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14-3-3 protein zeta

Adapter protein implicated in the regulation of a large spectrum of both general and specialized signaling pathways. Binds to a large number of partners, usually by recognition of a phosphoserine or phosphothreonine motif. Binding generally results in the modulation of the activity of the binding partner.

AlphaFold DB , UniProt , Accession Q5ZKC9, Species CHICK (Gallus gallus, Chicken), Gene YWHAZ, Length 245 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
1M70.7Confident94.6Very high129 Ų12966.2 Ų66.264%0.63532%0.32SS*.  0138.10-162173.7-56.100106.4E5 L6 K9M1-E5 HydrophobicContact CG-CB 3.72Å; M1-E5 WeakPolarHBondContact CG-OE2 3.08Å; M1-E5 HydrophobicContact SD-CB 4.24Å; M1-L6 HydrophobicContact CB-CD1 4.33Å; M1-L6 HydrophobicContact CB-CD2 4.13Å; M1-L6 HydrophobicContact CB-CG 3.98Å; M1-L6 HydrophobicContact CE-CD2 4.38Å; M1-L6 HydrophobicContact CG-CD2 4.17Å; M1-L6 HydrophobicContact CG-CG 3.99Å; M1-L6 HydrophobicContact SD-CD2 3.5Å; M1-L6 WeakPolarHBondContact SD-CD2 3.21Å; M1-L6 HydrophobicContact SD-CG 3.87Å; M1-K9 HydrophobicContact CE-CD 4.4Å; M1-K9 HydrophobicContact SD-CD 3.69Å; M1-K9 PolarHBondContact SD-NZ 3.46Å
2D92.3Very high94.9Very high83 Ų8369.9 Ų69.944%0.44434%0.342SS..  trans-65.9152.1178.6179.839.8000110.7N4 E5 L6D2-N4 PolarHBondContact O-N 3.15Å; D2-N4 WeakPolarHBondContact OD2-CB 3.4Å; D2-N4 PolarHBondContact OD2-N 3.16Å; D2-N4 PolarHBondContact OD2-ND2 2.95Å; D2-E5 HydrophobicContact CB-CB 4.48Å; D2-E5 HydrophobicContact CB-CG 4.17Å; D2-E5 PolarHBondContact N-OE2 3.21Å; D2-E5 PolarHBondContact O-N 3.4Å; D2-L6 PolarHBondContact O-N 3.26Å; D2-L6 VanDerWaalsContact O-N 3.09Å
3K95.3Very high95.2Very high39 Ų3965.2 Ų65.217%0.1732%0.321CS..Hα-helixtrans-53.9-44.6177.3-166.4-172.9-178.5-161.70110.9E5 L6 V7 V29 E40K3-E5 PolarHBondContact O-N 3.16Å; K3-L6 PolarHBondContact O-N 2.63Å; K3-V7 WeakPolarHBondContact O-CG2 3.44Å; K3-V7 PolarHBondContact O-N 3.01Å; K3-V29 HydrophobicContact CD-CG1 4.42Å; K3-V29 HydrophobicContact CG-CG1 3.93Å; K3-V29 HydrophobicContact CG-CG2 4.43Å; K3-E40 VanDerWaalsContact CE-CD 3.43Å; K3-E40 WeakPolarHBondContact CE-OE1 3.5Å; K3-E40 WeakPolarHBondContact CE-OE2 3.33Å; K3-E40 IonicContact NZ-OE1 2.75Å; K3-E40 PolarHBondContact NZ-OE1 3.33Å; K3-E40 IonicContact NZ-OE2 3.84Å; K3-E40 PolarHBondContact NZ-OE2 3.07Å
4N95.8Very high95.4Very high103 Ų10365.6 Ų65.655%0.55132%0.322SS*.Hα-helixtrans-65-42-178.5-59.9-56000111.7D2 L6 V7 Q8D2-N4 PolarHBondContact O-N 3.15Å; D2-N4 WeakPolarHBondContact OD2-CB 3.4Å; D2-N4 PolarHBondContact OD2-N 3.16Å; D2-N4 PolarHBondContact OD2-ND2 2.95Å; N4-L6 VanDerWaalsContact C-N 3.32Å; N4-L6 PolarHBondContact O-N 2.97Å; N4-V7 PolarHBondContact O-N 3.48Å; N4-Q8 VanDerWaalsContact O-CG 3.27Å; N4-Q8 WeakPolarHBondContact O-CG 3.41Å; N4-Q8 PolarHBondContact O-N 3.44Å
5E97.1Very high95.5Very high106 Ų10671.8 Ų71.850%0.49535%0.349SS..Hα-helixtrans-61-41.6176.2-70178.7159.400111.8M1 D2 K3 Q8 K9M1-E5 HydrophobicContact CG-CB 3.72Å; M1-E5 WeakPolarHBondContact CG-OE2 3.08Å; M1-E5 HydrophobicContact SD-CB 4.24Å; D2-E5 HydrophobicContact CB-CB 4.48Å; D2-E5 HydrophobicContact CB-CG 4.17Å; D2-E5 PolarHBondContact N-OE2 3.21Å; D2-E5 PolarHBondContact O-N 3.4Å; K3-E5 PolarHBondContact O-N 3.16Å; E5-Q8 PolarHBondContact O-N 3.14Å; E5-K9 WeakPolarHBondContact O-CG 3.46Å; E5-K9 PolarHBondContact O-N 2.97Å
6L97.9Very high95.7Very high12 Ų1271.3 Ų71.36%0.06336%0.36CS..Hα-helixtrans-65.3-43.6176.7-71.5165.7000112M1 D2 K3 N4 K9 A10 C25 V29M1-L6 HydrophobicContact CB-CD1 4.33Å; M1-L6 HydrophobicContact CB-CD2 4.13Å; M1-L6 HydrophobicContact CB-CG 3.98Å; M1-L6 HydrophobicContact CE-CD2 4.38Å; M1-L6 HydrophobicContact CG-CD2 4.17Å; M1-L6 HydrophobicContact CG-CG 3.99Å; M1-L6 HydrophobicContact SD-CD2 3.5Å; M1-L6 WeakPolarHBondContact SD-CD2 3.21Å; M1-L6 HydrophobicContact SD-CG 3.87Å; D2-L6 PolarHBondContact O-N 3.26Å; D2-L6 VanDerWaalsContact O-N 3.09Å; K3-L6 PolarHBondContact O-N 2.63Å; N4-L6 VanDerWaalsContact C-N 3.32Å; N4-L6 PolarHBondContact O-N 2.97Å; L6-K9 PolarHBondContact O-N 3.27Å; L6-A10 PolarHBondContact O-N 2.9Å; L6-C25 HydrophobicContact CD2-CB 4.47Å; L6-V29 HydrophobicContact CB-CG2 3.45Å; L6-V29 VanDerWaalsContact CB-CG2 3.45Å; L6-V29 HydrophobicContact CD1-CG2 4.03Å; L6-V29 HydrophobicContact CG-CG2 4.38Å
7V98.2Very high95.8Very high8 Ų875.7 Ų75.75%0.04838%0.379CS..Hα-helixtrans-63.4-41.7176.71720000111K3 N4 K9 A10 K11 V29 E40 L43K3-V7 WeakPolarHBondContact O-CG2 3.44Å; K3-V7 PolarHBondContact O-N 3.01Å; N4-V7 PolarHBondContact O-N 3.48Å; V7-K9 VanDerWaalsContact C-N 3.35Å; V7-K9 PolarHBondContact O-N 3.31Å; V7-A10 WeakPolarHBondContact O-CB 3.41Å; V7-A10 PolarHBondContact O-N 3Å; V7-K11 HydrophobicContact CG1-CD 4.44Å; V7-K11 WeakPolarHBondContact O-CG 3.27Å; V7-K11 PolarHBondContact O-N 3.21Å; V7-V29 HydrophobicContact CG2-CG1 4.36Å; V7-V29 HydrophobicContact CG2-CG2 3.94Å; V7-E40 HydrophobicContact CG2-CG 4.01Å; V7-L43 HydrophobicContact CG1-CD1 3.92Å
8Q98Very high95.9Very high107 Ų10779.6 Ų79.650%0.539%0.389SS..Hα-helixtrans-64.2-39.4175.5-68.2-59.4-29.400112N4 E5 K11 L12N4-Q8 VanDerWaalsContact O-CG 3.27Å; N4-Q8 WeakPolarHBondContact O-CG 3.41Å; N4-Q8 PolarHBondContact O-N 3.44Å; E5-Q8 PolarHBondContact O-N 3.14Å; Q8-K11 PolarHBondContact O-N 3.32Å; Q8-L12 WeakPolarHBondContact O-CG 3.35Å; Q8-L12 PolarHBondContact O-N 2.93Å
9K98.1Very high96Very high100 Ų10078.2 Ų78.244%0.43538%0.379SS..Hα-helixtrans-64-40.1172.9-74.8-179.5-177.6-177.80112.5M1 E5 L6 V7 K11 L12 A13M1-K9 HydrophobicContact CE-CD 4.4Å; M1-K9 HydrophobicContact SD-CD 3.69Å; M1-K9 PolarHBondContact SD-NZ 3.46Å; E5-K9 WeakPolarHBondContact O-CG 3.46Å; E5-K9 PolarHBondContact O-N 2.97Å; L6-K9 PolarHBondContact O-N 3.27Å; V7-K9 VanDerWaalsContact C-N 3.35Å; V7-K9 PolarHBondContact O-N 3.31Å; K9-K11 VanDerWaalsContact C-N 3.34Å; K9-K11 PolarHBondContact O-N 3.44Å; K9-L12 PolarHBondContact O-N 3.26Å; K9-A13 WeakPolarHBondContact O-CB 3.36Å; K9-A13 PolarHBondContact O-N 3.24Å
10A98.4Very high96.1Very high0 Ų078 Ų780%038%0.38CS..Hα-helixtrans-61-42.6174.900000111.6L6 V7 A13 E14 M22 C25 M26L6-A10 PolarHBondContact O-N 2.9Å; V7-A10 WeakPolarHBondContact O-CB 3.41Å; V7-A10 PolarHBondContact O-N 3Å; A10-A13 PolarHBondContact O-N 3.48Å; A10-E14 WeakPolarHBondContact O-CB 3.09Å; A10-E14 PolarHBondContact O-N 3.45Å; A10-M22 HydrophobicContact CB-CG 4.03Å; A10-C25 HydrophobicContact CB-CB 4.01Å; A10-M26 HydrophobicContact CB-CG 3.81Å; A10-M26 HydrophobicContact CB-SD 3.63Å
11K98.4Very high96.2Very high41 Ų4177.1 Ų77.118%0.17838%0.377CS..Hα-helixtrans-63.7-40.5175.1-69.8175.6178.4-176.10112.9V7 Q8 K9 E14 Q15 E39 L43V7-K11 HydrophobicContact CG1-CD 4.44Å; V7-K11 WeakPolarHBondContact O-CG 3.27Å; V7-K11 PolarHBondContact O-N 3.21Å; Q8-K11 PolarHBondContact O-N 3.32Å; K9-K11 VanDerWaalsContact C-N 3.34Å; K9-K11 PolarHBondContact O-N 3.44Å; K11-E14 PolarHBondContact O-N 3.32Å; K11-Q15 WeakPolarHBondContact O-CG 3.47Å; K11-Q15 PolarHBondContact O-N 3.4Å; K11-Q15 VanDerWaalsContact O-N 3.14Å; K11-E39 WeakPolarHBondContact CE-OE1 3.5Å; K11-E39 IonicContact NZ-OE1 3.65Å; K11-E39 PolarHBondContact NZ-OE1 3.43Å; K11-E39 IonicContact NZ-OE2 3.72Å; K11-E39 PolarHBondContact NZ-OE2 3.07Å; K11-L43 HydrophobicContact CG-CD1 4.05Å; K11-L43 HydrophobicContact CG-CD2 4.15Å
12L98.4Very high97.5Very high111 Ų11171 Ų7158%0.58135%0.347SS*.Hα-helixtrans-64.8-40.8173.5-70.6171.5000111.7Q8 K9 Q15 A16Q8-L12 WeakPolarHBondContact O-CG 3.35Å; Q8-L12 PolarHBondContact O-N 2.93Å; K9-L12 PolarHBondContact O-N 3.26Å; L12-Q15 PolarHBondContact O-N 3.39Å; L12-A16 WeakPolarHBondContact O-CB 3.48Å; L12-A16 PolarHBondContact O-N 2.64Å; L12-A16 VanDerWaalsContact O-N 3.15Å
13A98.4Very high97.8Very high8 Ų867.3 Ų67.37%0.06633%0.328CS..Hα-helixtrans-65.3-39.1176.600000111.9K9 A10 A16 E17 R18 D21 M22K9-A13 WeakPolarHBondContact O-CB 3.36Å; K9-A13 PolarHBondContact O-N 3.24Å; A10-A13 PolarHBondContact O-N 3.48Å; A13-A16 CarbonylContact O-C 3.51Å; A13-A16 PolarHBondContact O-N 3.18Å; A13-E17 PolarHBondContact O-N 3.15Å; A13-R18 HydrophobicContact CB-CB 4.3Å; A13-R18 PolarHBondContact O-N 3.19Å; A13-D21 HydrophobicContact CB-CB 3.99Å; A13-M22 HydrophobicContact CB-CB 4Å
14E98.1Very high98Very high72 Ų7269 Ų6934%0.33635%0.345SS..Hα-helixtrans-59.2-48.9173.9-177.9-179.9-151.700111.6A10 K11 A16 E17 M22 L43A10-E14 WeakPolarHBondContact O-CB 3.09Å; A10-E14 PolarHBondContact O-N 3.45Å; K11-E14 PolarHBondContact O-N 3.32Å; E14-A16 PolarHBondContact O-N 3.01Å; E14-E17 PolarHBondContact O-N 3.44Å; E14-M22 HydrophobicContact CB-CE 3.96Å; E14-M22 HydrophobicContact CB-SD 3.95Å; E14-M22 HydrophobicContact CG-CE 4.18Å; E14-M22 HydrophobicContact CG-SD 4.37Å; E14-L43 WeakPolarHBondContact OE2-CD2 3.47Å
15Q97.6Very high98.1Very high158 Ų15865 Ų6574%0.73833%0.325SS*.Hα-helixtrans-62.7-26.1177.5-69.61773300113.2K11 L12K11-Q15 WeakPolarHBondContact O-CG 3.47Å; K11-Q15 PolarHBondContact O-N 3.4Å; K11-Q15 VanDerWaalsContact O-N 3.14Å; L12-Q15 PolarHBondContact O-N 3.39Å
16A97.9Very high98.2Very high63 Ų6360 Ų6052%0.52130%0.301SS..THydrogen-bonded Turntrans-94.96.2176.400000113.1L12 A13 E14 R18L12-A16 WeakPolarHBondContact O-CB 3.48Å; L12-A16 PolarHBondContact O-N 2.64Å; L12-A16 VanDerWaalsContact O-N 3.15Å; A13-A16 CarbonylContact O-C 3.51Å; A13-A16 PolarHBondContact O-N 3.18Å; E14-A16 PolarHBondContact O-N 3.01Å; A16-R18 HydrophobicContact CB-CG 4.12Å; A16-R18 PolarHBondContact O-N 3.44Å; A16-R18 VanDerWaalsContact O-N 3.1Å
17E97.6Very high98.2Very high147 Ų14761.9 Ų61.969%0.68731%0.309SS*.THydrogen-bonded Turntrans53.727.2-175.9-57-175.9165.800113.8A13 E14 Y19A13-E17 PolarHBondContact O-N 3.15Å; E14-E17 PolarHBondContact O-N 3.44Å; E17-Y19 HydrophobicContact CB-CE2 3.98Å; E17-Y19 WeakPolarHBondContact O-CD2 3.35Å; E17-Y19 PolarHBondContact O-N 3.23Å
18R98.3Very high98.2Very high145 Ų14564 Ų6455%0.54732%0.324SS..  trans-91.167.8177.8-66.8-162.162.6176.4-12110.8A13 A16 D20 D21 M22A13-R18 HydrophobicContact CB-CB 4.3Å; A13-R18 PolarHBondContact O-N 3.19Å; A16-R18 HydrophobicContact CB-CG 4.12Å; A16-R18 PolarHBondContact O-N 3.44Å; A16-R18 VanDerWaalsContact O-N 3.1Å; R18-D20 VanDerWaalsContact C-N 3.31Å; R18-D20 PolarHBondContact O-N 3.07Å; R18-D21 HydrophobicContact CB-CB 4.2Å; R18-D21 IonicContact CZ-OD1 3.61Å; R18-D21 IonicContact CZ-OD2 3.12Å; R18-D21 IonicContact NE-OD1 3.16Å; R18-D21 IonicContact NE-OD2 2.82Å; R18-D21 PolarHBondContact NE-OD2 3.38Å; R18-D21 IonicContact NH1-OD2 3.36Å; R18-D21 VanDerWaalsContact NH2-CG 3.3Å; R18-D21 IonicContact NH2-OD1 3.65Å; R18-D21 PolarHBondContact NH2-OD1 2.89Å; R18-D21 IonicContact NH2-OD2 3.56Å; R18-D21 PolarHBondContact NH2-OD2 3.3Å; R18-D21 WeakPolarHBondContact O-CB 3.35Å; R18-D21 PolarHBondContact O-N 3.07Å; R18-D21 VanDerWaalsContact O-N 3.1Å; R18-M22 PolarHBondContact O-N 3.01Å
19Y98.4Very high98.2Very high54 Ų5458.9 Ų58.921%0.21230%0.301CS..Hα-helixtrans-65.8-27.7-171.8-56.7-68.2000114.6E17 M22 A23 V46 N50 V51E17-Y19 HydrophobicContact CB-CE2 3.98Å; E17-Y19 WeakPolarHBondContact O-CD2 3.35Å; E17-Y19 PolarHBondContact O-N 3.23Å; Y19-M22 HydrophobicContact CD1-SD 4.03Å; Y19-M22 WeakPolarHBondContact O-CB 3.34Å; Y19-M22 PolarHBondContact O-N 2.68Å; Y19-A23 WeakPolarHBondContact O-CB 3.4Å; Y19-A23 PolarHBondContact O-N 3.24Å; Y19-V46 HydrophobicContact CE1-CG1 4.33Å; Y19-N50 HydrophobicContact CD1-CB 3.65Å; Y19-N50 HydrophobicContact CD2-CB 3.38Å; Y19-N50 HydrophobicContact CE1-CB 3.99Å; Y19-N50 WeakPolarHBondContact CE1-ND2 3.36Å; Y19-N50 HydrophobicContact CE2-CB 3.7Å; Y19-N50 HydrophobicContact CG-CB 3.32Å; Y19-V51 VanDerWaalsContact C-CG2 3.43Å; Y19-V51 WeakPolarHBondContact O-CG2 3.25Å
20D97.9Very high98.2Very high74 Ų7454.2 Ų54.240%0.39628%0.28SS..Hα-helixtrans-65.8-38173.1-60-92.6000111.6R18 S24 R55R18-D20 VanDerWaalsContact C-N 3.31Å; R18-D20 PolarHBondContact O-N 3.07Å; D20-S24 WeakPolarHBondContact O-CB 3.33Å; D20-S24 PolarHBondContact O-N 3.27Å; D20-S24 PolarHBondContact O-OG 3.49Å; D20-R55 IonicContact OD1-CZ 3.33Å; D20-R55 IonicContact OD1-NH1 2.69Å; D20-R55 PolarHBondContact OD1-NH1 3.47Å; D20-R55 IonicContact OD1-NH2 2.62Å; D20-R55 PolarHBondContact OD1-NH2 2.61Å; D20-R55 VanDerWaalsContact OD1-NH2 3.12Å; D20-R55 IonicContact OD2-NH1 2.89Å
21D98.2Very high98.2Very high59 Ų5958.5 Ų58.532%0.31630%0.3SS..Hα-helixtrans-68.7-40.8174.3-64.35.6000110.6A13 R18 S24 C25A13-D21 HydrophobicContact CB-CB 3.99Å; R18-D21 HydrophobicContact CB-CB 4.2Å; R18-D21 IonicContact CZ-OD1 3.61Å; R18-D21 IonicContact CZ-OD2 3.12Å; R18-D21 IonicContact NE-OD1 3.16Å; R18-D21 IonicContact NE-OD2 2.82Å; R18-D21 PolarHBondContact NE-OD2 3.38Å; R18-D21 IonicContact NH1-OD2 3.36Å; R18-D21 VanDerWaalsContact NH2-CG 3.3Å; R18-D21 IonicContact NH2-OD1 3.65Å; R18-D21 PolarHBondContact NH2-OD1 2.89Å; R18-D21 IonicContact NH2-OD2 3.56Å; R18-D21 PolarHBondContact NH2-OD2 3.3Å; R18-D21 WeakPolarHBondContact O-CB 3.35Å; R18-D21 PolarHBondContact O-N 3.07Å; R18-D21 VanDerWaalsContact O-N 3.1Å; D21-S24 PolarHBondContact O-N 2.98Å; D21-C25 PolarHBondContact O-N 3.2Å; D21-C25 PolarHBondContact O-SG 2.82Å
22M98.2Very high98.1Very high0 Ų061 Ų610%031%0.312CS..Hα-helixtrans-60.2-46.4175.8-165.9-169.1-179.600111A10 A13 E14 R18 Y19 S24 C25 M26 L43 V46 A47A10-M22 HydrophobicContact CB-CG 4.03Å; A13-M22 HydrophobicContact CB-CB 4Å; E14-M22 HydrophobicContact CB-CE 3.96Å; E14-M22 HydrophobicContact CB-SD 3.95Å; E14-M22 HydrophobicContact CG-CE 4.18Å; E14-M22 HydrophobicContact CG-SD 4.37Å; R18-M22 PolarHBondContact O-N 3.01Å; Y19-M22 HydrophobicContact CD1-SD 4.03Å; Y19-M22 WeakPolarHBondContact O-CB 3.34Å; Y19-M22 PolarHBondContact O-N 2.68Å; M22-S24 PolarHBondContact O-N 3.47Å; M22-C25 PolarHBondContact O-N 3.34Å; M22-M26 WeakPolarHBondContact O-CB 3.32Å; M22-M26 WeakPolarHBondContact O-CG 3.4Å; M22-M26 PolarHBondContact O-N 2.91Å; M22-L43 HydrophobicContact CE-CB 3.85Å; M22-L43 HydrophobicContact CE-CD2 3.43Å; M22-L43 VanDerWaalsContact CE-CD2 3.43Å; M22-L43 HydrophobicContact CE-CG 4.25Å; M22-L43 WeakPolarHBondContact CE-O 3.26Å; M22-V46 HydrophobicContact CE-CB 4.14Å; M22-V46 HydrophobicContact CE-CG1 4.1Å; M22-V46 HydrophobicContact SD-CG1 4.29Å; M22-A47 HydrophobicContact CB-CB 3.88Å; M22-A47 HydrophobicContact CE-CB 4.27Å; M22-A47 HydrophobicContact CG-CB 3.6Å; M22-A47 VanDerWaalsContact SD-CA 3.58Å; M22-A47 HydrophobicContact SD-CB 3.56Å; M22-A47 VanDerWaalsContact SD-CB 3.56Å
23A98.4Very high97.9Very high7 Ų757.1 Ų57.16%0.05830%0.299CS..Hα-helixtrans-63.1-42.6177.900000111.1Y19 M26 K27 A47 Y48 V51Y19-A23 WeakPolarHBondContact O-CB 3.4Å; Y19-A23 PolarHBondContact O-N 3.24Å; A23-M26 PolarHBondContact O-N 3.26Å; A23-K27 WeakPolarHBondContact O-CB 3.3Å; A23-K27 PolarHBondContact O-N 2.91Å; A23-A47 HydrophobicContact CB-CB 4.11Å; A23-Y48 HydrophobicContact CB-CD1 4.13Å; A23-Y48 HydrophobicContact CB-CD2 4.32Å; A23-Y48 HydrophobicContact CB-CE1 3.98Å; A23-Y48 HydrophobicContact CB-CE2 4.13Å; A23-Y48 HydrophobicContact CB-CG 4.32Å; A23-V51 HydrophobicContact CB-CG2 4.28Å
24S98.3Very high97.8Very high73 Ų7359.3 Ų59.351%0.5132%0.318SS..Hα-helixtrans-61.2-45.2176.1-59.60000112.1D20 D21 M22 S28D20-S24 WeakPolarHBondContact O-CB 3.33Å; D20-S24 PolarHBondContact O-N 3.27Å; D20-S24 PolarHBondContact O-OG 3.49Å; D21-S24 PolarHBondContact O-N 2.98Å; M22-S24 PolarHBondContact O-N 3.47Å; S24-S28 PolarHBondContact O-N 3.16Å; S24-S28 PolarHBondContact O-OG 3.24Å
