.848SS**  trans-76.5120.5176.2-54.50000111.6K287T285-K287 HydrophobicContact CG2-CG 4.47Å
286R31.9Very low28.9Very low252 Ų252172.3 Ų172.395%0.95186%0.855SS**  trans-99.2100.3167-129.7178.5-173.3-1802.5110.1
287K33.1Very low29Very low194 Ų194171.5 Ų171.584%0.84386%0.857SS**  trans-67.1135.2172.6-74179.3175.5175.70111.6T285T285-K287 HydrophobicContact CG2-CG 4.47Å
288R32Very low29.3Very low245 Ų245173.8 Ų173.893%0.92586%0.86SS**  trans-104.7117.7160.2-163.1173.6177.7178.2-1.6108.3
289K31.1Very low29.4Very low198 Ų198173.9 Ų173.986%0.86187%0.867SS**  trans-65.2143.9175.3-77.9178.2173.9176.60110.9
290S32.4Very low29.5Very low127 Ų127175.3 Ų175.389%0.88888%0.877SS**  trans-146.9150.4150-73.40000108.8
291K30.6Very low29.7Very low196 Ų196174.3 Ų174.385%0.85288%0.877SS**  trans-120.9156.3-151.8-165.6-175.2-173.3-178.30109.3
292K28Very low29.9Very low203 Ų203171.2 Ų171.288%0.88387%0.872SS**  trans74.1146.6170.7-80.5-178.8164.5-173.90115.8
293A30.5Very low30.2Very low96 Ų96179.8 Ų179.879%0.79389%0.885SS**  cis-142.9162.9-0.800000105.2
294E29.2Very low30.6Very low266 Ų266178.9 Ų178.9100%1.24389%0.886SS**  cis-163.8044.5-166.5173.3172.500107.2

Retrieved 294 of 294 residues in 838.9 ms (Link to these results)

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