25C98.4Very high97.7Very high20 Ų2059.2 Ų59.214%0.13532%0.317CS..Hα-helixtrans-64.5-48.1177.1-66.90000111.5L6 A10 D21 M22 K27 S28 V29L6-C25 HydrophobicContact CD2-CB 4.47Å; A10-C25 HydrophobicContact CB-CB 4.01Å; D21-C25 PolarHBondContact O-N 3.2Å; D21-C25 PolarHBondContact O-SG 2.82Å; M22-C25 PolarHBondContact O-N 3.34Å; C25-K27 VanDerWaalsContact C-N 3.33Å; C25-K27 PolarHBondContact O-N 2.99Å; C25-S28 WeakPolarHBondContact O-CB 3.3Å; C25-S28 PolarHBondContact O-N 3.1Å; C25-V29 WeakPolarHBondContact O-CG2 3.49Å; C25-V29 PolarHBondContact O-N 3.22Å
26M98.5Very high97.7Very high0 Ų052 Ų520%028%0.284CS..Hα-helixtrans-71.2-28.1-177.3-68.3-51.4-5300113.1A10 M22 A23 V29 T30 E40 L43 L44A10-M26 HydrophobicContact CB-CG 3.81Å; A10-M26 HydrophobicContact CB-SD 3.63Å; M22-M26 WeakPolarHBondContact O-CB 3.32Å; M22-M26 WeakPolarHBondContact O-CG 3.4Å; M22-M26 PolarHBondContact O-N 2.91Å; A23-M26 PolarHBondContact O-N 3.26Å; M26-V29 HydrophobicContact CE-CB 4.18Å; M26-V29 HydrophobicContact CE-CG1 4.12Å; M26-V29 PolarHBondContact O-N 2.84Å; M26-V29 HydrophobicContact SD-CG2 4.37Å; M26-T30 WeakPolarHBondContact O-CB 3.12Å; M26-T30 PolarHBondContact O-N 3.44Å; M26-T30 PolarHBondContact O-OG1 2.99Å; M26-E40 HydrophobicContact CE-CB 4.11Å; M26-E40 WeakPolarHBondContact CE-O 3.42Å; M26-L43 HydrophobicContact CE-CB 4.15Å; M26-L43 HydrophobicContact CG-CB 4.19Å; M26-L43 HydrophobicContact SD-CB 3.94Å; M26-L43 HydrophobicContact SD-CD1 4.35Å; M26-L44 HydrophobicContact CB-CB 4.23Å; M26-L44 HydrophobicContact CB-CD1 3.66Å; M26-L44 HydrophobicContact CE-CB 4.31Å
27K98.5Very high97.7Very high52 Ų5251.7 Ų51.723%0.22628%0.277CS..Hα-helixtrans-59.2-52.6166.5177.8173.5-173.9176.10110.8A23 C25 V29 T30 E31 D96 L100A23-K27 WeakPolarHBondContact O-CB 3.3Å; A23-K27 PolarHBondContact O-N 2.91Å; C25-K27 VanDerWaalsContact C-N 3.33Å; C25-K27 PolarHBondContact O-N 2.99Å; K27-V29 PolarHBondContact O-N 3.15Å; K27-T30 PolarHBondContact O-N 2.82Å; K27-E31 WeakPolarHBondContact CE-OE1 3.38Å; K27-E31 HydrophobicContact CG-CG 4.37Å; K27-E31 WeakPolarHBondContact O-CG 3.35Å; K27-E31 PolarHBondContact O-N 3.04Å; K27-D96 WeakPolarHBondContact CD-OD2 3.34Å; K27-D96 WeakPolarHBondContact CE-OD1 3.44Å; K27-D96 WeakPolarHBondContact CE-OD2 3.25Å; K27-D96 IonicContact NZ-OD1 3.46Å; K27-D96 PolarHBondContact NZ-OD1 2.88Å; K27-D96 IonicContact NZ-OD2 3.1Å; K27-D96 PolarHBondContact NZ-OD2 3.38Å; K27-L100 HydrophobicContact CB-CD1 4.17Å; K27-L100 HydrophobicContact CG-CD1 4.05Å; K27-L100 HydrophobicContact CG-CD2 4.13Å
28S98.3Very high97.6Very high52 Ų5248.1 Ų48.136%0.36426%0.263SS..Hα-helixtrans-61.9-30.1177.3-640000113.4S24 C25 Q32S24-S28 PolarHBondContact O-N 3.16Å; S24-S28 PolarHBondContact O-OG 3.24Å; C25-S28 WeakPolarHBondContact O-CB 3.3Å; C25-S28 PolarHBondContact O-N 3.1Å; S28-Q32 WeakPolarHBondContact O-CG 3.49Å; S28-Q32 PolarHBondContact O-NE2 3.24Å
29V98.4Very high97.5Very high1 Ų146.2 Ų46.21%0.00626%0.261CS..Hα-helixtrans-67.9-46.5171.4170.60000110.8K3 L6 V7 C25 M26 K27 Q32 L36K3-V29 HydrophobicContact CD-CG1 4.42Å; K3-V29 HydrophobicContact CG-CG1 3.93Å; K3-V29 HydrophobicContact CG-CG2 4.43Å; L6-V29 HydrophobicContact CB-CG2 3.45Å; L6-V29 VanDerWaalsContact CB-CG2 3.45Å; L6-V29 HydrophobicContact CD1-CG2 4.03Å; L6-V29 HydrophobicContact CG-CG2 4.38Å; V7-V29 HydrophobicContact CG2-CG1 4.36Å; V7-V29 HydrophobicContact CG2-CG2 3.94Å; C25-V29 WeakPolarHBondContact O-CG2 3.49Å; C25-V29 PolarHBondContact O-N 3.22Å; M26-V29 HydrophobicContact CE-CB 4.18Å; M26-V29 HydrophobicContact CE-CG1 4.12Å; M26-V29 PolarHBondContact O-N 2.84Å; M26-V29 HydrophobicContact SD-CG2 4.37Å; K27-V29 PolarHBondContact O-N 3.15Å; V29-Q32 WeakPolarHBondContact O-CB 3.35Å; V29-Q32 PolarHBondContact O-N 3.33Å; V29-L36 HydrophobicContact CG1-CD2 3.79Å
30T98.3Very high97.5Very high1 Ų144.5 Ų44.51%0.00626%0.255CS..Hα-helixtrans-65.3-40.4-177.6-57.30000112M26 K27 Q32 G33 L100 F104 L105M26-T30 WeakPolarHBondContact O-CB 3.12Å; M26-T30 PolarHBondContact O-N 3.44Å; M26-T30 PolarHBondContact O-OG1 2.99Å; K27-T30 PolarHBondContact O-N 2.82Å; T30-Q32 PolarHBondContact O-N 2.85Å; T30-Q32 VanDerWaalsContact O-N 3.16Å; T30-G33 PolarHBondContact O-N 3.26Å; T30-L100 HydrophobicContact CG2-CB 4.17Å; T30-L100 HydrophobicContact CG2-CD2 3.97Å; T30-L100 HydrophobicContact CG2-CG 4.49Å; T30-F104 HydrophobicContact CG2-CB 3.8Å; T30-F104 HydrophobicContact CG2-CD2 4.49Å; T30-F104 HydrophobicContact CG2-CG 4.38Å; T30-L105 HydrophobicContact CG2-CD1 4.1Å; T30-L105 HydrophobicContact CG2-CD2 3.58Å; T30-L105 HydrophobicContact CG2-CG 3.73Å
31E97.9Very high97.5Very high91 Ų9141.5 Ų41.543%0.42524%0.238SC..THydrogen-bonded Turntrans-69-8.8179.9-70.1175.115400113.7K27 G33 L100 F104K27-E31 WeakPolarHBondContact CE-OE1 3.38Å; K27-E31 HydrophobicContact CG-CG 4.37Å; K27-E31 WeakPolarHBondContact O-CG 3.35Å; K27-E31 PolarHBondContact O-N 3.04Å; E31-G33 PolarHBondContact O-N 3.49Å; E31-L100 HydrophobicContact CG-CD2 3.74Å; E31-F104 HydrophobicContact CB-CE2 4.49Å; E31-F104 HydrophobicContact CB-CZ 4.27Å; E31-F104 HydrophobicContact CG-CE2 3.9Å; E31-F104 HydrophobicContact CG-CZ 4.12Å
32Q96.4Very high97.4Very high92 Ų9242.1 Ų42.143%0.4324%0.241SC..THydrogen-bonded Turntrans-71.3-13.2169-64.7176.429.700112.7S28 V29 T30 A34S28-Q32 WeakPolarHBondContact O-CG 3.49Å; S28-Q32 PolarHBondContact O-NE2 3.24Å; V29-Q32 WeakPolarHBondContact O-CB 3.35Å; V29-Q32 PolarHBondContact O-N 3.33Å; T30-Q32 PolarHBondContact O-N 2.85Å; T30-Q32 VanDerWaalsContact O-N 3.16Å; Q32-A34 VanDerWaalsContact C-N 3.31Å; Q32-A34 PolarHBondContact O-N 3.48Å
33G94.6Very high97.4Very high30 Ų3042.5 Ų42.531%0.30924%0.243SC..  trans80.50.3169.500000116.2T30 E31 N108T30-G33 PolarHBondContact O-N 3.26Å; E31-G33 PolarHBondContact O-N 3.49Å; G33-N108 PolarHBondContact O-ND2 3.24Å; G33-N108 VanDerWaalsContact O-ND2 3.15Å
34A95.2Very high97.4Very high54 Ų5442.2 Ų42.245%0.44624%0.241SC..SBendtrans-78.7146.7170.400000111Q32 L36Q32-A34 VanDerWaalsContact C-N 3.31Å; Q32-A34 PolarHBondContact O-N 3.48Å; A34-L36 PolarHBondContact O-N 2.69Å
35E97.3Very high97.4Very high71 Ų7140.2 Ų40.233%0.33223%0.226SC..PPolyproline II helixtrans-58.1133.3171.3-173.1170.8-16200110.1A109 S110E35-A109 WeakPolarHBondContact OE1-CA 2.98Å; E35-S110 VanDerWaalsContact CD-OG 3.24Å; E35-S110 PolarHBondContact OE1-N 3.44Å; E35-S110 PolarHBondContact OE1-OG 3.43Å; E35-S110 VanDerWaalsContact OE1-OG 3.05Å; E35-S110 VanDerWaalsContact OE2-CB 3.3Å; E35-S110 WeakPolarHBondContact OE2-CB 3.44Å; E35-S110 PolarHBondContact OE2-OG 3.43Å
36L98Very high97.4Very high7 Ų741.4 Ų41.44%0.03723%0.233CC..PPolyproline II helixtrans-76.8141.4179.3-60.4-171.3000110.6V29 A34 E40 R41 L44 L105V29-L36 HydrophobicContact CG1-CD2 3.79Å; A34-L36 PolarHBondContact O-N 2.69Å; L36-E40 WeakPolarHBondContact CA-OE2 3.49Å; L36-E40 HydrophobicContact CB-CB 3.94Å; L36-E40 HydrophobicContact CD1-CB 4.48Å; L36-E40 HydrophobicContact CD2-CB 4.22Å; L36-E40 HydrophobicContact CG-CB 4.44Å; L36-R41 HydrophobicContact CB-CB 4.39Å; L36-L44 HydrophobicContact CD1-CD2 4.09Å; L36-L105 HydrophobicContact CD1-CD2 3.57Å; L36-L105 HydrophobicContact CG-CD2 3.83Å
37S97.1Very high97.4Very high55 Ų5541.4 Ų41.439%0.38523%0.233SC..PPolyproline II helixtrans-66.4164.916676.10000110.9E39 E40 R41S37-E39 PolarHBondContact O-N 3.26Å; S37-E40 PolarHBondContact N-OE2 2.84Å; S37-E40 PolarHBondContact O-N 3.42Å; S37-E40 VanDerWaalsContact O-N 3.16Å; S37-E40 WeakPolarHBondContact OG-CG 3.45Å; S37-E40 PolarHBondContact OG-N 2.89Å; S37-R41 VanDerWaalsContact O-CB 3.3Å; S37-R41 WeakPolarHBondContact O-CB 3.35Å; S37-R41 PolarHBondContact O-N 2.87Å
38N94.9Very high97.4Very high73 Ų7339.3 Ų39.339%0.3922%0.224SC..Hα-helixtrans-56.8-37.8175.8-73.1-7000112.4R41 N42N38-R41 PolarHBondContact OD1-NH1 2.97Å; N38-N42 WeakPolarHBondContact O-CB 3.28Å; N38-N42 PolarHBondContact O-N 2.88Å; N38-N42 PolarHBondContact O-ND2 3.12Å; N38-N42 PolarHBondContact O-OD1 2.84Å
39E96.5Very high97.4Very high105 Ų10543.3 Ų43.349%0.49123%0.234SC..Hα-helixtrans-65.2-48.4176-174.1-180-147.900111.3K11 S37 R41 N42 L43K11-E39 WeakPolarHBondContact CE-OE1 3.5Å; K11-E39 IonicContact NZ-OE1 3.65Å; K11-E39 PolarHBondContact NZ-OE1 3.43Å; K11-E39 IonicContact NZ-OE2 3.72Å; K11-E39 PolarHBondContact NZ-OE2 3.07Å; S37-E39 PolarHBondContact O-N 3.26Å; E39-R41 PolarHBondContact O-N 3.09Å; E39-N42 PolarHBondContact O-N 3.21Å; E39-L43 HydrophobicContact CG-CD1 4.35Å; E39-L43 WeakPolarHBondContact O-CG 3.42Å; E39-L43 PolarHBondContact O-N 2.68Å
40E98.1Very high97.4Very high18 Ų1845.9 Ų45.98%0.08425%0.248CC..Hα-helixtrans-64.3-42.1179.9-68.7166.6165.700111.9K3 V7 M26 L36 S37 N42 L43 L44K3-E40 VanDerWaalsContact CE-CD 3.43Å; K3-E40 WeakPolarHBondContact CE-OE1 3.5Å; K3-E40 WeakPolarHBondContact CE-OE2 3.33Å; K3-E40 IonicContact NZ-OE1 2.75Å; K3-E40 PolarHBondContact NZ-OE1 3.33Å; K3-E40 IonicContact NZ-OE2 3.84Å; K3-E40 PolarHBondContact NZ-OE2 3.07Å; V7-E40 HydrophobicContact CG2-CG 4.01Å; M26-E40 HydrophobicContact CE-CB 4.11Å; M26-E40 WeakPolarHBondContact CE-O 3.42Å; L36-E40 WeakPolarHBondContact CA-OE2 3.49Å; L36-E40 HydrophobicContact CB-CB 3.94Å; L36-E40 HydrophobicContact CD1-CB 4.48Å; L36-E40 HydrophobicContact CD2-CB 4.22Å; L36-E40 HydrophobicContact CG-CB 4.44Å; S37-E40 PolarHBondContact N-OE2 2.84Å; S37-E40 PolarHBondContact O-N 3.42Å; S37-E40 VanDerWaalsContact O-N 3.16Å; S37-E40 WeakPolarHBondContact OG-CG 3.45Å; S37-E40 PolarHBondContact OG-N 2.89Å; E40-N42 VanDerWaalsContact C-N 3.33Å; E40-N42 PolarHBondContact O-N 3.17Å; E40-L43 PolarHBondContact O-N 3.42Å; E40-L44 PolarHBondContact O-N 3.38Å
41R97.8Very high97.4Very high10 Ų1046.1 Ų46.14%0.03825%0.25CC..Hα-helixtrans-57.7-45.9173.3177.4-168.576.4-172.32.3111.4L36 S37 N38 E39 L44 S45 E113 F117 Y118L36-R41 HydrophobicContact CB-CB 4.39Å; S37-R41 VanDerWaalsContact O-CB 3.3Å; S37-R41 WeakPolarHBondContact O-CB 3.35Å; S37-R41 PolarHBondContact O-N 2.87Å; N38-R41 PolarHBondContact OD1-NH1 2.97Å; E39-R41 PolarHBondContact O-N 3.09Å; R41-L44 PolarHBondContact O-N 2.93Å; R41-S45 WeakPolarHBondContact O-CB 3.38Å; R41-S45 PolarHBondContact O-N 2.85Å; R41-E113 IonicContact CZ-OE1 2.92Å; R41-E113 IonicContact NH1-OE1 3.65Å; R41-E113 PolarHBondContact NH1-OE1 2.87Å; R41-E113 IonicContact NH2-OE1 2.68Å; R41-E113 PolarHBondContact NH2-OE1 3.29Å; R41-F117 VanDerWaalsContact CD-CD1 3.5Å; R41-F117 HydrophobicContact CG-CD1 3.61Å; R41-F117 HydrophobicContact CG-CE1 3.45Å; R41-F117 VanDerWaalsContact CG-CE1 3.45Å; R41-F117 HydrophobicContact CG-CE2 4.48Å; R41-F117 HydrophobicContact CG-CG 4.21Å; R41-F117 HydrophobicContact CG-CZ 3.92Å; R41-Y118 HydrophobicContact CG-CE1 3.68Å
42N96.7Very high97.4Very high72 Ų7241.9 Ų41.939%0.38523%0.23SC..Hα-helixtrans-66.4-41.8179.6-70.9-9.7000111.2N38 E39 E40 L44 S45 V46N38-N42 WeakPolarHBondContact O-CB 3.28Å; N38-N42 PolarHBondContact O-N 2.88Å; N38-N42 PolarHBondContact O-ND2 3.12Å; N38-N42 PolarHBondContact O-OD1 2.84Å; E39-N42 PolarHBondContact O-N 3.21Å; E40-N42 VanDerWaalsContact C-N 3.33Å; E40-N42 PolarHBondContact O-N 3.17Å; N42-L44 PolarHBondContact O-N 3.33Å; N42-S45 WeakPolarHBondContact O-CB 3.49Å; N42-S45 PolarHBondContact O-N 2.93Å; N42-V46 WeakPolarHBondContact O-CG2 3.49Å; N42-V46 PolarHBondContact O-N 3.46Å
43L98.4Very high97.5Very high8 Ų838.6 Ų38.64%0.04222%0.221CC..Hα-helixtrans-58.5-47.9173.9-71.9170000111.5V7 K11 E14 M22 M26 E39 E40 S45 V46 A47V7-L43 HydrophobicContact CG1-CD1 3.92Å; K11-L43 HydrophobicContact CG-CD1 4.05Å; K11-L43 HydrophobicContact CG-CD2 4.15Å; E14-L43 WeakPolarHBondContact OE2-CD2 3.47Å; M22-L43 HydrophobicContact CE-CB 3.85Å; M22-L43 HydrophobicContact CE-CD2 3.43Å; M22-L43 VanDerWaalsContact CE-CD2 3.43Å; M22-L43 HydrophobicContact CE-CG 4.25Å; M22-L43 WeakPolarHBondContact CE-O 3.26Å; M26-L43 HydrophobicContact CE-CB 4.15Å; M26-L43 HydrophobicContact CG-CB 4.19Å; M26-L43 HydrophobicContact SD-CB 3.94Å; M26-L43 HydrophobicContact SD-CD1 4.35Å; E39-L43 HydrophobicContact CG-CD1 4.35Å; E39-L43 WeakPolarHBondContact O-CG 3.42Å; E39-L43 PolarHBondContact O-N 2.68Å; E40-L43 PolarHBondContact O-N 3.42Å; L43-S45 VanDerWaalsContact C-N 3.29Å; L43-S45 PolarHBondContact O-N 3.16Å; L43-V46 PolarHBondContact O-N 2.96Å; L43-A47 WeakPolarHBondContact O-CB 3.34Å; L43-A47 PolarHBondContact O-N 2.74Å
44L98.6Very high97.7Very high2 Ų239.5 Ų39.51%0.0123%0.225CC..Hα-helixtrans-57.1-44.8175.9-179.674.7000111.5M26 L36 E40 R41 N42 A47 Y48 L100 L105M26-L44 HydrophobicContact CB-CB 4.23Å; M26-L44 HydrophobicContact CB-CD1 3.66Å; M26-L44 HydrophobicContact CE-CB 4.31Å; L36-L44 HydrophobicContact CD1-CD2 4.09Å; E40-L44 PolarHBondContact O-N 3.38Å; R41-L44 PolarHBondContact O-N 2.93Å; N42-L44 PolarHBondContact O-N 3.33Å; L44-A47 PolarHBondContact O-N 3.07Å; L44-Y48 HydrophobicContact CD1-CD2 3.69Å; L44-Y48 HydrophobicContact CD1-CE2 3.51Å; L44-Y48 HydrophobicContact CG-CD2 4.23Å; L44-Y48 HydrophobicContact CG-CE2 4.48Å; L44-Y48 PolarHBondContact O-N 3.44Å; L44-L100 HydrophobicContact CD1-CD1 4.43Å; L44-L105 HydrophobicContact CD2-CD1 3.46Å; L44-L105 VanDerWaalsContact CD2-CD1 3.46Å; L44-L105 HydrophobicContact CD2-CD2 4.36Å
45S98.2Very high97.8Very high30 Ų3039.6 Ų39.621%0.2121%0.214CC..Hα-helixtrans-63.2-48.6179.6-169.10000112.1R41 N42 L43 A47 K49R41-S45 WeakPolarHBondContact O-CB 3.38Å; R41-S45 PolarHBondContact O-N 2.85Å; N42-S45 WeakPolarHBondContact O-CB 3.49Å; N42-S45 PolarHBondContact O-N 2.93Å; L43-S45 VanDerWaalsContact C-N 3.29Å; L43-S45 PolarHBondContact O-N 3.16Å; S45-A47 VanDerWaalsContact C-N 3.34Å; S45-A47 PolarHBondContact O-N 2.81Å; S45-K49 WeakPolarHBondContact O-CB 3.44Å; S45-K49 PolarHBondContact O-N 3.18Å
46V98.3Very high97.9Very high46 Ų4637.6 Ų37.628%0.27920%0.204SC..Hα-helixtrans-60.8-43.9178.2169.20000110.9Y19 M22 N42 L43 N50Y19-V46 HydrophobicContact CE1-CG1 4.33Å; M22-V46 HydrophobicContact CE-CB 4.14Å; M22-V46 HydrophobicContact CE-CG1 4.1Å; M22-V46 HydrophobicContact SD-CG1 4.29Å; N42-V46 WeakPolarHBondContact O-CG2 3.49Å; N42-V46 PolarHBondContact O-N 3.46Å; L43-V46 PolarHBondContact O-N 2.96Å; V46-N50 PolarHBondContact O-N 3.14Å; V46-N50 VanDerWaalsContact O-N 3.14Å; V46-N50 PolarHBondContact O-ND2 3.01Å
47A98.6Very high97.9Very high0 Ų040.4 Ų40.40%022%0.224CC..Hα-helixtrans-55.6-61.7178.800000111.3M22 A23 L43 L44 S45 K49 N50 V51M22-A47 HydrophobicContact CB-CB 3.88Å; M22-A47 HydrophobicContact CE-CB 4.27Å; M22-A47 HydrophobicContact CG-CB 3.6Å; M22-A47 VanDerWaalsContact SD-CA 3.58Å; M22-A47 HydrophobicContact SD-CB 3.56Å; M22-A47 VanDerWaalsContact SD-CB 3.56Å; A23-A47 HydrophobicContact CB-CB 4.11Å; L43-A47 WeakPolarHBondContact O-CB 3.34Å; L43-A47 PolarHBondContact O-N 2.74Å; L44-A47 PolarHBondContact O-N 3.07Å; S45-A47 VanDerWaalsContact C-N 3.34Å; S45-A47 PolarHBondContact O-N 2.81Å; A47-K49 PolarHBondContact O-N 3.19Å; A47-N50 PolarHBondContact O-N 2.88Å; A47-V51 WeakPolarHBondContact O-CG2 3.41Å; A47-V51 PolarHBondContact O-N 3.05Å; A47-V51 VanDerWaalsContact O-N 3.1Å
48Y98.7Very high97.9Very high7 Ų740.5 Ų40.53%0.02722%0.224CC..Hα-helixtrans-71.4-32-174.9-78.2-77.5000113A23 L44 N50 V51 V52 I93 V97 L100 Y125A23-Y48 HydrophobicContact CB-CD1 4.13Å; A23-Y48 HydrophobicContact CB-CD2 4.32Å; A23-Y48 HydrophobicContact CB-CE1 3.98Å; A23-Y48 HydrophobicContact CB-CE2 4.13Å; A23-Y48 HydrophobicContact CB-CG 4.32Å; L44-Y48 HydrophobicContact CD1-CD2 3.69Å; L44-Y48 HydrophobicContact CD1-CE2 3.51Å; L44-Y48 HydrophobicContact CG-CD2 4.23Å; L44-Y48 HydrophobicContact CG-CE2 4.48Å; L44-Y48 PolarHBondContact O-N 3.44Å; Y48-N50 VanDerWaalsContact C-N 3.3Å; Y48-N50 PolarHBondContact O-N 3.36Å; Y48-V51 PolarHBondContact O-N 2.65Å; Y48-V52 WeakPolarHBondContact O-CB 3.25Å; Y48-V52 VanDerWaalsContact O-CG1 3.25Å; Y48-V52 WeakPolarHBondContact O-CG1 3.39Å; Y48-V52 PolarHBondContact O-N 3.43Å; Y48-I93 HydrophobicContact CD1-CG2 4.09Å; Y48-V97 HydrophobicContact CD1-CG2 3.07Å; Y48-V97 HydrophobicContact CD2-CG2 3.75Å; Y48-V97 HydrophobicContact CE1-CG2 3.37Å; Y48-V97 HydrophobicContact CE2-CG2 4.02Å; Y48-V97 HydrophobicContact CG-CG2 3.25Å; Y48-L100 HydrophobicContact CE2-CD1 3.98Å; Y48-Y125 WeakPolarHBondContact CB-OH 3.37Å; Y48-Y125 PolarHBondContact O-OH 3Å
49K98Very high98.1Very high136 Ų13638.7 Ų38.759%0.59121%0.212SC*.Hα-helixtrans-57.9-43.6174.2178.7-176.7174.1-173.90111.3S45 A47 G53 Y125S45-K49 WeakPolarHBondContact O-CB 3.44Å; S45-K49 PolarHBondContact O-N 3.18Å; A47-K49 PolarHBondContact O-N 3.19Å; K49-G53 WeakPolarHBondContact O-CA 3.17Å; K49-G53 PolarHBondContact O-N 3.23Å; K49-Y125 PolarHBondContact N-OH 3.01Å
50N98.3Very high98.2Very high56 Ų5638.3 Ų38.330%0.29921%0.206SC..Hα-helixtrans-72.9-42.8179.1-78.1-70.6000112Y19 V46 A47 Y48 G53 A54Y19-N50 HydrophobicContact CD1-CB 3.65Å; Y19-N50 HydrophobicContact CD2-CB 3.38Å; Y19-N50 HydrophobicContact CE1-CB 3.99Å; Y19-N50 WeakPolarHBondContact CE1-ND2 3.36Å; Y19-N50 HydrophobicContact CE2-CB 3.7Å; Y19-N50 HydrophobicContact CG-CB 3.32Å; V46-N50 PolarHBondContact O-N 3.14Å; V46-N50 VanDerWaalsContact O-N 3.14Å; V46-N50 PolarHBondContact O-ND2 3.01Å; A47-N50 PolarHBondContact O-N 2.88Å; Y48-N50 VanDerWaalsContact C-N 3.3Å; Y48-N50 PolarHBondContact O-N 3.36Å; N50-G53 PolarHBondContact O-N 3.43Å; N50-A54 WeakPolarHBondContact O-CB 3.32Å; N50-A54 PolarHBondContact O-N 3.29Å
51V98.4Very high98.2Very high6 Ų641.8 Ų41.84%0.03623%0.228CC..Hα-helixtrans-58.5-51.1177174.20000111Y19 A23 A47 Y48 R55 I93Y19-V51 VanDerWaalsContact C-CG2 3.43Å; Y19-V51 WeakPolarHBondContact O-CG2 3.25Å; A23-V51 HydrophobicContact CB-CG2 4.28Å; A47-V51 WeakPolarHBondContact O-CG2 3.41Å; A47-V51 PolarHBondContact O-N 3.05Å; A47-V51 VanDerWaalsContact O-N 3.1Å; Y48-V51 PolarHBondContact O-N 2.65Å; V51-R55 VanDerWaalsContact O-CD 3.28Å; V51-R55 WeakPolarHBondContact O-CD 3.29Å; V51-R55 PolarHBondContact O-N 3.15Å; V51-I93 HydrophobicContact CG1-CD1 3.61Å; V51-I93 HydrophobicContact CG1-CG1 3.93Å; V51-I93 HydrophobicContact CG1-CG2 3.96Å
52V98.3Very high98.2Very high1 Ų142 Ų421%0.00623%0.231CC..Hα-helixtrans-69.7-37.2179.177.80000111.9Y48 A54 R55 R56 L90 I93 Y125 Y128Y48-V52 WeakPolarHBondContact O-CB 3.25Å; Y48-V52 VanDerWaalsContact O-CG1 3.25Å; Y48-V52 WeakPolarHBondContact O-CG1 3.39Å; Y48-V52 PolarHBondContact O-N 3.43Å; V52-A54 VanDerWaalsContact C-N 3.33Å; V52-A54 PolarHBondContact O-N 2.83Å; V52-R55 PolarHBondContact O-N 2.84Å; V52-R56 HydrophobicContact CG2-CG 4.41Å; V52-R56 WeakPolarHBondContact O-CB 3.34Å; V52-R56 WeakPolarHBondContact O-CG 3.36Å; V52-R56 PolarHBondContact O-N 3.49Å; V52-L90 HydrophobicContact CG2-CG 4.32Å; V52-I93 HydrophobicContact CB-CG2 4.19Å; V52-Y125 HydrophobicContact CB-CE1 4.11Å; V52-Y125 HydrophobicContact CG1-CE1 3.94Å; V52-Y125 HydrophobicContact CG2-CE1 4.31Å; V52-Y128 HydrophobicContact CG1-CD2 4Å; V52-Y128 HydrophobicContact CG1-CE2 3.85Å; V52-Y128 HydrophobicContact CG2-CD2 3.92Å; V52-Y128 HydrophobicContact CG2-CG 4.48Å
53G97.9Very high98.2Very high23 Ų2339.4 Ų39.424%0.23722%0.218CC..Hα-helixtrans-60.8-40.5178.300000112.8K49 N50 S57K49-G53 WeakPolarHBondContact O-CA 3.17Å; K49-G53 PolarHBondContact O-N 3.23Å; N50-G53 PolarHBondContact O-N 3.43Å; G53-S57 WeakPolarHBondContact O-CB 3.46Å; G53-S57 PolarHBondContact O-N 3.14Å; G53-S57 PolarHBondContact O-OG 3.37Å
54A98.1Very high98.1Very high49 Ų4940.7 Ų40.741%0.40523%0.228SC..Hα-helixtrans-62.3-47174.600000111.6N50 V52 S57 S58N50-A54 WeakPolarHBondContact O-CB 3.32Å; N50-A54 PolarHBondContact O-N 3.29Å; V52-A54 VanDerWaalsContact C-N 3.33Å; V52-A54 PolarHBondContact O-N 2.83Å; A54-S57 PolarHBondContact O-N 3.37Å; A54-S58 PolarHBondContact O-N 3.2Å; A54-S58 PolarHBondContact O-OG 3.19Å
55R98.3Very high98.1Very high57 Ų5744.5 Ų44.522%0.21525%0.248CC..Hα-helixtrans-66-41179.1-84.866.7178-165.2-7.5111.8D20 V51 V52 S57 S58 W59 I86 E89 L90 I93D20-R55 IonicContact OD1-CZ 3.33Å; D20-R55 IonicContact OD1-NH1 2.69Å; D20-R55 PolarHBondContact OD1-NH1 3.47Å; D20-R55 IonicContact OD1-NH2 2.62Å; D20-R55 PolarHBondContact OD1-NH2 2.61Å; D20-R55 VanDerWaalsContact OD1-NH2 3.12Å; D20-R55 IonicContact OD2-NH1 2.89Å; V51-R55 VanDerWaalsContact O-CD 3.28Å; V51-R55 WeakPolarHBondContact O-CD 3.29Å; V51-R55 PolarHBondContact O-N 3.15Å; V52-R55 PolarHBondContact O-N 2.84Å; R55-S57 VanDerWaalsContact C-N 3.34Å; R55-S57 PolarHBondContact O-N 2.88Å; R55-S58 PolarHBondContact O-N 3Å; R55-W59 VanDerWaalsContact O-CB 3.31Å; R55-W59 WeakPolarHBondContact O-CB 3.48Å; R55-W59 PolarHBondContact O-N 3.49Å; R55-I86 HydrophobicContact CB-CG2 4.27Å; R55-I86 WeakPolarHBondContact O-CG2 3.2Å; R55-E89 HydrophobicContact CG-CB 4.27Å; R55-E89 IonicContact NE-OE2 2.84Å; R55-L90 HydrophobicContact CB-CB 4.37Å; R55-I93 HydrophobicContact CG-CD1 3.96Å
56R98Very high98Very high28 Ų2844 Ų4411%0.10624%0.242CC..Hα-helixtrans-60-42.7174.1-73.9178.974.2-139.813.1112.3V52 W59 R60 L90 Y128 E131V52-R56 HydrophobicContact CG2-CG 4.41Å; V52-R56 WeakPolarHBondContact O-CB 3.34Å; V52-R56 WeakPolarHBondContact O-CG 3.36Å; V52-R56 PolarHBondContact O-N 3.49Å; R56-W59 PolarHBondContact O-N 2.93Å; R56-R60 WeakPolarHBondContact O-CG 3.3Å; R56-R60 PolarHBondContact O-N 3.2Å; R56-L90 HydrophobicContact CB-CD1 4.43Å; R56-L90 HydrophobicContact CG-CD1 3.46Å; R56-L90 VanDerWaalsContact CG-CD1 3.46Å; R56-Y128 VanDerWaalsContact CZ-CE1 3.46Å; R56-E131 IonicContact CZ-OE2 2.82Å; R56-E131 IonicContact NE-OE2 2.68Å; R56-E131 PolarHBondContact NE-OE2 3.24Å; R56-E131 IonicContact NH2-OE1 3.69Å; R56-E131 IonicContact NH2-OE2 3.25Å; R56-E131 PolarHBondContact NH2-OE2 3.42Å
57S98.2Very high97.9Very high66 Ų6648.3 Ų48.346%0.46226%0.259SS..Hα-helixtrans-64.7-46.9178.2-57.40000111.2G53 A54 R55 W59 R60 V61G53-S57 WeakPolarHBondContact O-CB 3.46Å; G53-S57 PolarHBondContact O-N 3.14Å; G53-S57 PolarHBondContact O-OG 3.37Å; A54-S57 PolarHBondContact O-N 3.37Å; R55-S57 VanDerWaalsContact C-N 3.34Å; R55-S57 PolarHBondContact O-N 2.88Å; S57-W59 VanDerWaalsContact C-N 3.34Å; S57-W59 PolarHBondContact O-N 3.42Å; S57-R60 PolarHBondContact O-N 2.83Å; S57-V61 WeakPolarHBondContact O-CG2 3.34Å; S57-V61 PolarHBondContact O-N 3.34Å
58S98.4Very high97.7Very high57 Ų5756.3 Ų56.340%0.39929%0.294SS..Hα-helixtrans-58.5-45.2173.8-62.60000111.9A54 R55 R60 V61 V62A54-S58 PolarHBondContact O-N 3.2Å; A54-S58 PolarHBondContact O-OG 3.19Å; R55-S58 PolarHBondContact O-N 3Å; S58-R60 PolarHBondContact O-N 3.35Å; S58-V61 PolarHBondContact O-N 2.78Å; S58-V62 VanDerWaalsContact O-CG2 3.28Å; S58-V62 WeakPolarHBondContact O-CG2 3.4Å; S58-V62 PolarHBondContact O-N 3.06Å
59W98.4Very high97.5Very high36 Ų3657.1 Ų57.114%0.13630%0.3CS..Hα-helixtrans-58.1-49.9178.5179.280.4000111.6R55 R56 S57 V61 V62 S63 I86 E87 E131 V132R55-W59 VanDerWaalsContact O-CB 3.31Å; R55-W59 WeakPolarHBondContact O-CB 3.48Å; R55-W59 PolarHBondContact O-N 3.49Å; R56-W59 PolarHBondContact O-N 2.93Å; S57-W59 VanDerWaalsContact C-N 3.34Å; S57-W59 PolarHBondContact O-N 3.42Å; W59-V61 VanDerWaalsContact C-N 3.33Å; W59-V61 PolarHBondContact O-N 2.93Å; W59-V62 PolarHBondContact O-N 3.38Å; W59-S63 WeakPolarHBondContact O-CB 3.38Å; W59-S63 PolarHBondContact O-N 2.95Å; W59-S63 PolarHBondContact O-OG 3.47Å; W59-I86 HydrophobicContact CB-CG2 3.75Å; W59-E87 VanDerWaalsContact CD1-CG 3.45Å; W59-E87 VanDerWaalsContact NE1-CG 3.27Å; W59-E87 PolarHBondContact NE1-OE1 3.39Å; W59-E131 HydrophobicContact CH2-CG 4.13Å; W59-E131 HydrophobicContact CZ3-CG 3.78Å; W59-V132 HydrophobicContact CD2-CG1 3.86Å; W59-V132 HydrophobicContact CE3-CG1 4.28Å; W59-V132 HydrophobicContact CG-CG1 4.27Å; W59-V132 HydrophobicContact CH2-CG1 4.34Å; W59-V132 HydrophobicContact CZ2-CB 4.4Å; W59-V132 HydrophobicContact CZ2-CG1 3.94Å; W59-V132 HydrophobicContact CZ3-CG1 4.5Å
60R97.7Very high97Very high97 Ų9758.2 Ų58.237%0.36631%0.307SS..Hα-helixtrans-58.8-42.7178.4-71.4-175.5-171.7116.8-3.2113.1R56 S57 S58 S64 E131R56-R60 WeakPolarHBondContact O-CG 3.3Å; R56-R60 PolarHBondContact O-N 3.2Å; S57-R60 PolarHBondContact O-N 2.83Å; S58-R60 PolarHBondContact O-N 3.35Å; R60-S64 WeakPolarHBondContact O-CB 3.46Å; R60-S64 PolarHBondContact O-N 3.5Å; R60-E131 IonicContact CZ-OE1 3.71Å; R60-E131 VanDerWaalsContact CZ-OE1 3.25Å; R60-E131 IonicContact NE-OE1 2.89Å; R60-E131 PolarHBondContact NE-OE1 2.91Å; R60-E131 VanDerWaalsContact NE-OE1 3.1Å; R60-E131 IonicContact NH2-OE1 2.95Å; R60-E131 PolarHBondContact NH2-OE1 2.89Å; R60-E131 IonicContact NH2-OE2 2.77Å; R60-E131 PolarHBondContact NH2-OE2 3.42Å
61V98.3Very high96.7Very high90 Ų9059.1 Ų59.155%0.54533%0.33SS..Hα-helixtrans-62-48.1177.8171.50000110.2S57 S58 W59 S64 I65S57-V61 WeakPolarHBondContact O-CG2 3.34Å; S57-V61 PolarHBondContact O-N 3.34Å; S58-V61 PolarHBondContact O-N 2.78Å; W59-V61 VanDerWaalsContact C-N 3.33Å; W59-V61 PolarHBondContact O-N 2.93Å; V61-S64 PolarHBondContact O-N 2.89Å; V61-I65 HydrophobicContact CG1-CD1 3.92Å; V61-I65 WeakPolarHBondContact O-CG1 3.44Å; V61-I65 PolarHBondContact O-N 3.05Å
62V98.2Very high96.5Very high14 Ų1460.8 Ų60.89%0.08534%0.344CS..Hα-helixtrans-69.2-39.3-178-179.90000111.5S58 W59 S64 I65 E66 A79 Y82 R83 I86S58-V62 VanDerWaalsContact O-CG2 3.28Å; S58-V62 WeakPolarHBondContact O-CG2 3.4Å; S58-V62 PolarHBondContact O-N 3.06Å; W59-V62 PolarHBondContact O-N 3.38Å; V62-S64 VanDerWaalsContact C-N 3.32Å; V62-S64 PolarHBondContact O-N 2.88Å; V62-I65 PolarHBondContact O-N 3.35Å; V62-I65 VanDerWaalsContact O-N 3.14Å; V62-E66 PolarHBondContact O-N 3.1Å; V62-A79 VanDerWaalsContact CG1-O 3.25Å; V62-A79 WeakPolarHBondContact CG1-O 3.2Å; V62-Y82 HydrophobicContact CG1-CD1 4.04Å; V62-Y82 HydrophobicContact CG2-CD1 3.66Å; V62-Y82 HydrophobicContact CG2-CE1 3.94Å; V62-R83 HydrophobicContact CG1-CB 3.9Å; V62-I86 HydrophobicContact CB-CD1 4.25Å; V62-I86 HydrophobicContact CG2-CD1 3.77Å
63S96.8Very high96.2Very high18 Ų1868.6 Ų68.613%0.12638%0.38CS..Hα-helixtrans-58.5-42.4171.9-62.50000111.8W59 E66 Q67 R83W59-S63 WeakPolarHBondContact O-CB 3.38Å; W59-S63 PolarHBondContact O-N 2.95Å; W59-S63 PolarHBondContact O-OG 3.47Å; S63-E66 PolarHBondContact O-N 3.34Å; S63-Q67 WeakPolarHBondContact O-CG 3.45Å; S63-Q67 PolarHBondContact O-N 3.15Å; S63-Q67 VanDerWaalsContact O-N 3.1Å; S63-R83 WeakPolarHBondContact OG-CD 3.08Å
64S97.4Very high96.1Very high36 Ų3675.5 Ų75.525%0.25240%0.404SS..Hα-helixtrans-65.5-38.1175-1730000112.3R60 V61 V62 K68R60-S64 WeakPolarHBondContact O-CB 3.46Å; R60-S64 PolarHBondContact O-N 3.5Å; V61-S64 PolarHBondContact O-N 2.89Å; V62-S64 VanDerWaalsContact C-N 3.32Å; V62-S64 PolarHBondContact O-N 2.88Å; S64-K68 WeakPolarHBondContact O-CB 3.42Å; S64-K68 VanDerWaalsContact O-CG 3.3Å; S64-K68 WeakPolarHBondContact O-CG 3.41Å; S64-K68 PolarHBondContact O-N 2.92Å; S64-K68 WeakPolarHBondContact OG-CE 3.44Å; S64-K68 PolarHBondContact OG-NZ 3.29Å; S64-K68 VanDerWaalsContact OG-NZ 3.14Å
65I97.3Very high96Very high82 Ų8280 Ų8042%0.42141%0.414SS..Hα-helixtrans-65.3-46175.4-68.6165.5000110.3V61 V62 Q67 K68 T69 A79V61-I65 HydrophobicContact CG1-CD1 3.92Å; V61-I65 WeakPolarHBondContact O-CG1 3.44Å; V61-I65 PolarHBondContact O-N 3.05Å; V62-I65 PolarHBondContact O-N 3.35Å; V62-I65 VanDerWaalsContact O-N 3.14Å; I65-Q67 VanDerWaalsContact C-N 3.32Å; I65-Q67 PolarHBondContact O-N 3.27Å; I65-K68 PolarHBondContact O-N 3.46Å; I65-T69 HydrophobicContact CG2-CG2 4.18Å; I65-T69 VanDerWaalsContact O-CG2 3.32Å; I65-T69 WeakPolarHBondContact O-CG2 3.41Å; I65-T69 PolarHBondContact O-N 3.23Å; I65-T69 PolarHBondContact O-OG1 2.95Å; I65-A79 HydrophobicContact CG2-CB 4.21Å
66E96.5Very high96Very high18 Ų1879.5 Ų79.58%0.08441%0.414CS..Hα-helixtrans-54.1-50.3177.2-176.3-178.4173.300110.5V62 S63 K68 T69 Q76 A79 R80 R83V62-E66 PolarHBondContact O-N 3.1Å; S63-E66 PolarHBondContact O-N 3.34Å; E66-K68 PolarHBondContact O-N 2.81Å; E66-T69 PolarHBondContact O-N 3.38Å; E66-T69 PolarHBondContact O-OG1 2.89Å; E66-Q76 HydrophobicContact CG-CG 4.01Å; E66-A79 HydrophobicContact CB-CB 3.84Å; E66-A79 HydrophobicContact CG-CB 4.38Å; E66-R80 HydrophobicContact CG-CB 4.44Å; E66-R80 WeakPolarHBondContact OE1-CB 3.34Å; E66-R80 IonicContact OE1-CZ 3.38Å; E66-R80 IonicContact OE1-NE 3.8Å; E66-R80 PolarHBondContact OE1-NE 3.41Å; E66-R80 IonicContact OE1-NH2 2.89Å; E66-R80 PolarHBondContact OE1-NH2 3.31Å; E66-R83 IonicContact OE1-NH2 3.18Å; E66-R83 IonicContact OE2-CZ 3.4Å; E66-R83 IonicContact OE2-NE 3.58Å; E66-R83 PolarHBondContact OE2-NE 3.19Å; E66-R83 IonicContact OE2-NH2 2.69Å; E66-R83 PolarHBondContact OE2-NH2 2.98Å
67Q95.4Very high95.9Very high138 Ų13882.2 Ų82.265%0.64543%0.428SS*.Hα-helixtrans-59.1-46.1177-71.1173.8-9.600112.4S63 I65 T69 E70S63-Q67 WeakPolarHBondContact O-CG 3.45Å; S63-Q67 PolarHBondContact O-N 3.15Å; S63-Q67 VanDerWaalsContact O-N 3.1Å; I65-Q67 VanDerWaalsContact C-N 3.32Å; I65-Q67 PolarHBondContact O-N 3.27Å; Q67-T69 PolarHBondContact O-N 3.49Å; Q67-E70 WeakPolarHBondContact O-CB 3.35Å; Q67-E70 PolarHBondContact O-N 3.19Å
68K96.2Very high95.9Very high167 Ų16784.6 Ų84.673%0.72643%0.433SS*.Hα-helixtrans-71.3-14.3-179.4-72.4169.3179.8161.40114.2S64 I65 E66S64-K68 WeakPolarHBondContact O-CB 3.42Å; S64-K68 VanDerWaalsContact O-CG 3.3Å; S64-K68 WeakPolarHBondContact O-CG 3.41Å; S64-K68 PolarHBondContact O-N 2.92Å; S64-K68 WeakPolarHBondContact OG-CE 3.44Å; S64-K68 PolarHBondContact OG-NZ 3.29Å; S64-K68 VanDerWaalsContact OG-NZ 3.14Å; I65-K68 PolarHBondContact O-N 3.46Å; E66-K68 PolarHBondContact O-N 2.81Å
69T93.7Very high95.9Very high25 Ų2582.3 Ų82.315%0.15342%0.418CS..THydrogen-bonded Turntrans-95.311.2176.956.10000113.4I65 E66 Q67 G71 A72 K75 Q76I65-T69 HydrophobicContact CG2-CG2 4.18Å; I65-T69 VanDerWaalsContact O-CG2 3.32Å; I65-T69 WeakPolarHBondContact O-CG2 3.41Å; I65-T69 PolarHBondContact O-N 3.23Å; I65-T69 PolarHBondContact O-OG1 2.95Å; E66-T69 PolarHBondContact O-N 3.38Å; E66-T69 PolarHBondContact O-OG1 2.89Å; Q67-T69 PolarHBondContact O-N 3.49Å; T69-G71 PolarHBondContact O-N 2.68Å; T69-A72 WeakPolarHBondContact O-CB 3.49Å; T69-A72 PolarHBondContact O-N 2.95Å; T69-K75 HydrophobicContact CG2-CB 4.07Å; T69-Q76 VanDerWaalsContact OG1-CA 3.3Å; T69-Q76 WeakPolarHBondContact OG1-CA 3.42Å
70E88Confident95.8Very high159 Ų15985.2 Ų85.274%0.74343%0.429SS*.THydrogen-bonded Turntrans-52.4130.7172.4-170.3171.7-162.700111.2Q67 A72Q67-E70 WeakPolarHBondContact O-CB 3.35Å; Q67-E70 PolarHBondContact O-N 3.19Å; E70-A72 VanDerWaalsContact C-N 3.33Å
71G90.7Very high95.8Very high75 Ų7585.6 Ų85.677%0.77344%0.435SS*.THydrogen-bonded Turntrans87.3-12-172.900000115.2T69T69-G71 PolarHBondContact O-N 2.68Å
72A94.2Very high95.8Very high41 Ų4187.4 Ų87.434%0.33943%0.433SS..  trans-105.971.4171.500000110.8T69 E70 K74 K75 Q76T69-A72 WeakPolarHBondContact O-CB 3.49Å; T69-A72 PolarHBondContact O-N 2.95Å; E70-A72 VanDerWaalsContact C-N 3.33Å; A72-K74 VanDerWaalsContact C-N 3.33Å; A72-K74 PolarHBondContact O-N 2.99Å; A72-K75 HydrophobicContact CB-CB 4.19Å; A72-K75 HydrophobicContact CB-CD 4.34Å; A72-K75 WeakPolarHBondContact O-CA 3.49Å; A72-K75 PolarHBondContact O-N 3.34Å; A72-Q76 PolarHBondContact O-N 2.86Å
73E93.5Very high95.8Very high164 Ų16488.8 Ų88.877%0.76644%0.437SS*.Hα-helixtrans-40.9-51.8-168.6-65.9-179.217400114.5K75 Q76 Q77E73-K75 PolarHBondContact O-N 3.01Å; E73-Q76 PolarHBondContact O-N 3.42Å; E73-Q77 WeakPolarHBondContact O-CB 3.38Å; E73-Q77 PolarHBondContact O-N 3.28Å
74K95.8Very high95.8Very high169 Ų16992 Ų9274%0.73545%0.45SS*.Hα-helixtrans-63.2-40.6-179.1-174.2176-179.5177.90112.8A72 M78A72-K74 VanDerWaalsContact C-N 3.33Å; A72-K74 PolarHBondContact O-N 2.99Å; K74-M78 HydrophobicContact CG-SD 4.42Å; K74-M78 VanDerWaalsContact O-CG 3.26Å; K74-M78 WeakPolarHBondContact O-CG 3.4Å; K74-M78 PolarHBondContact O-N 2.98Å; K74-M78 VanDerWaalsContact O-N 3.15Å
75K95.7Very high95.9Very high142 Ų14295.8 Ų95.862%0.61746%0.462SS*.Hα-helixtrans-70.9-41.7178.7-72.4-177.6177.4179.50110.8T69 A72 E73 M78 A79T69-K75 HydrophobicContact CG2-CB 4.07Å; A72-K75 HydrophobicContact CB-CB 4.19Å; A72-K75 HydrophobicContact CB-CD 4.34Å; A72-K75 WeakPolarHBondContact O-CA 3.49Å; A72-K75 PolarHBondContact O-N 3.34Å; E73-K75 PolarHBondContact O-N 3.01Å; K75-M78 PolarHBondContact O-N 3.43Å; K75-A79 WeakPolarHBondContact O-CB 3.39Å; K75-A79 PolarHBondContact O-N 3.24Å
76Q96.9Very high95.9Very high47 Ų4792.1 Ų92.122%0.2244%0.443CS..Hα-helixtrans-62.3-43.9177.2-168.7176.224.800111.4E66 T69 A72 E73 A79 R80E66-Q76 HydrophobicContact CG-CG 4.01Å; T69-Q76 VanDerWaalsContact OG1-CA 3.3Å; T69-Q76 WeakPolarHBondContact OG1-CA 3.42Å; A72-Q76 PolarHBondContact O-N 2.86Å; E73-Q76 PolarHBondContact O-N 3.42Å; Q76-A79 PolarHBondContact O-N 3.45Å; Q76-R80 WeakPolarHBondContact O-CB 3.34Å; Q76-R80 PolarHBondContact O-N 2.75Å
77Q97.2Very high96Very high86 Ų8692.2 Ų92.240%0.40244%0.443SS..Hα-helixtrans-61.4-45.1175.9-177.259.328.300112E73 A79 R80 E81E73-Q77 WeakPolarHBondContact O-CB 3.38Å; E73-Q77 PolarHBondContact O-N 3.28Å; Q77-A79 VanDerWaalsContact C-N 3.32Å; Q77-A79 PolarHBondContact O-N 3.46Å; Q77-R80 WeakPolarHBondContact O-CB 3.26Å; Q77-R80 PolarHBondContact O-N 3.37Å; Q77-E81 WeakPolarHBondContact CG-OE1 3.39Å; Q77-E81 PolarHBondContact NE2-OE1 3Å; Q77-E81 WeakPolarHBondContact O-CG 3.48Å; Q77-E81 PolarHBondContact O-N 2.96Å
78M97.6Very high96.1Very high115 Ų11588.7 Ų88.757%0.56743%0.431SS*.Hα-helixtrans-61.8-39.9176-71.3174.266.800112.4K74 K75 Y82K74-M78 HydrophobicContact CG-SD 4.42Å; K74-M78 VanDerWaalsContact O-CG 3.26Å; K74-M78 WeakPolarHBondContact O-CG 3.4Å; K74-M78 PolarHBondContact O-N 2.98Å; K74-M78 VanDerWaalsContact O-N 3.15Å; K75-M78 PolarHBondContact O-N 3.43Å; M78-Y82 WeakPolarHBondContact O-CB 3.29Å; M78-Y82 PolarHBondContact O-N 3.47Å; M78-Y82 VanDerWaalsContact O-N 3.17Å
79A97.7Very high96.2Very high10 Ų1083.9 Ų83.98%0.08341%0.411CS..Hα-helixtrans-66-42.5176.700000111.4V62 I65 E66 K75 Q76 Q77 Y82 R83V62-A79 VanDerWaalsContact CG1-O 3.25Å; V62-A79 WeakPolarHBondContact CG1-O 3.2Å; I65-A79 HydrophobicContact CG2-CB 4.21Å; E66-A79 HydrophobicContact CB-CB 3.84Å; E66-A79 HydrophobicContact CG-CB 4.38Å; K75-A79 WeakPolarHBondContact O-CB 3.39Å; K75-A79 PolarHBondContact O-N 3.24Å; Q76-A79 PolarHBondContact O-N 3.45Å; Q77-A79 VanDerWaalsContact C-N 3.32Å; Q77-A79 PolarHBondContact O-N 3.46Å; A79-Y82 PolarHBondContact O-N 3.47Å; A79-R83 WeakPolarHBondContact O-CB 3.31Å; A79-R83 PolarHBondContact O-N 3.04Å
80R97.5Very high96.4Very high97 Ų9782.7 Ų82.737%0.36640%0.404SS..Hα-helixtrans-59.1-52.5175.5178.9174.1-62.7-175.53.8112.5E66 Q76 Q77 Y82 R83 E84E66-R80 HydrophobicContact CG-CB 4.44Å; E66-R80 WeakPolarHBondContact OE1-CB 3.34Å; E66-R80 IonicContact OE1-CZ 3.38Å; E66-R80 IonicContact OE1-NE 3.8Å; E66-R80 PolarHBondContact OE1-NE 3.41Å; E66-R80 IonicContact OE1-NH2 2.89Å; E66-R80 PolarHBondContact OE1-NH2 3.31Å; Q76-R80 WeakPolarHBondContact O-CB 3.34Å; Q76-R80 PolarHBondContact O-N 2.75Å; Q77-R80 WeakPolarHBondContact O-CB 3.26Å; Q77-R80 PolarHBondContact O-N 3.37Å; R80-Y82 PolarHBondContact O-N 2.95Å; R80-R83 WeakPolarHBondContact O-CB 3.5Å; R80-R83 PolarHBondContact O-N 3.3Å; R80-R83 VanDerWaalsContact O-N 3.1Å; R80-E84 HydrophobicContact CG-CG 4.48Å; R80-E84 WeakPolarHBondContact CG-OE1 3.39Å; R80-E84 WeakPolarHBondContact O-CG 3.44Å; R80-E84 PolarHBondContact O-N 3.1Å
81E98Very high96.9Very high105 Ų10579.5 Ų79.549%0.49139%0.385SS..Hα-helixtrans-58.2-39.3179.5-73.1170.1-172.400111.4Q77 K85Q77-E81 WeakPolarHBondContact CG-OE1 3.39Å; Q77-E81 PolarHBondContact NE2-OE1 3Å; Q77-E81 WeakPolarHBondContact O-CG 3.48Å; Q77-E81 PolarHBondContact O-N 2.96Å; E81-K85 PolarHBondContact O-N 3.41Å; E81-K85 VanDerWaalsContact O-N 3.11Å
82Y98.2Very high97.2Very high128 Ų12880.5 Ų80.550%0.50237%0.373SS..Hα-helixtrans-72.3-36.6177.1-164.3-120.5000112.6V62 M78 A79 R80 K85 I86V62-Y82 HydrophobicContact CG1-CD1 4.04Å; V62-Y82 HydrophobicContact CG2-CD1 3.66Å; V62-Y82 HydrophobicContact CG2-CE1 3.94Å; M78-Y82 WeakPolarHBondContact O-CB 3.29Å; M78-Y82 PolarHBondContact O-N 3.47Å; M78-Y82 VanDerWaalsContact O-N 3.17Å; A79-Y82 PolarHBondContact O-N 3.47Å; R80-Y82 PolarHBondContact O-N 2.95Å; Y82-K85 HydrophobicContact CD2-CD 4.43Å; Y82-K85 HydrophobicContact CE2-CD 4.43Å; Y82-K85 WeakPolarHBondContact O-CB 3.37Å; Y82-K85 PolarHBondContact O-N 3.19Å; Y82-I86 HydrophobicContact CD1-CD1 4.04Å; Y82-I86 HydrophobicContact CE1-CD1 3.9Å; Y82-I86 WeakPolarHBondContact O-CG1 3.17Å; Y82-I86 PolarHBondContact O-N 3.38Å; Y82-I86 VanDerWaalsContact O-N 3.14Å
83R97.7Very high97.4Very high43 Ų4379.7 Ų79.716%0.16236%0.363CS..Hα-helixtrans-58.8-50.6171.7-179.1-177.153.276.34.8110.7V62 S63 E66 A79 R80 K85 I86 E87V62-R83 HydrophobicContact CG1-CB 3.9Å; S63-R83 WeakPolarHBondContact OG-CD 3.08Å; E66-R83 IonicContact OE1-NH2 3.18Å; E66-R83 IonicContact OE2-CZ 3.4Å; E66-R83 IonicContact OE2-NE 3.58Å; E66-R83 PolarHBondContact OE2-NE 3.19Å; E66-R83 IonicContact OE2-NH2 2.69Å; E66-R83 PolarHBondContact OE2-NH2 2.98Å; A79-R83 WeakPolarHBondContact O-CB 3.31Å; A79-R83 PolarHBondContact O-N 3.04Å; R80-R83 WeakPolarHBondContact O-CB 3.5Å; R80-R83 PolarHBondContact O-N 3.3Å; R80-R83 VanDerWaalsContact O-N 3.1Å; R83-K85 VanDerWaalsContact C-N 3.28Å; R83-K85 PolarHBondContact O-N 3.03Å; R83-I86 WeakPolarHBondContact O-CB 3.49Å; R83-I86 PolarHBondContact O-N 3.3Å; R83-E87 HydrophobicContact CG-CG 4.44Å; R83-E87 IonicContact CZ-OE1 2.65Å; R83-E87 IonicContact NH1-OE1 3.49Å; R83-E87 PolarHBondContact NH1-OE1 3.35Å; R83-E87 IonicContact NH1-OE2 2.88Å; R83-E87 PolarHBondContact NH1-OE2 2.99Å; R83-E87 WeakPolarHBondContact O-CG 3.31Å; R83-E87 PolarHBondContact O-N 3.43Å
84E97.4Very high97.6Very high86 Ų8671.9 Ų71.940%0.40233%0.326SS..Hα-helixtrans-61.7-35-179.1-71.8171.7-176.900112.4R80 E87 T88R80-E84 HydrophobicContact CG-CG 4.48Å; R80-E84 WeakPolarHBondContact CG-OE1 3.39Å; R80-E84 WeakPolarHBondContact O-CG 3.44Å; R80-E84 PolarHBondContact O-N 3.1Å; E84-E87 PolarHBondContact O-N 3.08Å; E84-T88 PolarHBondContact O-N 2.9Å; E84-T88 PolarHBondContact O-OG1 2.89Å
85K98.3Very high97.8Very high114 Ų11467.4 Ų67.450%0.49631%0.31SS..Hα-helixtrans-60.4-48.5170.2179.8179.7173.9-1800111.6E81 Y82 R83 E87 T88 E89E81-K85 PolarHBondContact O-N 3.41Å; E81-K85 VanDerWaalsContact O-N 3.11Å; Y82-K85 HydrophobicContact CD2-CD 4.43Å; Y82-K85 HydrophobicContact CE2-CD 4.43Å; Y82-K85 WeakPolarHBondContact O-CB 3.37Å; Y82-K85 PolarHBondContact O-N 3.19Å; R83-K85 VanDerWaalsContact C-N 3.28Å; R83-K85 PolarHBondContact O-N 3.03Å; K85-E87 VanDerWaalsContact C-N 3.31Å; K85-E87 PolarHBondContact O-N 3.43Å; K85-T88 WeakPolarHBondContact O-CB 3.47Å; K85-T88 PolarHBondContact O-N 2.87Å; K85-E89 WeakPolarHBondContact CE-OE1 3.3Å; K85-E89 PolarHBondContact O-N 2.82Å
86I98.3Very high97.9Very high5 Ų562.9 Ų62.93%0.02629%0.293CS..Hα-helixtrans-64-38.4179-62.4163000111R55 W59 V62 Y82 R83 T88 E89 L90R55-I86 HydrophobicContact CB-CG2 4.27Å; R55-I86 WeakPolarHBondContact O-CG2 3.2Å; W59-I86 HydrophobicContact CB-CG2 3.75Å; V62-I86 HydrophobicContact CB-CD1 4.25Å; V62-I86 HydrophobicContact CG2-CD1 3.77Å; Y82-I86 HydrophobicContact CD1-CD1 4.04Å; Y82-I86 HydrophobicContact CE1-CD1 3.9Å; Y82-I86 WeakPolarHBondContact O-CG1 3.17Å; Y82-I86 PolarHBondContact O-N 3.38Å; Y82-I86 VanDerWaalsContact O-N 3.14Å; R83-I86 WeakPolarHBondContact O-CB 3.49Å; R83-I86 PolarHBondContact O-N 3.3Å; I86-T88 VanDerWaalsContact C-N 3.28Å; I86-T88 PolarHBondContact O-N 2.89Å; I86-E89 PolarHBondContact O-N 2.87Å; I86-L90 WeakPolarHBondContact O-CB 3.32Å; I86-L90 PolarHBondContact O-N 3.48Å
87E97.7Very high97.9Very high20 Ų2060.8 Ų60.89%0.09328%0.283CS..Hα-helixtrans-61.2-38.7175.1-69.9175.3174.100112.2W59 R83 E84 K85 L90 R91 V132W59-E87 VanDerWaalsContact CD1-CG 3.45Å; W59-E87 VanDerWaalsContact NE1-CG 3.27Å; W59-E87 PolarHBondContact NE1-OE1 3.39Å; R83-E87 HydrophobicContact CG-CG 4.44Å; R83-E87 IonicContact CZ-OE1 2.65Å; R83-E87 IonicContact NH1-OE1 3.49Å; R83-E87 PolarHBondContact NH1-OE1 3.35Å; R83-E87 IonicContact NH1-OE2 2.88Å; R83-E87 PolarHBondContact NH1-OE2 2.99Å; R83-E87 WeakPolarHBondContact O-CG 3.31Å; R83-E87 PolarHBondContact O-N 3.43Å; E84-E87 PolarHBondContact O-N 3.08Å; K85-E87 VanDerWaalsContact C-N 3.31Å; K85-E87 PolarHBondContact O-N 3.43Å; E87-L90 PolarHBondContact O-N 3.49Å; E87-R91 VanDerWaalsContact O-CB 3.25Å; E87-R91 WeakPolarHBondContact O-CB 3.39Å; E87-R91 PolarHBondContact O-N 2.88Å; E87-V132 HydrophobicContact CG-CB 4.07Å; E87-V132 HydrophobicContact CG-CG1 4.38Å
88T97.7Very high98Very high65 Ų6556.9 Ų56.940%0.39927%0.265SS..Hα-helixtrans-64.1-49.5175.1-56.80000110.9E84 K85 I86 L90 R91 D92E84-T88 PolarHBondContact O-N 2.9Å; E84-T88 PolarHBondContact O-OG1 2.89Å; K85-T88 WeakPolarHBondContact O-CB 3.47Å; K85-T88 PolarHBondContact O-N 2.87Å; I86-T88 VanDerWaalsContact C-N 3.28Å; I86-T88 PolarHBondContact O-N 2.89Å; T88-L90 VanDerWaalsContact C-N 3.33Å; T88-L90 PolarHBondContact O-N 3.5Å; T88-R91 PolarHBondContact O-N 2.95Å; T88-D92 VanDerWaalsContact O-CG 3.28Å; T88-D92 PolarHBondContact O-N 2.97Å
89E98.2Very high98.1Very high65 Ų6552.8 Ų52.830%0.30425%0.248SC..Hα-helixtrans-58-45.1175.9-67.2175.6-165.900111.9R55 K85 I86 R91 D92 I93R55-E89 HydrophobicContact CG-CB 4.27Å; R55-E89 IonicContact NE-OE2 2.84Å; K85-E89 WeakPolarHBondContact CE-OE1 3.3Å; K85-E89 PolarHBondContact O-N 2.82Å; I86-E89 PolarHBondContact O-N 2.87Å; E89-R91 PolarHBondContact O-N 3.42Å; E89-D92 PolarHBondContact O-N 2.96Å; E89-I93 VanDerWaalsContact O-CD1 3.29Å; E89-I93 WeakPolarHBondContact O-CD1 3.38Å; E89-I93 VanDerWaalsContact O-CG1 3.23Å; E89-I93 WeakPolarHBondContact O-CG1 3.07Å; E89-I93 PolarHBondContact O-N 3.47Å
90L97.9Very high98.1Very high0 Ų052.4 Ų52.40%024%0.244CC..Hα-helixtrans-61.8-44177.9-174.1152.2000111.4V52 R55 R56 I86 E87 T88 I93 C94 L129 V132V52-L90 HydrophobicContact CG2-CG 4.32Å; R55-L90 HydrophobicContact CB-CB 4.37Å; R56-L90 HydrophobicContact CB-CD1 4.43Å; R56-L90 HydrophobicContact CG-CD1 3.46Å; R56-L90 VanDerWaalsContact CG-CD1 3.46Å; I86-L90 WeakPolarHBondContact O-CB 3.32Å; I86-L90 PolarHBondContact O-N 3.48Å; E87-L90 PolarHBondContact O-N 3.49Å; T88-L90 VanDerWaalsContact C-N 3.33Å; T88-L90 PolarHBondContact O-N 3.5Å; L90-I93 PolarHBondContact O-N 3.4Å; L90-C94 WeakPolarHBondContact O-CB 3.45Å; L90-C94 PolarHBondContact O-N 3.31Å; L90-C94 PolarHBondContact O-SG 3.33Å; L90-L129 HydrophobicContact CD2-CD2 4.45Å; L90-V132 HydrophobicContact CD1-CG1 4.15Å; L90-V132 HydrophobicContact CD2-CG1 4.35Å; L90-V132 HydrophobicContact CD2-CG2 3.88Å
91R97.7Very high98.2Very high92 Ų9247.8 Ų47.835%0.34723%0.227SC..Hα-helixtrans-61.7-44.5177.8-175-177.4-57.999.52.6111.3E87 T88 E89 C94 N95 L129E87-R91 VanDerWaalsContact O-CB 3.25Å; E87-R91 WeakPolarHBondContact O-CB 3.39Å; E87-R91 PolarHBondContact O-N 2.88Å; T88-R91 PolarHBondContact O-N 2.95Å; E89-R91 PolarHBondContact O-N 3.42Å; R91-C94 PolarHBondContact O-N 3.35Å; R91-N95 WeakPolarHBondContact O-CB 3.46Å; R91-N95 VanDerWaalsContact O-CG 3.28Å; R91-N95 PolarHBondContact O-N 2.91Å; R91-N95 PolarHBondContact O-ND2 3.28Å; R91-L129 HydrophobicContact CB-CD2 4.13Å; R91-L129 HydrophobicContact CG-CD2 3.95Å
92D98.2Very high98.2Very high97 Ų9746.6 Ų46.652%0.51922%0.222SC..Hα-helixtrans-62.5-46.3178.5-68-17.3000111.2T88 E89 C94 N95 D96T88-D92 VanDerWaalsContact O-CG 3.28Å; T88-D92 PolarHBondContact O-N 2.97Å; E89-D92 PolarHBondContact O-N 2.96Å; D92-C94 PolarHBondContact O-N 3.35Å; D92-N95 PolarHBondContact O-N 3.45Å; D92-D96 WeakPolarHBondContact O-CB 3.5Å; D92-D96 PolarHBondContact O-N 3.3Å
93I98.4Very high98.2Very high23 Ų2347 Ų4712%0.11823%0.226CC..Hα-helixtrans-60.1-46.8176.5-66.1156000110.9Y48 V51 V52 R55 E89 L90 D96 V97Y48-I93 HydrophobicContact CD1-CG2 4.09Å; V51-I93 HydrophobicContact CG1-CD1 3.61Å; V51-I93 HydrophobicContact CG1-CG1 3.93Å; V51-I93 HydrophobicContact CG1-CG2 3.96Å; V52-I93 HydrophobicContact CB-CG2 4.19Å; R55-I93 HydrophobicContact CG-CD1 3.96Å; E89-I93 VanDerWaalsContact O-CD1 3.29Å; E89-I93 WeakPolarHBondContact O-CD1 3.38Å; E89-I93 VanDerWaalsContact O-CG1 3.23Å; E89-I93 WeakPolarHBondContact O-CG1 3.07Å; E89-I93 PolarHBondContact O-N 3.47Å; L90-I93 PolarHBondContact O-N 3.4Å; I93-D96 PolarHBondContact O-N 2.98Å; I93-V97 WeakPolarHBondContact O-CG2 3.34Å; I93-V97 PolarHBondContact O-N 2.88Å
94C98.5Very high98.2Very high0 Ų047.4 Ų47.40%023%0.229CC..Hα-helixtrans-65-44.8-179.2-65.60000111.5L90 R91 D92 D96 V97 L98 Y125 L129L90-C94 WeakPolarHBondContact O-CB 3.45Å; L90-C94 PolarHBondContact O-N 3.31Å; L90-C94 PolarHBondContact O-SG 3.33Å; R91-C94 PolarHBondContact O-N 3.35Å; D92-C94 PolarHBondContact O-N 3.35Å; C94-D96 VanDerWaalsContact C-N 3.27Å; C94-D96 PolarHBondContact O-N 3.1Å; C94-V97 PolarHBondContact O-N 3.4Å; C94-L98 WeakPolarHBondContact O-CB 3.46Å; C94-L98 WeakPolarHBondContact O-CG 2.99Å; C94-L98 PolarHBondContact O-N 3.4Å; C94-Y125 HydrophobicContact CB-CD1 4.1Å; C94-L129 HydrophobicContact CB-CD1 4.01Å; C94-L129 HydrophobicContact CB-CD2 3.65Å; C94-L129 HydrophobicContact CB-CG 3.63Å
95N98.3Very high98.3Very high76 Ų7643.7 Ų43.741%0.40621%0.211SC..Hα-helixtrans-64.3-33.6178.6-75.6-24.2000112.4R91 D92 L98 S99R91-N95 WeakPolarHBondContact O-CB 3.46Å; R91-N95 VanDerWaalsContact O-CG 3.28Å; R91-N95 PolarHBondContact O-N 2.91Å; R91-N95 PolarHBondContact O-ND2 3.28Å; D92-N95 PolarHBondContact O-N 3.45Å; N95-L98 PolarHBondContact O-N 2.8Å; N95-S99 VanDerWaalsContact O-CB 3.32Å; N95-S99 WeakPolarHBondContact O-CB 3.46Å; N95-S99 PolarHBondContact O-N 3.12Å
96D98.1Very high98.3Very high47 Ų4739.7 Ų39.725%0.25120%0.195SC..Hα-helixtrans-63.6-48.2175.7-154.617.5000111.1K27 D92 I93 C94 S99 L100K27-D96 WeakPolarHBondContact CD-OD2 3.34Å; K27-D96 WeakPolarHBondContact CE-OD1 3.44Å; K27-D96 WeakPolarHBondContact CE-OD2 3.25Å; K27-D96 IonicContact NZ-OD1 3.46Å; K27-D96 PolarHBondContact NZ-OD1 2.88Å; K27-D96 IonicContact NZ-OD2 3.1Å; K27-D96 PolarHBondContact NZ-OD2 3.38Å; D92-D96 WeakPolarHBondContact O-CB 3.5Å; D92-D96 PolarHBondContact O-N 3.3Å; I93-D96 PolarHBondContact O-N 2.98Å; C94-D96 VanDerWaalsContact C-N 3.27Å; C94-D96 PolarHBondContact O-N 3.1Å; D96-S99 PolarHBondContact O-N 2.9Å; D96-L100 WeakPolarHBondContact O-CG 3.17Å; D96-L100 PolarHBondContact O-N 3.02Å
97V98.3Very high98.3Very high2 Ų243.5 Ų43.51%0.01222%0.221CC..Hα-helixtrans-62.1-46.1175.4175.40000112.1Y48 I93 C94 S99 L100 L101 M121 Y125Y48-V97 HydrophobicContact CD1-CG2 3.07Å; Y48-V97 HydrophobicContact CD2-CG2 3.75Å; Y48-V97 HydrophobicContact CE1-CG2 3.37Å; Y48-V97 HydrophobicContact CE2-CG2 4.02Å; Y48-V97 HydrophobicContact CG-CG2 3.25Å; I93-V97 WeakPolarHBondContact O-CG2 3.34Å; I93-V97 PolarHBondContact O-N 2.88Å; C94-V97 PolarHBondContact O-N 3.4Å; V97-S99 VanDerWaalsContact C-N 3.29Å; V97-S99 PolarHBondContact O-N 3.47Å; V97-L100 WeakPolarHBondContact O-CB 3.45Å; V97-L100 PolarHBondContact O-N 3.13Å; V97-L100 VanDerWaalsContact O-N 3.1Å; V97-L101 HydrophobicContact CG1-CD1 3.68Å; V97-L101 HydrophobicContact CG1-CG 4.16Å; V97-L101 VanDerWaalsContact O-CG 3.31Å; V97-L101 WeakPolarHBondContact O-CG 3.41Å; V97-L101 PolarHBondContact O-N 3.06Å; V97-M121 HydrophobicContact CG1-CE 3.67Å; V97-Y125 HydrophobicContact CB-CD1 4.07Å; V97-Y125 HydrophobicContact CB-CD2 4.3Å; V97-Y125 HydrophobicContact CB-CE1 4.11Å; V97-Y125 HydrophobicContact CB-CE2 4.4Å; V97-Y125 HydrophobicContact CB-CG 4.18Å; V97-Y125 HydrophobicContact CG1-CD1 4.19Å; V97-Y125 HydrophobicContact CG1-CD2 3.53Å; V97-Y125 HydrophobicContact CG1-CE1 4.18Å; V97-Y125 HydrophobicContact CG1-CE2 3.59Å; V97-Y125 HydrophobicContact CG1-CG 3.89Å; V97-Y125 HydrophobicContact CG2-CD1 4.24Å; V97-Y125 HydrophobicContact CG2-CE1 3.8Å; V97-Y125 HydrophobicContact CG2-CE2 4.48Å
98L98.8Very high98.2Very high4 Ų445.8 Ų45.82%0.02123%0.233CC..Hα-helixtrans-60.1-41.6179.2-71.3170.8000111C94 N95 L100 L101 E102 K122 Y126 L129C94-L98 WeakPolarHBondContact O-CB 3.46Å; C94-L98 WeakPolarHBondContact O-CG 2.99Å; C94-L98 PolarHBondContact O-N 3.4Å; N95-L98 PolarHBondContact O-N 2.8Å; L98-L100 VanDerWaalsContact C-N 3.35Å; L98-L100 PolarHBondContact O-N 3.29Å; L98-L101 HydrophobicContact CD2-CD1 4.46Å; L98-L101 PolarHBondContact O-N 3.16Å; L98-E102 WeakPolarHBondContact O-CB 3.05Å; L98-E102 VanDerWaalsContact O-CG 3.32Å; L98-E102 WeakPolarHBondContact O-CG 3.25Å; L98-E102 PolarHBondContact O-N 3.04Å; L98-K122 HydrophobicContact CD2-CG 3.92Å; L98-Y126 HydrophobicContact CD1-CD1 3.96Å; L98-Y126 HydrophobicContact CD1-CD2 4.36Å; L98-Y126 HydrophobicContact CD1-CE1 3.7Å; L98-Y126 HydrophobicContact CD1-CE2 4.09Å; L98-Y126 HydrophobicContact CD1-CG 4.28Å; L98-Y126 HydrophobicContact CD2-CD2 3.65Å; L98-Y126 HydrophobicContact CD2-CE2 3.45Å; L98-Y126 VanDerWaalsContact CD2-CE2 3.45Å; L98-Y126 HydrophobicContact CD2-CG 4.27Å; L98-Y126 HydrophobicContact CG-CE2 4.36Å; L98-L129 HydrophobicContact CD1-CD1 3.61Å
99S98.6Very high98.1Very high30 Ų3043.5 Ų43.521%0.2122%0.221CC..Hα-helixtrans-60.8-41.6173.4172.10000112N95 D96 V97 K103N95-S99 VanDerWaalsContact O-CB 3.32Å; N95-S99 WeakPolarHBondContact O-CB 3.46Å; N95-S99 PolarHBondContact O-N 3.12Å; D96-S99 PolarHBondContact O-N 2.9Å; V97-S99 VanDerWaalsContact C-N 3.29Å; V97-S99 PolarHBondContact O-N 3.47Å; S99-K103 VanDerWaalsContact O-CB 3.26Å; S99-K103 WeakPolarHBondContact O-CB 3.39Å; S99-K103 WeakPolarHBondContact O-CG 3.23Å; S99-K103 PolarHBondContact O-N 3.25Å; S99-K103 PolarHBondContact OG-NZ 2.83Å
100L98.7Very high98Very high1 Ų144.8 Ų44.81%0.00524%0.237CC..Hα-helixtrans-64.4-43.8175.6-66.8175.5000112.2K27 T30 E31 L44 Y48 D96 V97 L98 F104 L105K27-L100 HydrophobicContact CB-CD1 4.17Å; K27-L100 HydrophobicContact CG-CD1 4.05Å; K27-L100 HydrophobicContact CG-CD2 4.13Å; T30-L100 HydrophobicContact CG2-CB 4.17Å; T30-L100 HydrophobicContact CG2-CD2 3.97Å; T30-L100 HydrophobicContact CG2-CG 4.49Å; E31-L100 HydrophobicContact CG-CD2 3.74Å; L44-L100 HydrophobicContact CD1-CD1 4.43Å; Y48-L100 HydrophobicContact CE2-CD1 3.98Å; D96-L100 WeakPolarHBondContact O-CG 3.17Å; D96-L100 PolarHBondContact O-N 3.02Å; V97-L100 WeakPolarHBondContact O-CB 3.45Å; V97-L100 PolarHBondContact O-N 3.13Å; V97-L100 VanDerWaalsContact O-N 3.1Å; L98-L100 VanDerWaalsContact C-N 3.35Å; L98-L100 PolarHBondContact O-N 3.29Å; L100-F104 HydrophobicContact CD2-CD2 4.04Å; L100-F104 HydrophobicContact CD2-CE2 4.28Å; L100-F104 PolarHBondContact O-N 3.03Å; L100-L105 HydrophobicContact CB-CD1 4.36Å; L100-L105 PolarHBondContact O-N 3.21Å; L100-L105 VanDerWaalsContact O-N 3.13Å
101L98.7Very high98Very high0 Ų049.8 Ų49.80%026%0.261CS..Iπ-helixtrans-61.7-47.5179.2-70.8165.9000111.5V97 L98 L105 I106 Y118 M121 K122V97-L101 HydrophobicContact CG1-CD1 3.68Å; V97-L101 HydrophobicContact CG1-CG 4.16Å; V97-L101 VanDerWaalsContact O-CG 3.31Å; V97-L101 WeakPolarHBondContact O-CG 3.41Å; V97-L101 PolarHBondContact O-N 3.06Å; L98-L101 HydrophobicContact CD2-CD1 4.46Å; L98-L101 PolarHBondContact O-N 3.16Å; L101-L105 HydrophobicContact CD2-CB 4.33Å; L101-L105 HydrophobicContact CD2-CD1 3.74Å; L101-L105 HydrophobicContact CG-CD1 4.26Å; L101-L105 PolarHBondContact O-N 3.24Å; L101-I106 HydrophobicContact CB-CD1 4.1Å; L101-I106 HydrophobicContact CB-CG1 4.47Å; L101-I106 WeakPolarHBondContact O-CB 3.4Å; L101-I106 WeakPolarHBondContact O-CG1 3.35Å; L101-I106 PolarHBondContact O-N 2.67Å; L101-Y118 HydrophobicContact CD2-CD1 3.82Å; L101-Y118 HydrophobicContact CD2-CG 4.14Å; L101-M121 HydrophobicContact CD1-CB 4.26Å; L101-M121 HydrophobicContact CD1-CG 4.12Å; L101-M121 HydrophobicContact CD2-CB 4.23Å; L101-M121 HydrophobicContact CD2-CG 4.36Å; L101-M121 HydrophobicContact CD2-SD 4.09Å; L101-K122 HydrophobicContact CD1-CB 4.02Å
102E98.4Very high97.9Very high81 Ų8147 Ų4738%0.37926%0.257SS..Iπ-helixtrans-75.5-34.4-174.9-69.6176.8168.100113.1L98 P107 K122 Y126L98-E102 WeakPolarHBondContact O-CB 3.05Å; L98-E102 VanDerWaalsContact O-CG 3.32Å; L98-E102 WeakPolarHBondContact O-CG 3.25Å; L98-E102 PolarHBondContact O-N 3.04Å; E102-P107 WeakPolarHBondContact O-CD 3.32Å; E102-P107 WeakPolarHBondContact O-CG 3.12Å; E102-K122 WeakPolarHBondContact OE1-CE 3.41Å; E102-K122 IonicContact OE1-NZ 2.89Å; E102-K122 PolarHBondContact OE1-NZ 3.49Å; E102-Y126 PolarHBondContact OE1-OH 2.91Å
103K98.2Very high97.8Very high137 Ų13744.7 Ų44.760%0.59624%0.243SC*.Iπ-helixtrans-90.8-34.1-176.1-65.8174.3-176.4158.50114.1S99S99-K103 VanDerWaalsContact O-CB 3.26Å; S99-K103 WeakPolarHBondContact O-CB 3.39Å; S99-K103 WeakPolarHBondContact O-CG 3.23Å; S99-K103 PolarHBondContact O-N 3.25Å; S99-K103 PolarHBondContact OG-NZ 2.83Å
104F98.4Very high97.8Very high51 Ų5143.7 Ų43.722%0.22424%0.238CC..Iπ-helixtrans-124.6-37.8-168-57.7-79.9000114T30 E31 L100 N108T30-F104 HydrophobicContact CG2-CB 3.8Å; T30-F104 HydrophobicContact CG2-CD2 4.49Å; T30-F104 HydrophobicContact CG2-CG 4.38Å; E31-F104 HydrophobicContact CB-CE2 4.49Å; E31-F104 HydrophobicContact CB-CZ 4.27Å; E31-F104 HydrophobicContact CG-CE2 3.9Å; E31-F104 HydrophobicContact CG-CZ 4.12Å; L100-F104 HydrophobicContact CD2-CD2 4.04Å; L100-F104 HydrophobicContact CD2-CE2 4.28Å; L100-F104 PolarHBondContact O-N 3.03Å; F104-N108 VanDerWaalsContact O-CB 3.25Å; F104-N108 WeakPolarHBondContact O-CB 3.47Å; F104-N108 PolarHBondContact O-ND2 3.28Å
105L98.6Very high97.8Very high7 Ų747 Ų474%0.03725%0.253CS..Iπ-helixtrans-92-54-168.2-58.8166.5000112.9T30 L36 L44 L100 L101 N108 A109 Y118T30-L105 HydrophobicContact CG2-CD1 4.1Å; T30-L105 HydrophobicContact CG2-CD2 3.58Å; T30-L105 HydrophobicContact CG2-CG 3.73Å; L36-L105 HydrophobicContact CD1-CD2 3.57Å; L36-L105 HydrophobicContact CG-CD2 3.83Å; L44-L105 HydrophobicContact CD2-CD1 3.46Å; L44-L105 VanDerWaalsContact CD2-CD1 3.46Å; L44-L105 HydrophobicContact CD2-CD2 4.36Å; L100-L105 HydrophobicContact CB-CD1 4.36Å; L100-L105 PolarHBondContact O-N 3.21Å; L100-L105 VanDerWaalsContact O-N 3.13Å; L101-L105 HydrophobicContact CD2-CB 4.33Å; L101-L105 HydrophobicContact CD2-CD1 3.74Å; L101-L105 HydrophobicContact CG-CD1 4.26Å; L101-L105 PolarHBondContact O-N 3.24Å; L105-N108 PolarHBondContact O-N 3.08Å; L105-A109 WeakPolarHBondContact O-CB 3.44Å; L105-A109 PolarHBondContact O-N 3Å; L105-Y118 HydrophobicContact CB-CD1 3.84Å; L105-Y118 HydrophobicContact CB-CD2 3.82Å; L105-Y118 HydrophobicContact CB-CE1 3.89Å; L105-Y118 HydrophobicContact CB-CE2 3.9Å; L105-Y118 HydrophobicContact CB-CG 3.83Å; L105-Y118 HydrophobicContact CD1-CD1 4.07Å; L105-Y118 HydrophobicContact CD1-CE1 3.97Å; L105-Y118 HydrophobicContact CD2-CE1 3.94Å; L105-Y118 HydrophobicContact CD2-CE2 4.47Å; L105-Y118 HydrophobicContact CG-CD1 4.41Å; L105-Y118 HydrophobicContact CG-CE1 4.15Å
106I98.4Very high97.8Very high31 Ų3143.4 Ų43.416%0.15923%0.233CC..Hα-helixtrans-63.8-44.7-179.6-63.7167.9000111.2L101 N108 A109 L119 K122L101-I106 HydrophobicContact CB-CD1 4.1Å; L101-I106 HydrophobicContact CB-CG1 4.47Å; L101-I106 WeakPolarHBondContact O-CB 3.4Å; L101-I106 WeakPolarHBondContact O-CG1 3.35Å; L101-I106 PolarHBondContact O-N 2.67Å; I106-N108 VanDerWaalsContact C-N 3.31Å; I106-N108 PolarHBondContact O-N 3.35Å; I106-A109 PolarHBondContact O-N 3.27Å; I106-L119 HydrophobicContact CD1-CD2 4.04Å; I106-L119 HydrophobicContact CG2-CD2 4.48Å; I106-K122 HydrophobicContact CD1-CB 4.33Å; I106-K122 HydrophobicContact CD1-CD 3.81Å
107P97.7Very high97.8Very high85 Ų8542.5 Ų42.555%0.55223%0.227SC*.Hα-helixtrans-66.1-29.9179.2-23.235.4000114.3E102E102-P107 WeakPolarHBondContact O-CD 3.32Å; E102-P107 WeakPolarHBondContact O-CG 3.12Å
108N96Very high97.9Very high67 Ų6742.5 Ų42.536%0.35823%0.227SC..Hα-helixtrans-96.9-0.6-177.4-65.7-36.3000113.7G33 F104 L105 I106 S110G33-N108 PolarHBondContact O-ND2 3.24Å; G33-N108 VanDerWaalsContact O-ND2 3.15Å; F104-N108 VanDerWaalsContact O-CB 3.25Å; F104-N108 WeakPolarHBondContact O-CB 3.47Å; F104-N108 PolarHBondContact O-ND2 3.28Å; L105-N108 PolarHBondContact O-N 3.08Å; I106-N108 VanDerWaalsContact C-N 3.31Å; I106-N108 PolarHBondContact O-N 3.35Å; N108-S110 PolarHBondContact O-N 2.85Å; N108-S110 VanDerWaalsContact O-N 3.15Å
109A97.2Very high97.9Very high18 Ų1842.4 Ų42.415%0.14923%0.226CC..  trans-70.4108.6178.400000110.6E35 L105 I106 K115 Y118E35-A109 WeakPolarHBondContact OE1-CA 2.98Å; L105-A109 WeakPolarHBondContact O-CB 3.44Å; L105-A109 PolarHBondContact O-N 3Å; I106-A109 PolarHBondContact O-N 3.27Å; A109-K115 HydrophobicContact CB-CB 4.1Å; A109-Y118 HydrophobicContact CB-CD2 3.96Å; A109-Y118 HydrophobicContact CB-CE2 4.1Å
110S95.9Very high97.9Very high92 Ų9242.8 Ų42.864%0.64322%0.224SC*.  trans-84-26.9-179.263.30000112.9E35 N108E35-S110 VanDerWaalsContact CD-OG 3.24Å; E35-S110 PolarHBondContact OE1-N 3.44Å; E35-S110 PolarHBondContact OE1-OG 3.43Å; E35-S110 VanDerWaalsContact OE1-OG 3.05Å; E35-S110 VanDerWaalsContact OE2-CB 3.3Å; E35-S110 WeakPolarHBondContact OE2-CB 3.44Å; E35-S110 PolarHBondContact OE2-OG 3.43Å; N108-S110 PolarHBondContact O-N 2.85Å; N108-S110 VanDerWaalsContact O-N 3.15Å
111Q96.1Very high97.9Very high105 Ų10543 Ų4349%0.49123%0.226SC..SBendtrans-101.9144.6-178.9-62-175.5-13.900112.2E113 S114 K115Q111-E113 PolarHBondContact O-N 2.73Å; Q111-S114 PolarHBondContact O-N 3.43Å; Q111-K115 PolarHBondContact O-N 2.98Å
112A96.5Very high97.9Very high33 Ų3344.8 Ų44.827%0.27323%0.233SC..Hα-helixtrans-56.3-39.9175.800000111.8K115 V116 I155 E159A112-K115 PolarHBondContact O-N 2.98Å; A112-V116 VanDerWaalsContact O-CG2 3.31Å; A112-V116 WeakPolarHBondContact O-CG2 3.49Å; A112-V116 PolarHBondContact O-N 3.43Å; A112-I155 HydrophobicContact CB-CG2 4.16Å; A112-E159 HydrophobicContact CB-CB 3.71Å; A112-E159 HydrophobicContact CB-CG 3.92Å
113E96.7Very high97.9Very high49 Ų4940.9 Ų40.923%0.22922%0.215CC..Hα-helixtrans-57.7-52.5177.2-169.4-163.6129.400111.9R41 Q111 K115 V116 F117 M160 H164 I166R41-E113 IonicContact CZ-OE1 2.92Å; R41-E113 IonicContact NH1-OE1 3.65Å; R41-E113 PolarHBondContact NH1-OE1 2.87Å; R41-E113 IonicContact NH2-OE1 2.68Å; R41-E113 PolarHBondContact NH2-OE1 3.29Å; Q111-E113 PolarHBondContact O-N 2.73Å; E113-K115 VanDerWaalsContact C-N 3.32Å; E113-K115 PolarHBondContact O-N 2.71Å; E113-V116 PolarHBondContact O-N 3.18Å; E113-F117 WeakPolarHBondContact O-CB 3.4Å; E113-F117 PolarHBondContact O-N 2.89Å; E113-M160 HydrophobicContact CG-CE 4.4Å; E113-H164 IonicContact OE2-NE2 2.63Å; E113-I166 HydrophobicContact CG-CD1 3.36Å; E113-I166 VanDerWaalsContact OE1-CD1 3.3Å; E113-I166 WeakPolarHBondContact OE1-CD1 3.28Å
114S97.9Very high97.9Very high1 Ų134.8 Ų34.81%0.00719%0.189CC..Hα-helixtrans-61.1-41.4177.6-68.40000111.6Q111 F117 Y118Q111-S114 PolarHBondContact O-N 3.43Å; S114-F117 WeakPolarHBondContact O-CB 3.49Å; S114-F117 PolarHBondContact O-N 3.31Å; S114-Y118 WeakPolarHBondContact O-CD2 3.36Å; S114-Y118 VanDerWaalsContact O-CG 3.31Å; S114-Y118 PolarHBondContact O-N 3.49Å
115K98.3Very high97.9Very high70 Ų7032.7 Ų32.730%0.30418%0.18SC..Hα-helixtrans-63.5-46.5178.3-172.2169.2177.9-174.70111.9A109 Q111 A112 E113 F117 Y118 L119 E151 I155A109-K115 HydrophobicContact CB-CB 4.1Å; Q111-K115 PolarHBondContact O-N 2.98Å; A112-K115 PolarHBondContact O-N 2.98Å; E113-K115 VanDerWaalsContact C-N 3.32Å; E113-K115 PolarHBondContact O-N 2.71Å; K115-F117 VanDerWaalsContact C-N 3.34Å; K115-F117 PolarHBondContact O-N 3.38Å; K115-Y118 PolarHBondContact O-N 3.13Å; K115-L119 HydrophobicContact CG-CD1 3.85Å; K115-L119 HydrophobicContact CG-CG 4.46Å; K115-L119 WeakPolarHBondContact O-CB 3.48Å; K115-L119 VanDerWaalsContact O-CG 3.32Å; K115-L119 WeakPolarHBondContact O-CG 3.49Å; K115-L119 PolarHBondContact O-N 3.35Å; K115-E151 WeakPolarHBondContact CE-OE1 3.39Å; K115-E151 IonicContact NZ-OE1 3.49Å; K115-E151 PolarHBondContact NZ-OE1 3.27Å; K115-I155 HydrophobicContact CD-CD1 3.73Å; K115-I155 HydrophobicContact CG-CD1 3.97Å
116V98.7Very high97.9Very high0 Ų033.9 Ų33.90%018%0.184CC..Hα-helixtrans-62.9-41.8175.8174.70000110.7A112 E113 Y118 L119 K120 A152 I155 M160 I166 L170A112-V116 VanDerWaalsContact O-CG2 3.31Å; A112-V116 WeakPolarHBondContact O-CG2 3.49Å; A112-V116 PolarHBondContact O-N 3.43Å; E113-V116 PolarHBondContact O-N 3.18Å; V116-Y118 PolarHBondContact O-N 2.86Å; V116-L119 PolarHBondContact O-N 3Å; V116-K120 WeakPolarHBondContact O-CB 3.25Å; V116-K120 PolarHBondContact O-N 3.39Å; V116-A152 HydrophobicContact CG1-CB 4.34Å; V116-I155 HydrophobicContact CG2-CB 3.77Å; V116-I155 HydrophobicContact CG2-CG2 3.53Å; V116-M160 HydrophobicContact CB-SD 4.01Å; V116-M160 HydrophobicContact CG1-SD 3.98Å; V116-M160 HydrophobicContact CG2-SD 3.84Å; V116-I166 HydrophobicContact CB-CG2 4.3Å; V116-I166 HydrophobicContact CG1-CG2 3.73Å; V116-L170 HydrophobicContact CG1-CD2 4.06Å
117F98.5Very high97.9Very high29 Ų2932.9 Ų32.913%0.12718%0.178CC..Hα-helixtrans-57.6-50.1176.9-171.9-80000111.7R41 E113 S114 K115 M121 I166R41-F117 VanDerWaalsContact CD-CD1 3.5Å; R41-F117 HydrophobicContact CG-CD1 3.61Å; R41-F117 HydrophobicContact CG-CE1 3.45Å; R41-F117 VanDerWaalsContact CG-CE1 3.45Å; R41-F117 HydrophobicContact CG-CE2 4.48Å; R41-F117 HydrophobicContact CG-CG 4.21Å; R41-F117 HydrophobicContact CG-CZ 3.92Å; E113-F117 WeakPolarHBondContact O-CB 3.4Å; E113-F117 PolarHBondContact O-N 2.89Å; S114-F117 WeakPolarHBondContact O-CB 3.49Å; S114-F117 PolarHBondContact O-N 3.31Å; K115-F117 VanDerWaalsContact C-N 3.34Å; K115-F117 PolarHBondContact O-N 3.38Å; F117-M121 HydrophobicContact CE1-SD 4.38Å; F117-M121 WeakPolarHBondContact O-CB 3.28Å; F117-M121 PolarHBondContact O-N 2.87Å; F117-I166 HydrophobicContact CB-CD1 4.41Å; F117-I166 HydrophobicContact CD2-CD1 3.8Å; F117-I166 HydrophobicContact CD2-CG1 4.1Å
118Y98.8Very high98Very high1 Ų130 Ų300%0.00416%0.156CC..Hα-helixtrans-71.3-37.4-178.8-62-46000113.1R41 L101 L105 A109 S114 K115 V116 M121 K122R41-Y118 HydrophobicContact CG-CE1 3.68Å; L101-Y118 HydrophobicContact CD2-CD1 3.82Å; L101-Y118 HydrophobicContact CD2-CG 4.14Å; L105-Y118 HydrophobicContact CB-CD1 3.84Å; L105-Y118 HydrophobicContact CB-CD2 3.82Å; L105-Y118 HydrophobicContact CB-CE1 3.89Å; L105-Y118 HydrophobicContact CB-CE2 3.9Å; L105-Y118 HydrophobicContact CB-CG 3.83Å; L105-Y118 HydrophobicContact CD1-CD1 4.07Å; L105-Y118 HydrophobicContact CD1-CE1 3.97Å; L105-Y118 HydrophobicContact CD2-CE1 3.94Å; L105-Y118 HydrophobicContact CD2-CE2 4.47Å; L105-Y118 HydrophobicContact CG-CD1 4.41Å; L105-Y118 HydrophobicContact CG-CE1 4.15Å; A109-Y118 HydrophobicContact CB-CD2 3.96Å; A109-Y118 HydrophobicContact CB-CE2 4.1Å; S114-Y118 WeakPolarHBondContact O-CD2 3.36Å; S114-Y118 VanDerWaalsContact O-CG 3.31Å; S114-Y118 PolarHBondContact O-N 3.49Å; K115-Y118 PolarHBondContact O-N 3.13Å; V116-Y118 PolarHBondContact O-N 2.86Å; Y118-M121 WeakPolarHBondContact O-CB 3.3Å; Y118-M121 PolarHBondContact O-N 3.28Å; Y118-K122 WeakPolarHBondContact O-CB 3.41Å; Y118-K122 PolarHBondContact O-N 3.25Å
119L98.9Very high98Very high2 Ų227.2 Ų27.21%0.0114%0.141CC..Hα-helixtrans-67.7-41175.5-73.7168.1000111.9I106 K115 V116 M121 K122 G123 E151 A152 I155I106-L119 HydrophobicContact CD1-CD2 4.04Å; I106-L119 HydrophobicContact CG2-CD2 4.48Å; K115-L119 HydrophobicContact CG-CD1 3.85Å; K115-L119 HydrophobicContact CG-CG 4.46Å; K115-L119 WeakPolarHBondContact O-CB 3.48Å; K115-L119 VanDerWaalsContact O-CG 3.32Å; K115-L119 WeakPolarHBondContact O-CG 3.49Å; K115-L119 PolarHBondContact O-N 3.35Å; V116-L119 PolarHBondContact O-N 3Å; L119-M121 VanDerWaalsContact C-N 3.3Å; L119-M121 PolarHBondContact O-N 2.95Å; L119-K122 WeakPolarHBondContact O-CB 3.24Å; L119-K122 PolarHBondContact O-N 3.37Å; L119-G123 PolarHBondContact O-N 3.13Å; L119-E151 HydrophobicContact CD1-CB 4.1Å; L119-E151 HydrophobicContact CD1-CG 3.71Å; L119-E151 HydrophobicContact CD2-CB 4.45Å; L119-E151 HydrophobicContact CD2-CG 4.45Å; L119-A152 HydrophobicContact CB-CB 3.66Å; L119-I155 HydrophobicContact CD1-CD1 3.73Å
120K98.7Very high98Very high38 Ų3826.3 Ų26.317%0.16513%0.134CC..Hα-helixtrans-56.6-47.8170.2177.6-168.6169.2-67.40110.5V116 K122 G123 D124 G169 L170 N173V116-K120 WeakPolarHBondContact O-CB 3.25Å; V116-K120 PolarHBondContact O-N 3.39Å; K120-K122 VanDerWaalsContact C-N 3.35Å; K120-K122 PolarHBondContact O-N 3.45Å; K120-G123 PolarHBondContact O-N 3.23Å; K120-D124 IonicContact NZ-OD2 3.01Å; K120-D124 PolarHBondContact NZ-OD2 2.78Å; K120-D124 VanDerWaalsContact O-CG 3.29Å; K120-D124 PolarHBondContact O-N 2.86Å; K120-G169 WeakPolarHBondContact CE-O 3.48Å; K120-L170 HydrophobicContact CB-CD1 4.01Å; K120-L170 HydrophobicContact CD-CB 4.09Å; K120-L170 HydrophobicContact CG-CB 4.3Å; K120-L170 HydrophobicContact CG-CD1 3.99Å; K120-N173 WeakPolarHBondContact CE-ND2 3.37Å; K120-N173 PolarHBondContact NZ-ND2 2.56Å
121M98.7Very high98Very high7 Ų723.8 Ų23.83%0.03411%0.112CC..Hα-helixtrans-59.8-45.3177.2-165.6174.2173.700110.7V97 L101 F117 Y118 L119 G123 D124 Y125V97-M121 HydrophobicContact CG1-CE 3.67Å; L101-M121 HydrophobicContact CD1-CB 4.26Å; L101-M121 HydrophobicContact CD1-CG 4.12Å; L101-M121 HydrophobicContact CD2-CB 4.23Å; L101-M121 HydrophobicContact CD2-CG 4.36Å; L101-M121 HydrophobicContact CD2-SD 4.09Å; F117-M121 HydrophobicContact CE1-SD 4.38Å; F117-M121 WeakPolarHBondContact O-CB 3.28Å; F117-M121 PolarHBondContact O-N 2.87Å; Y118-M121 WeakPolarHBondContact O-CB 3.3Å; Y118-M121 PolarHBondContact O-N 3.28Å; L119-M121 VanDerWaalsContact C-N 3.3Å; L119-M121 PolarHBondContact O-N 2.95Å; M121-G123 VanDerWaalsContact C-N 3.33Å; M121-G123 PolarHBondContact O-N 3.13Å; M121-D124 WeakPolarHBondContact O-CA 3.5Å; M121-D124 WeakPolarHBondContact O-CB 3.49Å; M121-D124 PolarHBondContact O-N 2.91Å; M121-Y125 HydrophobicContact CE-CD2 4.48Å; M121-Y125 HydrophobicContact CE-CE2 3.59Å; M121-Y125 HydrophobicContact CG-CD2 3.81Å; M121-Y125 HydrophobicContact CG-CE2 3.53Å; M121-Y125 WeakPolarHBondContact O-CD2 3.43Å; M121-Y125 PolarHBondContact O-N 3.23Å; M121-Y125 HydrophobicContact SD-CE2 4.41Å
122K98.8Very high97.9Very high36 Ų3619.3 Ų19.316%0.1579%0.092CC..Hα-helixtrans-55.3-47.2174.8-176.1176.8-178.3173.30111.6L98 L101 E102 I106 Y118 L119 K120 D124 Y125 Y126 A148L98-K122 HydrophobicContact CD2-CG 3.92Å; L101-K122 HydrophobicContact CD1-CB 4.02Å; E102-K122 WeakPolarHBondContact OE1-CE 3.41Å; E102-K122 IonicContact OE1-NZ 2.89Å; E102-K122 PolarHBondContact OE1-NZ 3.49Å; I106-K122 HydrophobicContact CD1-CB 4.33Å; I106-K122 HydrophobicContact CD1-CD 3.81Å; Y118-K122 WeakPolarHBondContact O-CB 3.41Å; Y118-K122 PolarHBondContact O-N 3.25Å; L119-K122 WeakPolarHBondContact O-CB 3.24Å; L119-K122 PolarHBondContact O-N 3.37Å; K120-K122 VanDerWaalsContact C-N 3.35Å; K120-K122 PolarHBondContact O-N 3.45Å; K122-D124 PolarHBondContact O-N 2.93Å; K122-Y125 PolarHBondContact O-N 3.45Å; K122-Y126 HydrophobicContact CD-CE2 4.31Å; K122-Y126 VanDerWaalsContact CE-CE2 3.49Å; K122-Y126 HydrophobicContact CG-CD2 3.87Å; K122-Y126 HydrophobicContact CG-CE2 3.76Å; K122-Y126 VanDerWaalsContact O-CD2 3.31Å; K122-Y126 WeakPolarHBondContact O-CD2 3.21Å; K122-Y126 PolarHBondContact O-N 3.36Å; K122-Y126 VanDerWaalsContact O-N 3.08Å; K122-A148 HydrophobicContact CB-CB 4.03Å; K122-A148 HydrophobicContact CD-CB 4.09Å; K122-A148 HydrophobicContact CG-CB 3.88Å
123G98.8Very high97.7Very high0 Ų018.5 Ų18.50%09%0.086CC..Hα-helixtrans-58.1-44.8173.500000112.5L119 K120 M121 Y125 Y126 R127 S145 Y149L119-G123 PolarHBondContact O-N 3.13Å; K120-G123 PolarHBondContact O-N 3.23Å; M121-G123 VanDerWaalsContact C-N 3.33Å; M121-G123 PolarHBondContact O-N 3.13Å; G123-Y125 PolarHBondContact O-N 3.03Å; G123-Y126 PolarHBondContact O-N 2.81Å; G123-R127 VanDerWaalsContact O-CB 3.3Å; G123-R127 WeakPolarHBondContact O-CB 3.46Å; G123-R127 PolarHBondContact O-N 2.99Å; G123-S145 PolarHBondContact O-OG 3.42Å; G123-S145 VanDerWaalsContact O-OG 3.08Å; G123-Y149 VanDerWaalsContact C-CZ 3.4Å
124D98.8Very high97.1Very high9 Ų920.1 Ų20.15%0.04811%0.107CC..Hα-helixtrans-59.1-46177.8-69-35.1000112.7K120 M121 K122 R127 Y128 Y149 N173K120-D124 IonicContact NZ-OD2 3.01Å; K120-D124 PolarHBondContact NZ-OD2 2.78Å; K120-D124 VanDerWaalsContact O-CG 3.29Å; K120-D124 PolarHBondContact O-N 2.86Å; M121-D124 WeakPolarHBondContact O-CA 3.5Å; M121-D124 WeakPolarHBondContact O-CB 3.49Å; M121-D124 PolarHBondContact O-N 2.91Å; K122-D124 PolarHBondContact O-N 2.93Å; D124-R127 WeakPolarHBondContact O-CB 3.37Å; D124-R127 PolarHBondContact O-N 3.45Å; D124-R127 IonicContact OD1-NH2 3.98Å; D124-Y128 HydrophobicContact CB-CE2 4.15Å; D124-Y128 WeakPolarHBondContact O-CD1 3.28Å; D124-Y128 WeakPolarHBondContact O-CD2 3.46Å; D124-Y128 WeakPolarHBondContact O-CE2 3.31Å; D124-Y128 PolarHBondContact O-N 3.48Å; D124-Y149 VanDerWaalsContact CA-OH 3.3Å; D124-Y149 WeakPolarHBondContact CA-OH 3.16Å; D124-Y149 PolarHBondContact N-OH 2.89Å; D124-Y149 PolarHBondContact OD1-OH 2.73Å; D124-N173 VanDerWaalsContact OD1-CB 3.28Å; D124-N173 WeakPolarHBondContact OD1-CB 3.33Å; D124-N173 PolarHBondContact OD1-ND2 3.45Å; D124-N173 PolarHBondContact OD2-ND2 2.82Å
125Y98.7Very high96.4Very high6 Ų623.1 Ų23.12%0.02414%0.138CC..Hα-helixtrans-73-36.2-178.7-76.4-85.3000112.9Y48 K49 V52 C94 V97 M121 K122 G123 R127 Y128 L129Y48-Y125 WeakPolarHBondContact CB-OH 3.37Å; Y48-Y125 PolarHBondContact O-OH 3Å; K49-Y125 PolarHBondContact N-OH 3.01Å; V52-Y125 HydrophobicContact CB-CE1 4.11Å; V52-Y125 HydrophobicContact CG1-CE1 3.94Å; V52-Y125 HydrophobicContact CG2-CE1 4.31Å; C94-Y125 HydrophobicContact CB-CD1 4.1Å; V97-Y125 HydrophobicContact CB-CD1 4.07Å; V97-Y125 HydrophobicContact CB-CD2 4.3Å; V97-Y125 HydrophobicContact CB-CE1 4.11Å; V97-Y125 HydrophobicContact CB-CE2 4.4Å; V97-Y125 HydrophobicContact CB-CG 4.18Å; V97-Y125 HydrophobicContact CG1-CD1 4.19Å; V97-Y125 HydrophobicContact CG1-CD2 3.53Å; V97-Y125 HydrophobicContact CG1-CE1 4.18Å; V97-Y125 HydrophobicContact CG1-CE2 3.59Å; V97-Y125 HydrophobicContact CG1-CG 3.89Å; V97-Y125 HydrophobicContact CG2-CD1 4.24Å; V97-Y125 HydrophobicContact CG2-CE1 3.8Å; V97-Y125 HydrophobicContact CG2-CE2 4.48Å; M121-Y125 HydrophobicContact CE-CD2 4.48Å; M121-Y125 HydrophobicContact CE-CE2 3.59Å; M121-Y125 HydrophobicContact CG-CD2 3.81Å; M121-Y125 HydrophobicContact CG-CE2 3.53Å; M121-Y125 WeakPolarHBondContact O-CD2 3.43Å; M121-Y125 PolarHBondContact O-N 3.23Å; M121-Y125 HydrophobicContact SD-CE2 4.41Å; K122-Y125 PolarHBondContact O-N 3.45Å; G123-Y125 PolarHBondContact O-N 3.03Å; Y125-R127 VanDerWaalsContact C-N 3.33Å; Y125-Y128 HydrophobicContact CD1-CD2 4.04Å; Y125-Y128 HydrophobicContact CD1-CE2 4.48Å; Y125-Y128 HydrophobicContact CE1-CD2 4.34Å; Y125-Y128 HydrophobicContact CE1-CE2 4.48Å; Y125-Y128 HydrophobicContact CG-CD2 4.37Å; Y125-Y128 PolarHBondContact O-N 3.38Å; Y125-L129 WeakPolarHBondContact O-CG 3.19Å; Y125-L129 PolarHBondContact O-N 3.16Å
126Y98.7Very high95.4Very high32 Ų3227.3 Ų27.313%0.12516%0.164CC..Hα-helixtrans-65.7-36.9169.3-80.3-65000112.1L98 E102 K122 G123 Y128 L129 A130 I141 Q144L98-Y126 HydrophobicContact CD1-CD1 3.96Å; L98-Y126 HydrophobicContact CD1-CD2 4.36Å; L98-Y126 HydrophobicContact CD1-CE1 3.7Å; L98-Y126 HydrophobicContact CD1-CE2 4.09Å; L98-Y126 HydrophobicContact CD1-CG 4.28Å; L98-Y126 HydrophobicContact CD2-CD2 3.65Å; L98-Y126 HydrophobicContact CD2-CE2 3.45Å; L98-Y126 VanDerWaalsContact CD2-CE2 3.45Å; L98-Y126 HydrophobicContact CD2-CG 4.27Å; L98-Y126 HydrophobicContact CG-CE2 4.36Å; E102-Y126 PolarHBondContact OE1-OH 2.91Å; K122-Y126 HydrophobicContact CD-CE2 4.31Å; K122-Y126 VanDerWaalsContact CE-CE2 3.49Å; K122-Y126 HydrophobicContact CG-CD2 3.87Å; K122-Y126 HydrophobicContact CG-CE2 3.76Å; K122-Y126 VanDerWaalsContact O-CD2 3.31Å; K122-Y126 WeakPolarHBondContact O-CD2 3.21Å; K122-Y126 PolarHBondContact O-N 3.36Å; K122-Y126 VanDerWaalsContact O-N 3.08Å; G123-Y126 PolarHBondContact O-N 2.81Å; Y126-Y128 VanDerWaalsContact C-N 3.35Å; Y126-Y128 PolarHBondContact O-N 2.81Å; Y126-L129 HydrophobicContact CD1-CD1 4.13Å; Y126-L129 WeakPolarHBondContact O-CB 3.49Å; Y126-L129 PolarHBondContact O-N 2.99Å; Y126-A130 WeakPolarHBondContact O-CB 3.46Å; Y126-A130 PolarHBondContact O-N 3.45Å; Y126-I141 HydrophobicContact CD1-CG2 4.18Å; Y126-I141 WeakPolarHBondContact O-CG2 3.43Å; Y126-Q144 HydrophobicContact CD1-CB 3.74Å; Y126-Q144 HydrophobicContact CD1-CG 4.48Å; Y126-Q144 HydrophobicContact CD2-CB 3.76Å; Y126-Q144 HydrophobicContact CE1-CB 3.76Å; Y126-Q144 HydrophobicContact CE1-CG 4.07Å; Y126-Q144 HydrophobicContact CE2-CB 3.79Å; Y126-Q144 HydrophobicContact CE2-CG 4.44Å; Y126-Q144 HydrophobicContact CG-CB 3.75Å
127R98.3Very high94.7Very high11 Ų1133.3 Ų33.34%0.04220%0.196CC..Hα-helixtrans-60-43.2172.3172167.171.390.42.3112.2G123 D124 Y125 L129 A130 E131 Y149 F177 E180 I181G123-R127 VanDerWaalsContact O-CB 3.3Å; G123-R127 WeakPolarHBondContact O-CB 3.46Å; G123-R127 PolarHBondContact O-N 2.99Å; D124-R127 WeakPolarHBondContact O-CB 3.37Å; D124-R127 PolarHBondContact O-N 3.45Å; D124-R127 IonicContact OD1-NH2 3.98Å; Y125-R127 VanDerWaalsContact C-N 3.33Å; R127-L129 VanDerWaalsContact C-N 3.32Å; R127-L129 PolarHBondContact O-N 3.36Å; R127-A130 WeakPolarHBondContact O-CB 3.33Å; R127-A130 PolarHBondContact O-N 3.39Å; R127-E131 PolarHBondContact O-N 3.06Å; R127-Y149 PolarHBondContact NE-OH 3.02Å; R127-Y149 VanDerWaalsContact NE-OH 3.13Å; R127-F177 HydrophobicContact CB-CD2 4.28Å; R127-F177 HydrophobicContact CG-CD2 4.29Å; R127-E180 IonicContact NH1-OE2 2.7Å; R127-E180 PolarHBondContact NH1-OE2 3Å; R127-I181 HydrophobicContact CG-CD1 4.2Å; R127-I181 HydrophobicContact CG-CG1 3.78Å
128Y98.2Very high94.4Very high23 Ų2335.9 Ų35.99%0.0921%0.207CC..Hα-helixtrans-64.8-36.9176.1-55.8-30.3000112.3V52 R56 D124 Y125 Y126 E131V52-Y128 HydrophobicContact CG1-CD2 4Å; V52-Y128 HydrophobicContact CG1-CE2 3.85Å; V52-Y128 HydrophobicContact CG2-CD2 3.92Å; V52-Y128 HydrophobicContact CG2-CG 4.48Å; R56-Y128 VanDerWaalsContact CZ-CE1 3.46Å; D124-Y128 HydrophobicContact CB-CE2 4.15Å; D124-Y128 WeakPolarHBondContact O-CD1 3.28Å; D124-Y128 WeakPolarHBondContact O-CD2 3.46Å; D124-Y128 WeakPolarHBondContact O-CE2 3.31Å; D124-Y128 PolarHBondContact O-N 3.48Å; Y125-Y128 HydrophobicContact CD1-CD2 4.04Å; Y125-Y128 HydrophobicContact CD1-CE2 4.48Å; Y125-Y128 HydrophobicContact CE1-CD2 4.34Å; Y125-Y128 HydrophobicContact CE1-CE2 4.48Å; Y125-Y128 HydrophobicContact CG-CD2 4.37Å; Y125-Y128 PolarHBondContact O-N 3.38Å; Y126-Y128 VanDerWaalsContact C-N 3.35Å; Y126-Y128 PolarHBondContact O-N 2.81Å; Y128-E131 WeakPolarHBondContact O-CB 3.44Å; Y128-E131 PolarHBondContact O-N 3.3Å
129L97.8Very high94.2Very high9 Ų942.7 Ų42.75%0.04724%0.237CC..Hα-helixtrans-63.8-41.7170.7-72175.1000111.6L90 R91 C94 L98 Y125 Y126 R127 E131 V132 A133 I141L90-L129 HydrophobicContact CD2-CD2 4.45Å; R91-L129 HydrophobicContact CB-CD2 4.13Å; R91-L129 HydrophobicContact CG-CD2 3.95Å; C94-L129 HydrophobicContact CB-CD1 4.01Å; C94-L129 HydrophobicContact CB-CD2 3.65Å; C94-L129 HydrophobicContact CB-CG 3.63Å; L98-L129 HydrophobicContact CD1-CD1 3.61Å; Y125-L129 WeakPolarHBondContact O-CG 3.19Å; Y125-L129 PolarHBondContact O-N 3.16Å; Y126-L129 HydrophobicContact CD1-CD1 4.13Å; Y126-L129 WeakPolarHBondContact O-CB 3.49Å; Y126-L129 PolarHBondContact O-N 2.99Å; R127-L129 VanDerWaalsContact C-N 3.32Å; R127-L129 PolarHBondContact O-N 3.36Å; L129-E131 VanDerWaalsContact C-N 3.27Å; L129-E131 PolarHBondContact O-N 2.99Å; L129-V132 WeakPolarHBondContact O-CG2 3.32Å; L129-V132 PolarHBondContact O-N 3.45Å; L129-A133 VanDerWaalsContact O-CB 3.28Å; L129-A133 WeakPolarHBondContact O-CB 3.4Å; L129-A133 PolarHBondContact O-N 3.31Å; L129-I141 HydrophobicContact CB-CD1 4.38Å; L129-I141 HydrophobicContact CB-CG2 3.62Å
130A96.9Very high93.9Very high0 Ų044.2 Ų44.20%025%0.253CS..Hα-helixtrans-65.1-30.8-179.800000112.8Y126 R127 V132 K138 I141 V142 I181Y126-A130 WeakPolarHBondContact O-CB 3.46Å; Y126-A130 PolarHBondContact O-N 3.45Å; R127-A130 WeakPolarHBondContact O-CB 3.33Å; R127-A130 PolarHBondContact O-N 3.39Å; A130-V132 VanDerWaalsContact C-N 3.28Å; A130-V132 PolarHBondContact O-N 2.91Å; A130-K138 WeakPolarHBondContact O-CE 3.23Å; A130-I141 HydrophobicContact CB-CG2 3.84Å; A130-V142 HydrophobicContact CB-CG2 3.83Å; A130-I181 HydrophobicContact CB-CD1 4.34Å; A130-I181 HydrophobicContact CB-CG2 3.94Å
131E95.4Very high93.9Very high39 Ų3944 Ų4418%0.18225%0.254CS..Hα-helixtrans-61.1-36.6175.8-176.6175.5-165.100111.9R56 W59 R60 R127 Y128 L129 I181R56-E131 IonicContact CZ-OE2 2.82Å; R56-E131 IonicContact NE-OE2 2.68Å; R56-E131 PolarHBondContact NE-OE2 3.24Å; R56-E131 IonicContact NH2-OE1 3.69Å; R56-E131 IonicContact NH2-OE2 3.25Å; R56-E131 PolarHBondContact NH2-OE2 3.42Å; W59-E131 HydrophobicContact CH2-CG 4.13Å; W59-E131 HydrophobicContact CZ3-CG 3.78Å; R60-E131 IonicContact CZ-OE1 3.71Å; R60-E131 VanDerWaalsContact CZ-OE1 3.25Å; R60-E131 IonicContact NE-OE1 2.89Å; R60-E131 PolarHBondContact NE-OE1 2.91Å; R60-E131 VanDerWaalsContact NE-OE1 3.1Å; R60-E131 IonicContact NH2-OE1 2.95Å; R60-E131 PolarHBondContact NH2-OE1 2.89Å; R60-E131 IonicContact NH2-OE2 2.77Å; R60-E131 PolarHBondContact NH2-OE2 3.42Å; R127-E131 PolarHBondContact O-N 3.06Å; Y128-E131 WeakPolarHBondContact O-CB 3.44Å; Y128-E131 PolarHBondContact O-N 3.3Å; L129-E131 VanDerWaalsContact C-N 3.27Å; L129-E131 PolarHBondContact O-N 2.99Å; E131-I181 HydrophobicContact CB-CD1 4.49Å
132V94.6Very high93.8Very high10 Ų1044.6 Ų44.66%0.06126%0.257CS..Hα-helixtrans-104.9-6.8-177.4-54.10000114.1W59 E87 L90 L129 A130W59-V132 HydrophobicContact CD2-CG1 3.86Å; W59-V132 HydrophobicContact CE3-CG1 4.28Å; W59-V132 HydrophobicContact CG-CG1 4.27Å; W59-V132 HydrophobicContact CH2-CG1 4.34Å; W59-V132 HydrophobicContact CZ2-CB 4.4Å; W59-V132 HydrophobicContact CZ2-CG1 3.94Å; W59-V132 HydrophobicContact CZ3-CG1 4.5Å; E87-V132 HydrophobicContact CG-CB 4.07Å; E87-V132 HydrophobicContact CG-CG1 4.38Å; L90-V132 HydrophobicContact CD1-CG1 4.15Å; L90-V132 HydrophobicContact CD2-CG1 4.35Å; L90-V132 HydrophobicContact CD2-CG2 3.88Å; L129-V132 WeakPolarHBondContact O-CG2 3.32Å; L129-V132 PolarHBondContact O-N 3.45Å; A130-V132 VanDerWaalsContact C-N 3.28Å; A130-V132 PolarHBondContact O-N 2.91Å
133A92.5Very high93.8Very high17 Ų1747.8 Ų47.814%0.1427%0.273CS..  trans-74.6145.3-179.400000111.9L129 K138 I141L129-A133 VanDerWaalsContact O-CB 3.28Å; L129-A133 WeakPolarHBondContact O-CB 3.4Å; L129-A133 PolarHBondContact O-N 3.31Å; A133-K138 HydrophobicContact CB-CB 3.93Å; A133-K138 HydrophobicContact CB-CG 4.17Å; A133-I141 HydrophobicContact CB-CD1 3.76Å
134A83.5Confident93.7Very high82 Ų8250.8 Ų50.868%0.67829%0.287SS*.  trans-126.9155.8174.600000110.5
135G82.6Confident93.7Very high64 Ų6450.3 Ų50.366%0.6628%0.284SS*.THydrogen-bonded Turntrans66.1-151.6176.500000114.2D137 K138G135-D137 VanDerWaalsContact C-N 3.3Å; G135-D137 PolarHBondContact O-N 3.27Å; G135-K138 WeakPolarHBondContact O-CB 3.29Å; G135-K138 PolarHBondContact O-N 2.87Å
136D78.1Confident93.7Very high158 Ų15853.4 Ų53.485%0.84530%0.299SS*.THydrogen-bonded Turntrans-66-29.6-171.4-66.6-31.5000113.5K138 K139D136-K138 PolarHBondContact O-N 3.4Å; D136-K139 PolarHBondContact O-N 2.87Å
137D83.6Confident93.7Very high127 Ų12757.2 Ų57.268%0.67932%0.318SS*.Hα-helixtrans-59.5-31177.3-70-17000111.8G135 K139 G140 I141G135-D137 VanDerWaalsContact C-N 3.3Å; G135-D137 PolarHBondContact O-N 3.27Å; D137-K139 VanDerWaalsContact C-N 3.31Å; D137-K139 PolarHBondContact O-N 3.21Å; D137-G140 PolarHBondContact O-N 3.48Å; D137-I141 HydrophobicContact CB-CD1 4.49Å; D137-I141 WeakPolarHBondContact O-CD1 3.18Å; D137-I141 VanDerWaalsContact O-CG1 3.27Å; D137-I141 WeakPolarHBondContact O-CG1 3.5Å; D137-I141 PolarHBondContact O-N 3.2Å
138K92.2Very high93.7Very high82 Ų8256.9 Ų56.936%0.35732%0.318SS..Hα-helixtrans-60.5-40.3-178.9-173.1171.9-174.7165.60111.8A130 A133 G135 D136 G140 I141 V142A130-K138 WeakPolarHBondContact O-CE 3.23Å; A133-K138 HydrophobicContact CB-CB 3.93Å; A133-K138 HydrophobicContact CB-CG 4.17Å; G135-K138 WeakPolarHBondContact O-CB 3.29Å; G135-K138 PolarHBondContact O-N 2.87Å; D136-K138 PolarHBondContact O-N 3.4Å; K138-G140 PolarHBondContact O-N 3.1Å; K138-I141 PolarHBondContact O-N 3.38Å; K138-V142 HydrophobicContact CG-CG2 4.1Å; K138-V142 WeakPolarHBondContact O-CB 3.41Å; K138-V142 WeakPolarHBondContact O-CG2 3.33Å; K138-V142 PolarHBondContact O-N 3.03Å
139K93.5Very high93.8Very high144 Ų14455.8 Ų55.863%0.62631%0.313SS*.Hα-helixtrans-62.6-48.1-176.2-175.7-179.4174-1750111.6D136 D137 I141 V142 E143D136-K139 PolarHBondContact O-N 2.87Å; D137-K139 VanDerWaalsContact C-N 3.31Å; D137-K139 PolarHBondContact O-N 3.21Å; K139-I141 VanDerWaalsContact C-N 3.34Å; K139-I141 PolarHBondContact O-N 3.05Å; K139-V142 PolarHBondContact O-N 2.75Å; K139-E143 WeakPolarHBondContact CE-OE1 3.16Å; K139-E143 WeakPolarHBondContact O-CG 3.45Å; K139-E143 PolarHBondContact O-N 3.27Å
140G94.6Very high93.8Very high34 Ų3458.6 Ų58.635%0.35133%0.326SS..Hα-helixtrans-62.9-40.2178.600000112.4D137 K138 E143 Q144D137-G140 PolarHBondContact O-N 3.48Å; K138-G140 PolarHBondContact O-N 3.1Å; G140-E143 PolarHBondContact O-N 3.19Å; G140-Q144 WeakPolarHBondContact O-CG 3.13Å; G140-Q144 PolarHBondContact O-N 2.76Å
141I97.2Very high93.9Very high35 Ų3562.2 Ų62.218%0.17934%0.343CS..Hα-helixtrans-63.6-43.7176.5-66.3166.8000111.2Y126 L129 A130 A133 D137 K138 K139 Q144 S145Y126-I141 HydrophobicContact CD1-CG2 4.18Å; Y126-I141 WeakPolarHBondContact O-CG2 3.43Å; L129-I141 HydrophobicContact CB-CD1 4.38Å; L129-I141 HydrophobicContact CB-CG2 3.62Å; A130-I141 HydrophobicContact CB-CG2 3.84Å; A133-I141 HydrophobicContact CB-CD1 3.76Å; D137-I141 HydrophobicContact CB-CD1 4.49Å; D137-I141 WeakPolarHBondContact O-CD1 3.18Å; D137-I141 VanDerWaalsContact O-CG1 3.27Å; D137-I141 WeakPolarHBondContact O-CG1 3.5Å; D137-I141 PolarHBondContact O-N 3.2Å; K138-I141 PolarHBondContact O-N 3.38Å; K139-I141 VanDerWaalsContact C-N 3.34Å; K139-I141 PolarHBondContact O-N 3.05Å; I141-Q144 PolarHBondContact O-N 3.34Å; I141-S145 PolarHBondContact O-N 3Å
142V97.8Very high94Very high19 Ų1960.3 Ų60.312%0.11533%0.334CS..Hα-helixtrans-62.5-43.4177.31710000111.2A130 K138 K139 S145 Q146 F177 I181 L182A130-V142 HydrophobicContact CB-CG2 3.83Å; K138-V142 HydrophobicContact CG-CG2 4.1Å; K138-V142 WeakPolarHBondContact O-CB 3.41Å; K138-V142 WeakPolarHBondContact O-CG2 3.33Å; K138-V142 PolarHBondContact O-N 3.03Å; K139-V142 PolarHBondContact O-N 2.75Å; V142-S145 WeakPolarHBondContact O-CB 3.39Å; V142-S145 PolarHBondContact O-N 2.62Å; V142-Q146 WeakPolarHBondContact O-CB 3.39Å; V142-Q146 PolarHBondContact O-N 3.21Å; V142-F177 HydrophobicContact CG1-CE2 4.31Å; V142-F177 HydrophobicContact CG1-CZ 3.97Å; V142-I181 HydrophobicContact CG1-CG2 4.26Å; V142-I181 HydrophobicContact CG2-CG2 3.62Å; V142-L182 HydrophobicContact CG1-CD2 3.46Å; V142-L182 VanDerWaalsContact CG1-CD2 3.46Å
143E97.2Very high94.2Very high102 Ų10260.9 Ų60.948%0.47734%0.336SS..Hα-helixtrans-61.3-43.4176.2-73.4172.4-178.800111.7K139 G140 Q146 Q147K139-E143 WeakPolarHBondContact CE-OE1 3.16Å; K139-E143 WeakPolarHBondContact O-CG 3.45Å; K139-E143 PolarHBondContact O-N 3.27Å; G140-E143 PolarHBondContact O-N 3.19Å; E143-Q146 PolarHBondContact O-N 3.41Å; E143-Q147 WeakPolarHBondContact O-CB 3.26Å; E143-Q147 PolarHBondContact O-N 2.91Å
144Q98.2Very high94.5Very high63 Ų6364 Ų6429%0.29435%0.347SS..Hα-helixtrans-62.7-42.6175.5-71.2-58.6-4900112.5Y126 G140 I141 Q147 A148Y126-Q144 HydrophobicContact CD1-CB 3.74Å; Y126-Q144 HydrophobicContact CD1-CG 4.48Å; Y126-Q144 HydrophobicContact CD2-CB 3.76Å; Y126-Q144 HydrophobicContact CE1-CB 3.76Å; Y126-Q144 HydrophobicContact CE1-CG 4.07Å; Y126-Q144 HydrophobicContact CE2-CB 3.79Å; Y126-Q144 HydrophobicContact CE2-CG 4.44Å; Y126-Q144 HydrophobicContact CG-CB 3.75Å; G140-Q144 WeakPolarHBondContact O-CG 3.13Å; G140-Q144 PolarHBondContact O-N 2.76Å; I141-Q144 PolarHBondContact O-N 3.34Å; Q144-Q147 PolarHBondContact O-N 3.22Å; Q144-A148 WeakPolarHBondContact O-CB 3.14Å; Q144-A148 PolarHBondContact O-N 2.86Å
145S98.5Very high95.2Very high0 Ų061.5 Ų61.50%032%0.322CS..Hα-helixtrans-58.6-49.9174.8-175.60000111.1G123 I141 V142 A148 Y149 F177G123-S145 PolarHBondContact O-OG 3.42Å; G123-S145 VanDerWaalsContact O-OG 3.08Å; I141-S145 PolarHBondContact O-N 3Å; V142-S145 WeakPolarHBondContact O-CB 3.39Å; V142-S145 PolarHBondContact O-N 2.62Å; S145-A148 PolarHBondContact O-N 3.33Å; S145-Y149 WeakPolarHBondContact O-CD2 3.35Å; S145-Y149 PolarHBondContact O-N 3.48Å; S145-Y149 VanDerWaalsContact O-N 3.1Å; S145-Y149 WeakPolarHBondContact OG-CE2 3.22Å; S145-F177 WeakPolarHBondContact OG-CD2 3.48Å; S145-F177 VanDerWaalsContact OG-CE2 3.26Å; S145-F177 WeakPolarHBondContact OG-CE2 3.34Å
146Q98.5Very high95.9Very high70 Ų7058.4 Ų58.433%0.32729%0.291SS..Hα-helixtrans-63.4-43.2-179.2-173.3173.7-0.700111.8V142 E143 Y149 Q150 F177V142-Q146 WeakPolarHBondContact O-CB 3.39Å; V142-Q146 PolarHBondContact O-N 3.21Å; E143-Q146 PolarHBondContact O-N 3.41Å; Q146-Y149 PolarHBondContact O-N 3.32Å; Q146-Q150 WeakPolarHBondContact O-CB 3.41Å; Q146-Q150 PolarHBondContact O-N 2.82Å; Q146-F177 HydrophobicContact CB-CE1 3.8Å; Q146-F177 HydrophobicContact CB-CZ 3.82Å; Q146-F177 HydrophobicContact CG-CE1 4.12Å
147Q98.6Very high96.8Very high113 Ų11355.6 Ų55.653%0.52827%0.271SS..Hα-helixtrans-60.5-46.6178.6-176.4-179.66.400111.4E143 Q144 Q150 E151E143-Q147 WeakPolarHBondContact O-CB 3.26Å; E143-Q147 PolarHBondContact O-N 2.91Å; Q144-Q147 PolarHBondContact O-N 3.22Å; Q147-Q150 PolarHBondContact O-N 3.31Å; Q147-E151 PolarHBondContact O-N 3.39Å
148A98.8Very high97.5Very high4 Ų456.9 Ų56.93%0.03327%0.271CS..Hα-helixtrans-63.1-44179.900000112.1K122 Q144 S145 A152K122-A148 HydrophobicContact CB-CB 4.03Å; K122-A148 HydrophobicContact CD-CB 4.09Å; K122-A148 HydrophobicContact CG-CB 3.88Å; Q144-A148 WeakPolarHBondContact O-CB 3.14Å; Q144-A148 PolarHBondContact O-N 2.86Å; S145-A148 PolarHBondContact O-N 3.33Å; A148-A152 WeakPolarHBondContact O-CB 3.38Å; A148-A152 PolarHBondContact O-N 2.82Å
149Y98.8Very high97.7Very high0 Ų059.3 Ų59.30%028%0.283CS..Hα-helixtrans-64.7-42175.2-74.1-52.4000112.6G123 D124 R127 S145 Q146 A152 F153 L170 N173 F174 F177G123-Y149 VanDerWaalsContact C-CZ 3.4Å; D124-Y149 VanDerWaalsContact CA-OH 3.3Å; D124-Y149 WeakPolarHBondContact CA-OH 3.16Å; D124-Y149 PolarHBondContact N-OH 2.89Å; D124-Y149 PolarHBondContact OD1-OH 2.73Å; R127-Y149 PolarHBondContact NE-OH 3.02Å; R127-Y149 VanDerWaalsContact NE-OH 3.13Å; S145-Y149 WeakPolarHBondContact O-CD2 3.35Å; S145-Y149 PolarHBondContact O-N 3.48Å; S145-Y149 VanDerWaalsContact O-N 3.1Å; S145-Y149 WeakPolarHBondContact OG-CE2 3.22Å; Q146-Y149 PolarHBondContact O-N 3.32Å; Y149-A152 PolarHBondContact O-N 2.99Å; Y149-F153 VanDerWaalsContact O-CB 3.25Å; Y149-F153 WeakPolarHBondContact O-CB 3.24Å; Y149-F153 PolarHBondContact O-N 3.42Å; Y149-L170 HydrophobicContact CD1-CD1 3.67Å; Y149-L170 HydrophobicContact CE1-CD1 4.39Å; Y149-N173 HydrophobicContact CE1-CB 4.17Å; Y149-F174 VanDerWaalsContact CB-CD2 3.43Å; Y149-F174 VanDerWaalsContact CB-CE2 3.5Å; Y149-F174 HydrophobicContact CD1-CB 4.07Å; Y149-F174 HydrophobicContact CD1-CD2 4.46Å; Y149-F174 HydrophobicContact CD1-CG 4.33Å; Y149-F174 AromaticContact CD2-CD2 3.58Å; Y149-F174 HydrophobicContact CD2-CD2 3.58Å; Y149-F174 HydrophobicContact CD2-CE2 4.01Å; Y149-F174 HydrophobicContact CD2-CG 4.24Å; Y149-F174 HydrophobicContact CE2-CD2 4.41Å; Y149-F174 HydrophobicContact CG-CB 4.06Å; Y149-F174 HydrophobicContact CG-CD1 4.48Å; Y149-F174 AromaticContact CG-CD2 3.61Å; Y149-F174 HydrophobicContact CG-CD2 3.61Å; Y149-F174 HydrophobicContact CG-CE2 4.08Å; Y149-F174 AromaticContact CG-CG 3.84Å; Y149-F174 HydrophobicContact CG-CG 3.84Å; Y149-F177 HydrophobicContact CD2-CB 4.17Å; Y149-F177 HydrophobicContact CD2-CD1 4.24Å; Y149-F177 HydrophobicContact CD2-CG 4.06Å; Y149-F177 HydrophobicContact CE2-CB 3.69Å; Y149-F177 HydrophobicContact CE2-CD1 4.49Å; Y149-F177 HydrophobicContact CE2-CD2 4.15Å; Y149-F177 AromaticContact CE2-CG 3.86Å; Y149-F177 HydrophobicContact CE2-CG 3.86Å
150Q98.6Very high97.8Very high67 Ų6753.2 Ų53.231%0.31326%0.257SS..Hα-helixtrans-64.2-44.8178.6-169.866.647.600111.3Q146 Q147 A152 F153 E154Q146-Q150 WeakPolarHBondContact O-CB 3.41Å; Q146-Q150 PolarHBondContact O-N 2.82Å; Q147-Q150 PolarHBondContact O-N 3.31Å; Q150-A152 VanDerWaalsContact C-N 3.35Å; Q150-A152 PolarHBondContact O-N 2.99Å; Q150-F153 PolarHBondContact O-N 3.03Å; Q150-F153 VanDerWaalsContact O-N 3.13Å; Q150-E154 PolarHBondContact NE2-OE1 3.43Å; Q150-E154 WeakPolarHBondContact O-CG 3.24Å; Q150-E154 PolarHBondContact O-N 3.49Å
151E98.5Very high97.9Very high76 Ų7656.9 Ų56.936%0.35527%0.265SS..Hα-helixtrans-60.7-44.9176.7-168.9-173.7164.200111.3K115 L119 Q147 F153 E154 I155K115-E151 WeakPolarHBondContact CE-OE1 3.39Å; K115-E151 IonicContact NZ-OE1 3.49Å; K115-E151 PolarHBondContact NZ-OE1 3.27Å; L119-E151 HydrophobicContact CD1-CB 4.1Å; L119-E151 HydrophobicContact CD1-CG 3.71Å; L119-E151 HydrophobicContact CD2-CB 4.45Å; L119-E151 HydrophobicContact CD2-CG 4.45Å; Q147-E151 PolarHBondContact O-N 3.39Å; E151-F153 VanDerWaalsContact C-N 3.26Å; E151-F153 PolarHBondContact O-N 2.93Å; E151-E154 PolarHBondContact O-N 3.08Å; E151-I155 HydrophobicContact CG-CD1 4.22Å; E151-I155 WeakPolarHBondContact O-CG1 3.35Å; E151-I155 PolarHBondContact O-N 3.41Å
152A98.8Very high97.9Very high0 Ų055.9 Ų55.90%026%0.261CS..Hα-helixtrans-58.4-41.9174.500000111.4V116 L119 A148 Y149 Q150 I155 S156 L170V116-A152 HydrophobicContact CG1-CB 4.34Å; L119-A152 HydrophobicContact CB-CB 3.66Å; A148-A152 WeakPolarHBondContact O-CB 3.38Å; A148-A152 PolarHBondContact O-N 2.82Å; Y149-A152 PolarHBondContact O-N 2.99Å; Q150-A152 VanDerWaalsContact C-N 3.35Å; Q150-A152 PolarHBondContact O-N 2.99Å; A152-I155 PolarHBondContact O-N 3.16Å; A152-S156 VanDerWaalsContact O-CB 3.3Å; A152-S156 WeakPolarHBondContact O-CB 3.33Å; A152-S156 PolarHBondContact O-N 3.1Å; A152-S156 PolarHBondContact O-OG 3.04Å; A152-L170 VanDerWaalsContact C-CD2 3.48Å; A152-L170 HydrophobicContact CB-CD1 3.81Å; A152-L170 HydrophobicContact CB-CD2 3.63Å; A152-L170 HydrophobicContact CB-CG 4.39Å
153F98.2Very high97.8Very high22 Ų2255 Ų5510%0.09626%0.256CS..Hα-helixtrans-68.7-43.7-175.3-165.8-115000111.6Y149 Q150 E151 I155 S156 K157 L170 L191Y149-F153 VanDerWaalsContact O-CB 3.25Å; Y149-F153 WeakPolarHBondContact O-CB 3.24Å; Y149-F153 PolarHBondContact O-N 3.42Å; Q150-F153 PolarHBondContact O-N 3.03Å; Q150-F153 VanDerWaalsContact O-N 3.13Å; E151-F153 VanDerWaalsContact C-N 3.26Å; E151-F153 PolarHBondContact O-N 2.93Å; F153-I155 VanDerWaalsContact C-N 3.34Å; F153-I155 PolarHBondContact O-N 3.47Å; F153-S156 WeakPolarHBondContact CA-OG 3.16Å; F153-S156 PolarHBondContact O-N 3.33Å; F153-S156 PolarHBondContact O-OG 2.9Å; F153-K157 HydrophobicContact CD1-CD 4.04Å; F153-K157 HydrophobicContact CE1-CD 3.77Å; F153-K157 HydrophobicContact CE1-CG 4.47Å; F153-K157 HydrophobicContact CZ-CD 4.19Å; F153-K157 WeakPolarHBondContact O-CB 3.26Å; F153-K157 WeakPolarHBondContact O-CG 3.42Å; F153-K157 PolarHBondContact O-N 3.35Å; F153-L170 HydrophobicContact CB-CD2 4.13Å; F153-L170 HydrophobicContact CD2-CD2 4.15Å; F153-L170 HydrophobicContact CD2-CG 4.48Å; F153-L191 HydrophobicContact CE1-CD1 4.16Å; F153-L191 HydrophobicContact CE2-CD1 3.61Å; F153-L191 HydrophobicContact CZ-CD1 3.34Å
154E98.2Very high97.8Very high81 Ų8152.5 Ų52.538%0.37924%0.244SC..Hα-helixtrans-60.5-40.6175.8-69.2-51.9135.100112.8Q150 E151 K158Q150-E154 PolarHBondContact NE2-OE1 3.43Å; Q150-E154 WeakPolarHBondContact O-CG 3.24Å; Q150-E154 PolarHBondContact O-N 3.49Å; E151-E154 PolarHBondContact O-N 3.08Å; E154-K158 WeakPolarHBondContact O-CD 3.45Å; E154-K158 WeakPolarHBondContact O-CG 3.3Å
155I98.5Very high97.7Very high30 Ų3050.5 Ų50.515%0.15424%0.236CC..Hα-helixtrans-69.7-47.3176.4-61.8163.8000109.7A112 K115 V116 L119 E151 A152 F153 K157 K158 E159A112-I155 HydrophobicContact CB-CG2 4.16Å; K115-I155 HydrophobicContact CD-CD1 3.73Å; K115-I155 HydrophobicContact CG-CD1 3.97Å; V116-I155 HydrophobicContact CG2-CB 3.77Å; V116-I155 HydrophobicContact CG2-CG2 3.53Å; L119-I155 HydrophobicContact CD1-CD1 3.73Å; E151-I155 HydrophobicContact CG-CD1 4.22Å; E151-I155 WeakPolarHBondContact O-CG1 3.35Å; E151-I155 PolarHBondContact O-N 3.41Å; A152-I155 PolarHBondContact O-N 3.16Å; F153-I155 VanDerWaalsContact C-N 3.34Å; F153-I155 PolarHBondContact O-N 3.47Å; I155-K157 VanDerWaalsContact C-N 3.29Å; I155-K157 PolarHBondContact O-N 3.32Å; I155-K158 PolarHBondContact O-N 3.17Å; I155-K158 VanDerWaalsContact O-N 3.1Å; I155-E159 HydrophobicContact CG2-CG 4.27Å; I155-E159 PolarHBondContact O-N 2.98Å
156S98.2Very high97.7Very high0 Ų051.5 Ų51.50%024%0.241CC..Hα-helixtrans-61.5-35.9-177.3750000113.1A152 F153 K158 M160A152-S156 VanDerWaalsContact O-CB 3.3Å; A152-S156 WeakPolarHBondContact O-CB 3.33Å; A152-S156 PolarHBondContact O-N 3.1Å; A152-S156 PolarHBondContact O-OG 3.04Å; F153-S156 WeakPolarHBondContact CA-OG 3.16Å; F153-S156 PolarHBondContact O-N 3.33Å; F153-S156 PolarHBondContact O-OG 2.9Å; S156-K158 VanDerWaalsContact C-N 3.3Å; S156-K158 PolarHBondContact O-N 3.42Å; S156-M160 VanDerWaalsContact O-CB 3.29Å; S156-M160 WeakPolarHBondContact O-CB 3.4Å; S156-M160 PolarHBondContact O-N 3.1Å
157K96.9Very high97.6Very high98 Ų9849.4 Ų49.443%0.42623%0.23SC..Hα-helixtrans-66.4-31.4177-83.7-175.1160.4-179.90113.3F153 I155F153-K157 HydrophobicContact CD1-CD 4.04Å; F153-K157 HydrophobicContact CE1-CD 3.77Å; F153-K157 HydrophobicContact CE1-CG 4.47Å; F153-K157 HydrophobicContact CZ-CD 4.19Å; F153-K157 WeakPolarHBondContact O-CB 3.26Å; F153-K157 WeakPolarHBondContact O-CG 3.42Å; F153-K157 PolarHBondContact O-N 3.35Å; I155-K157 VanDerWaalsContact C-N 3.29Å; I155-K157 PolarHBondContact O-N 3.32Å
158K97Very high97.6Very high155 Ų15544 Ų4467%0.67421%0.205SC*.Hα-helixtrans-86.5-38-177.4-68.2173.1-173.5173.60112.4E154 I155 S156E154-K158 WeakPolarHBondContact O-CD 3.45Å; E154-K158 WeakPolarHBondContact O-CG 3.3Å; I155-K158 PolarHBondContact O-N 3.17Å; I155-K158 VanDerWaalsContact O-N 3.1Å; S156-K158 VanDerWaalsContact C-N 3.3Å; S156-K158 PolarHBondContact O-N 3.42Å
159E97.2Very high97.6Very high132 Ų13244.3 Ų44.362%0.61721%0.208SC*.Hα-helixtrans-112.7-6.5-164.9-57.6-64146.800113.8A112 I155A112-E159 HydrophobicContact CB-CB 3.71Å; A112-E159 HydrophobicContact CB-CG 3.92Å; I155-E159 HydrophobicContact CG2-CG 4.27Å; I155-E159 PolarHBondContact O-N 2.98Å
160M96.2Very high97.6Very high16 Ų1644.3 Ų44.38%0.07921%0.208CC..SBendtrans-132.4138.8-172-48.6175.371.600111.6E113 V116 S156 H164 I166 R167E113-M160 HydrophobicContact CG-CE 4.4Å; V116-M160 HydrophobicContact CB-SD 4.01Å; V116-M160 HydrophobicContact CG1-SD 3.98Å; V116-M160 HydrophobicContact CG2-SD 3.84Å; S156-M160 VanDerWaalsContact O-CB 3.29Å; S156-M160 WeakPolarHBondContact O-CB 3.4Å; S156-M160 PolarHBondContact O-N 3.1Å; M160-H164 HydrophobicContact CB-CB 4.26Å; M160-H164 HydrophobicContact CE-CB 4.19Å; M160-H164 WeakPolarHBondContact CE-CE1 3.39Å; M160-H164 WeakPolarHBondContact CE-ND1 3.35Å; M160-I166 HydrophobicContact CE-CB 3.79Å; M160-I166 HydrophobicContact CE-CG2 3.91Å; M160-R167 HydrophobicContact CB-CB 4.36Å; M160-R167 HydrophobicContact CE-CB 4.45Å; M160-R167 PolarHBondContact O-NH1 3.01Å
161Q96Very high97.6Very high112 Ų11241.2 Ų41.252%0.52319%0.194SC..  trans-63.3147.7174-70.6177.8-22.100111.3T163 H164 R167Q161-T163 PolarHBondContact O-N 3.48Å; Q161-T163 VanDerWaalsContact O-N 3.14Å; Q161-H164 WeakPolarHBondContact O-CB 3.42Å; Q161-H164 PolarHBondContact O-N 3.38Å; Q161-R167 WeakPolarHBondContact O-CD 3.46Å
162P97.1Very high97.6Very high14 Ų1438.5 Ų38.59%0.09118%0.182CC..THydrogen-bonded Turntrans-52.2-32.5175.4-28.336.2000114.6H164 L168 E198 E202P162-H164 VanDerWaalsContact C-N 3.3Å; P162-H164 PolarHBondContact O-N 3.39Å; P162-L168 WeakPolarHBondContact O-CG 3.48Å; P162-E198 HydrophobicContact CB-CB 3.82Å; P162-E198 HydrophobicContact CG-CB 4.24Å; P162-E202 WeakPolarHBondContact CD-OE2 3.4Å
163T96.4Very high97.6Very high0 Ų039.9 Ų39.90%019%0.189CC..THydrogen-bonded Turntrans-81.1-3.9179.355.70000114Q161 A199 E202 S214Q161-T163 PolarHBondContact O-N 3.48Å; Q161-T163 VanDerWaalsContact O-N 3.14Å; T163-A199 HydrophobicContact CG2-CB 4.42Å; T163-A199 WeakPolarHBondContact CG2-O 3.42Å; T163-E202 HydrophobicContact CG2-CB 3.91Å; T163-E202 WeakPolarHBondContact CG2-O 3.12Å; T163-S214 WeakPolarHBondContact O-CB 3.44Å; T163-S214 PolarHBondContact O-OG 2.85Å
164H96.2Very high97.6Very high50 Ų5038.9 Ų38.923%0.23119%0.185CC..  trans-66.8128-177-170.1-56.9000111.2E113 M160 Q161 P162 I166 R167 L168E113-H164 IonicContact OE2-NE2 2.63Å; M160-H164 HydrophobicContact CB-CB 4.26Å; M160-H164 HydrophobicContact CE-CB 4.19Å; M160-H164 WeakPolarHBondContact CE-CE1 3.39Å; M160-H164 WeakPolarHBondContact CE-ND1 3.35Å; Q161-H164 WeakPolarHBondContact O-CB 3.42Å; Q161-H164 PolarHBondContact O-N 3.38Å; P162-H164 VanDerWaalsContact C-N 3.3Å; P162-H164 PolarHBondContact O-N 3.39Å; H164-I166 PolarHBondContact ND1-N 3.49Å; H164-I166 VanDerWaalsContact ND1-N 3.18Å; H164-I166 PolarHBondContact O-N 2.68Å; H164-R167 HydrophobicContact CB-CB 4.24Å; H164-R167 PolarHBondContact O-N 3.24Å; H164-L168 PolarHBondContact O-N 3.46Å
165P96.7Very high97.7Very high21 Ų2135 Ų3514%0.13617%0.167CC..Hα-helixtrans-53.4-44.4-175.2-26.329.5000114.5L168 G169 D213 S214 I217P165-L168 PolarHBondContact O-N 2.7Å; P165-G169 PolarHBondContact O-N 2.77Å; P165-D213 HydrophobicContact CB-CB 4.17Å; P165-D213 HydrophobicContact CG-CB 4.15Å; P165-S214 WeakPolarHBondContact CD-OG 3.37Å; P165-S214 WeakPolarHBondContact CG-OG 3.25Å; P165-I217 HydrophobicContact CB-CD1 4.19Å; P165-I217 VanDerWaalsContact O-CD1 3.29Å; P165-I217 WeakPolarHBondContact O-CD1 3.36Å
166I97.6Very high97.7Very high21 Ų2134.4 Ų34.411%0.10817%0.165CC..Hα-helixtrans-64.1-39.8177.3-68.5168.6000112.9E113 V116 F117 M160 H164 G169 L170E113-I166 HydrophobicContact CG-CD1 3.36Å; E113-I166 VanDerWaalsContact OE1-CD1 3.3Å; E113-I166 WeakPolarHBondContact OE1-CD1 3.28Å; V116-I166 HydrophobicContact CB-CG2 4.3Å; V116-I166 HydrophobicContact CG1-CG2 3.73Å; F117-I166 HydrophobicContact CB-CD1 4.41Å; F117-I166 HydrophobicContact CD2-CD1 3.8Å; F117-I166 HydrophobicContact CD2-CG1 4.1Å; M160-I166 HydrophobicContact CE-CB 3.79Å; M160-I166 HydrophobicContact CE-CG2 3.91Å; H164-I166 PolarHBondContact ND1-N 3.49Å; H164-I166 VanDerWaalsContact ND1-N 3.18Å; H164-I166 PolarHBondContact O-N 2.68Å; I166-G169 PolarHBondContact O-N 3.02Å; I166-L170 WeakPolarHBondContact O-CB 3.43Å; I166-L170 PolarHBondContact O-N 3.47Å
167R98.1Very high97.7Very high25 Ų2534.4 Ų34.49%0.09417%0.165CC..Hα-helixtrans-66.2-44.1176.6177.5175.8167.3171.6-5.7110.8M160 Q161 H164 L170 A171 E198M160-R167 HydrophobicContact CB-CB 4.36Å; M160-R167 HydrophobicContact CE-CB 4.45Å; M160-R167 PolarHBondContact O-NH1 3.01Å; Q161-R167 WeakPolarHBondContact O-CD 3.46Å; H164-R167 HydrophobicContact CB-CB 4.24Å; H164-R167 PolarHBondContact O-N 3.24Å; R167-L170 WeakPolarHBondContact O-CB 3.31Å; R167-L170 PolarHBondContact O-N 3.33Å; R167-A171 PolarHBondContact O-N 3.04Å; R167-E198 IonicContact CZ-OE2 3.68Å; R167-E198 IonicContact NH2-OE2 2.75Å; R167-E198 PolarHBondContact NH2-OE2 2.97Å
168L98.4Very high97.8Very high1 Ų131 Ų311%0.00515%0.149CC..Hα-helixtrans-62.5-44.5174.8-72.1166.7000111.7P162 H164 P165 L170 A171 L172 A199 I217 M218 L221P162-L168 WeakPolarHBondContact O-CG 3.48Å; H164-L168 PolarHBondContact O-N 3.46Å; P165-L168 PolarHBondContact O-N 2.7Å; L168-L170 VanDerWaalsContact C-N 3.27Å; L168-L170 PolarHBondContact O-N 2.97Å; L168-A171 PolarHBondContact O-N 3.18Å; L168-L172 WeakPolarHBondContact O-CB 3.11Å; L168-L172 PolarHBondContact O-N 2.86Å; L168-A199 HydrophobicContact CD1-CB 4.4Å; L168-A199 HydrophobicContact CD2-CB 3.66Å; L168-I217 HydrophobicContact CB-CB 4.18Å; L168-I217 HydrophobicContact CB-CG2 3.6Å; L168-M218 HydrophobicContact CD1-CG 3.96Å; L168-M218 HydrophobicContact CD1-SD 4.4Å; L168-M218 HydrophobicContact CD2-CG 4.17Å; L168-L221 HydrophobicContact CD2-CD1 4.01Å
169G98.4Very high97.8Very high9 Ų926.2 Ų26.29%0.09313%0.127CC..Hα-helixtrans-64.2-33177.800000112.6K120 P165 I166 N173K120-G169 WeakPolarHBondContact CE-O 3.48Å; P165-G169 PolarHBondContact O-N 2.77Å; I166-G169 PolarHBondContact O-N 3.02Å; G169-N173 PolarHBondContact O-N 3.48Å; G169-N173 VanDerWaalsContact O-N 3.08Å
170L98.8Very high97.7Very high0 Ų024.8 Ų24.80%012%0.121CC..Hα-helixtrans-65-49.3171.117063.1000111.2V116 K120 Y149 A152 F153 I166 R167 L168 L172 N173 F174V116-L170 HydrophobicContact CG1-CD2 4.06Å; K120-L170 HydrophobicContact CB-CD1 4.01Å; K120-L170 HydrophobicContact CD-CB 4.09Å; K120-L170 HydrophobicContact CG-CB 4.3Å; K120-L170 HydrophobicContact CG-CD1 3.99Å; Y149-L170 HydrophobicContact CD1-CD1 3.67Å; Y149-L170 HydrophobicContact CE1-CD1 4.39Å; A152-L170 VanDerWaalsContact C-CD2 3.48Å; A152-L170 HydrophobicContact CB-CD1 3.81Å; A152-L170 HydrophobicContact CB-CD2 3.63Å; A152-L170 HydrophobicContact CB-CG 4.39Å; F153-L170 HydrophobicContact CB-CD2 4.13Å; F153-L170 HydrophobicContact CD2-CD2 4.15Å; F153-L170 HydrophobicContact CD2-CG 4.48Å; I166-L170 WeakPolarHBondContact O-CB 3.43Å; I166-L170 PolarHBondContact O-N 3.47Å; R167-L170 WeakPolarHBondContact O-CB 3.31Å; R167-L170 PolarHBondContact O-N 3.33Å; L168-L170 VanDerWaalsContact C-N 3.27Å; L168-L170 PolarHBondContact O-N 2.97Å; L170-L172 VanDerWaalsContact C-N 3.31Å; L170-L172 PolarHBondContact O-N 3.45Å; L170-N173 PolarHBondContact O-N 2.98Å; L170-F174 VanDerWaalsContact O-CB 3.24Å; L170-F174 WeakPolarHBondContact O-CB 3.31Å; L170-F174 PolarHBondContact O-N 3.14Å
171A98.7Very high97.8Very high2 Ų225.3 Ų25.32%0.01712%0.123CC..Hα-helixtrans-59.6-42.5177.700000111.8R167 L168 S175 A195R167-A171 PolarHBondContact O-N 3.04Å; L168-A171 PolarHBondContact O-N 3.18Å; A171-S175 VanDerWaalsContact O-CB 3.28Å; A171-S175 WeakPolarHBondContact O-CB 3.33Å; A171-S175 PolarHBondContact O-N 3.32Å; A171-S175 PolarHBondContact O-OG 3.29Å; A171-A195 HydrophobicContact CB-CB 3.42Å; A171-A195 VanDerWaalsContact CB-CB 3.42Å
172L98.7Very high97.8Very high19 Ų1922.2 Ų22.210%0.09911%0.11CC..Hα-helixtrans-56-56.6174.6177.764.9000110.8L168 L170 F174 S175 V176 I217 L220 L221 N224L168-L172 WeakPolarHBondContact O-CB 3.11Å; L168-L172 PolarHBondContact O-N 2.86Å; L170-L172 VanDerWaalsContact C-N 3.31Å; L170-L172 PolarHBondContact O-N 3.45Å; L172-F174 PolarHBondContact O-N 3.08Å; L172-S175 PolarHBondContact O-N 2.95Å; L172-S175 PolarHBondContact O-OG 3.17Å; L172-V176 WeakPolarHBondContact O-CG2 3.42Å; L172-V176 PolarHBondContact O-N 3.21Å; L172-V176 VanDerWaalsContact O-N 3.13Å; L172-I217 HydrophobicContact CB-CG2 4.28Å; L172-I217 HydrophobicContact CD2-CG2 4.18Å; L172-L220 HydrophobicContact CD1-CB 4.09Å; L172-L220 HydrophobicContact CD2-CB 3.94Å; L172-L220 HydrophobicContact CD2-CD1 3.92Å; L172-L221 HydrophobicContact CB-CD2 3.92Å; L172-L221 HydrophobicContact CB-CG 4.23Å; L172-L221 HydrophobicContact CD1-CD2 3.98Å; L172-L221 HydrophobicContact CD1-CG 4.18Å; L172-N224 VanDerWaalsContact CD1-ND2 3.31Å; L172-N224 WeakPolarHBondContact CD1-ND2 3.28Å
173N98.6Very high97.7Very high29 Ų2928.2 Ų28.216%0.15514%0.142CC..Hα-helixtrans-68.7-35.4-175.6-75.712.9000113.2K120 D124 Y149 G169 L170 V176 F177K120-N173 WeakPolarHBondContact CE-ND2 3.37Å; K120-N173 PolarHBondContact NZ-ND2 2.56Å; D124-N173 VanDerWaalsContact OD1-CB 3.28Å; D124-N173 WeakPolarHBondContact OD1-CB 3.33Å; D124-N173 PolarHBondContact OD1-ND2 3.45Å; D124-N173 PolarHBondContact OD2-ND2 2.82Å; Y149-N173 HydrophobicContact CE1-CB 4.17Å; G169-N173 PolarHBondContact O-N 3.48Å; G169-N173 VanDerWaalsContact O-N 3.08Å; L170-N173 PolarHBondContact O-N 2.98Å; N173-V176 PolarHBondContact O-N 2.98Å; N173-F177 PolarHBondContact O-N 2.8Å
174F98.8Very high97.8Very high2 Ų229.4 Ų29.41%0.00915%0.15CC..Hα-helixtrans-72.4-33.4178.4-168.1-166.8000111.8Y149 L170 L172 F177 Y178 L191Y149-F174 VanDerWaalsContact CB-CD2 3.43Å; Y149-F174 VanDerWaalsContact CB-CE2 3.5Å; Y149-F174 HydrophobicContact CD1-CB 4.07Å; Y149-F174 HydrophobicContact CD1-CD2 4.46Å; Y149-F174 HydrophobicContact CD1-CG 4.33Å; Y149-F174 AromaticContact CD2-CD2 3.58Å; Y149-F174 HydrophobicContact CD2-CD2 3.58Å; Y149-F174 HydrophobicContact CD2-CE2 4.01Å; Y149-F174 HydrophobicContact CD2-CG 4.24Å; Y149-F174 HydrophobicContact CE2-CD2 4.41Å; Y149-F174 HydrophobicContact CG-CB 4.06Å; Y149-F174 HydrophobicContact CG-CD1 4.48Å; Y149-F174 AromaticContact CG-CD2 3.61Å; Y149-F174 HydrophobicContact CG-CD2 3.61Å; Y149-F174 HydrophobicContact CG-CE2 4.08Å; Y149-F174 AromaticContact CG-CG 3.84Å; Y149-F174 HydrophobicContact CG-CG 3.84Å; L170-F174 VanDerWaalsContact O-CB 3.24Å; L170-F174 WeakPolarHBondContact O-CB 3.31Å; L170-F174 PolarHBondContact O-N 3.14Å; L172-F174 PolarHBondContact O-N 3.08Å; F174-F177 HydrophobicContact CD2-CB 4.24Å; F174-F177 AromaticContact CD2-CD1 3.74Å; F174-F177 HydrophobicContact CD2-CD1 3.74Å; F174-F177 HydrophobicContact CD2-CG 4.37Å; F174-F177 AromaticContact CE2-CD1 3.67Å; F174-F177 HydrophobicContact CE2-CD1 3.67Å; F174-F177 HydrophobicContact CE2-CE1 4.1Å; F174-F177 WeakPolarHBondContact O-CB 3.46Å; F174-F177 PolarHBondContact O-N 3.5Å; F174-Y178 HydrophobicContact CD1-CE2 4.13Å; F174-Y178 AromaticContact CD2-CD2 4Å; F174-Y178 HydrophobicContact CD2-CD2 4Å; F174-Y178 AromaticContact CD2-CE2 3.66Å; F174-Y178 HydrophobicContact CD2-CE2 3.66Å; F174-Y178 AromaticContact CE1-CE2 3.93Å; F174-Y178 HydrophobicContact CE1-CE2 3.93Å; F174-Y178 HydrophobicContact CE2-CD2 4.12Å; F174-Y178 HydrophobicContact CE2-CE1 4.32Å; F174-Y178 AromaticContact CE2-CE2 3.42Å; F174-Y178 HydrophobicContact CE2-CE2 3.42Å; F174-Y178 VanDerWaalsContact CE2-CE2 3.42Å; F174-Y178 AromaticContact CE2-CZ 3.54Å; F174-Y178 HydrophobicContact CG-CD2 4.42Å; F174-Y178 HydrophobicContact CG-CE2 4.02Å; F174-Y178 AromaticContact CZ-CE2 3.58Å; F174-Y178 HydrophobicContact CZ-CE2 3.58Å; F174-Y178 AromaticContact CZ-CZ 3.56Å; F174-Y178 WeakPolarHBondContact CZ-OH 3.32Å; F174-Y178 VanDerWaalsContact O-CD2 3.22Å; F174-Y178 WeakPolarHBondContact O-CD2 3.33Å; F174-Y178 PolarHBondContact O-N 3.31Å; F174-L191 HydrophobicContact CB-CD2 3.81Å; F174-L191 HydrophobicContact CD1-CD2 3.72Å; F174-L191 HydrophobicContact CG-CD2 3.81Å
175S98.6Very high97.8Very high0 Ų028 Ų280%015%0.146CC..Hα-helixtrans-64.1-41.9171.469.90000111.7A171 L172 F177 Y178 Y179 A188 W228A171-S175 VanDerWaalsContact O-CB 3.28Å; A171-S175 WeakPolarHBondContact O-CB 3.33Å; A171-S175 PolarHBondContact O-N 3.32Å; A171-S175 PolarHBondContact O-OG 3.29Å; L172-S175 PolarHBondContact O-N 2.95Å; L172-S175 PolarHBondContact O-OG 3.17Å; S175-F177 VanDerWaalsContact C-N 3.31Å; S175-F177 PolarHBondContact O-N 3.39Å; S175-Y178 PolarHBondContact O-N 3.39Å; S175-Y178 VanDerWaalsContact O-N 3.16Å; S175-Y179 PolarHBondContact O-N 3.06Å; S175-A188 WeakPolarHBondContact CB-O 3.33Å; S175-A188 VanDerWaalsContact O-CB 3.24Å; S175-A188 WeakPolarHBondContact O-CB 3.38Å; S175-W228 WeakPolarHBondContact OG-CH2 3.4Å
176V98.4Very high97.8Very high16 Ų1633.6 Ų33.610%0.09717%0.17CC..Hα-helixtrans-61.2-39.4173.6175.30000111.2L172 N173 Y179 E180 W228L172-V176 WeakPolarHBondContact O-CG2 3.42Å; L172-V176 PolarHBondContact O-N 3.21Å; L172-V176 VanDerWaalsContact O-N 3.13Å; N173-V176 PolarHBondContact O-N 2.98Å; V176-Y179 PolarHBondContact O-N 3.42Å; V176-E180 HydrophobicContact CG1-CG 3.91Å; V176-E180 VanDerWaalsContact CG1-OE2 3.24Å; V176-E180 WeakPolarHBondContact CG1-OE2 3.2Å; V176-E180 WeakPolarHBondContact O-CB 3.2Å; V176-E180 PolarHBondContact O-N 2.85Å; V176-W228 HydrophobicContact CG2-CH2 3.92Å; V176-W228 HydrophobicContact CG2-CZ2 3.95Å
177F98.6Very high97.7Very high0 Ų038.3 Ų38.30%019%0.189CC..Hα-helixtrans-59.1-47.4172.7171.1-102.7000112.4R127 V142 S145 Q146 Y149 N173 F174 S175 Y179 I181 L182R127-F177 HydrophobicContact CB-CD2 4.28Å; R127-F177 HydrophobicContact CG-CD2 4.29Å; V142-F177 HydrophobicContact CG1-CE2 4.31Å; V142-F177 HydrophobicContact CG1-CZ 3.97Å; S145-F177 WeakPolarHBondContact OG-CD2 3.48Å; S145-F177 VanDerWaalsContact OG-CE2 3.26Å; S145-F177 WeakPolarHBondContact OG-CE2 3.34Å; Q146-F177 HydrophobicContact CB-CE1 3.8Å; Q146-F177 HydrophobicContact CB-CZ 3.82Å; Q146-F177 HydrophobicContact CG-CE1 4.12Å; Y149-F177 HydrophobicContact CD2-CB 4.17Å; Y149-F177 HydrophobicContact CD2-CD1 4.24Å; Y149-F177 HydrophobicContact CD2-CG 4.06Å; Y149-F177 HydrophobicContact CE2-CB 3.69Å; Y149-F177 HydrophobicContact CE2-CD1 4.49Å; Y149-F177 HydrophobicContact CE2-CD2 4.15Å; Y149-F177 AromaticContact CE2-CG 3.86Å; Y149-F177 HydrophobicContact CE2-CG 3.86Å; N173-F177 PolarHBondContact O-N 2.8Å; F174-F177 HydrophobicContact CD2-CB 4.24Å; F174-F177 AromaticContact CD2-CD1 3.74Å; F174-F177 HydrophobicContact CD2-CD1 3.74Å; F174-F177 HydrophobicContact CD2-CG 4.37Å; F174-F177 AromaticContact CE2-CD1 3.67Å; F174-F177 HydrophobicContact CE2-CD1 3.67Å; F174-F177 HydrophobicContact CE2-CE1 4.1Å; F174-F177 WeakPolarHBondContact O-CB 3.46Å; F174-F177 PolarHBondContact O-N 3.5Å; S175-F177 VanDerWaalsContact C-N 3.31Å; S175-F177 PolarHBondContact O-N 3.39Å; F177-Y179 VanDerWaalsContact C-N 3.27Å; F177-Y179 PolarHBondContact O-N 3.41Å; F177-I181 HydrophobicContact CD2-CB 3.75Å; F177-I181 HydrophobicContact CD2-CG1 3.82Å; F177-I181 HydrophobicContact CD2-CG2 4.1Å; F177-I181 HydrophobicContact CE2-CB 3.84Å; F177-I181 HydrophobicContact CE2-CG1 4.27Å; F177-I181 HydrophobicContact CE2-CG2 3.68Å; F177-I181 WeakPolarHBondContact O-CB 3.37Å; F177-I181 PolarHBondContact O-N 3.36Å; F177-L182 HydrophobicContact CD1-CD1 4.07Å; F177-L182 HydrophobicContact CD1-CG 4.32Å; F177-L182 HydrophobicContact CE1-CD1 3.33Å; F177-L182 HydrophobicContact CE1-CD2 4.44Å; F177-L182 HydrophobicContact CE1-CG 3.65Å; F177-L182 HydrophobicContact CZ-CD1 3.87Å; F177-L182 HydrophobicContact CZ-CD2 4.15Å; F177-L182 HydrophobicContact CZ-CG 3.76Å; F177-L182 PolarHBondContact O-N 2.94Å
178Y98.5Very high97.7Very high26 Ų2637.1 Ų37.110%0.10219%0.185CC..Hα-helixtrans-59.3-40.8177.1-79.7-61000111.9F174 S175 L182 N183 S184 K187 L191F174-Y178 HydrophobicContact CD1-CE2 4.13Å; F174-Y178 AromaticContact CD2-CD2 4Å; F174-Y178 HydrophobicContact CD2-CD2 4Å; F174-Y178 AromaticContact CD2-CE2 3.66Å; F174-Y178 HydrophobicContact CD2-CE2 3.66Å; F174-Y178 AromaticContact CE1-CE2 3.93Å; F174-Y178 HydrophobicContact CE1-CE2 3.93Å; F174-Y178 HydrophobicContact CE2-CD2 4.12Å; F174-Y178 HydrophobicContact CE2-CE1 4.32Å; F174-Y178 AromaticContact CE2-CE2 3.42Å; F174-Y178 HydrophobicContact CE2-CE2 3.42Å; F174-Y178 VanDerWaalsContact CE2-CE2 3.42Å; F174-Y178 AromaticContact CE2-CZ 3.54Å; F174-Y178 HydrophobicContact CG-CD2 4.42Å; F174-Y178 HydrophobicContact CG-CE2 4.02Å; F174-Y178 AromaticContact CZ-CE2 3.58Å; F174-Y178 HydrophobicContact CZ-CE2 3.58Å; F174-Y178 AromaticContact CZ-CZ 3.56Å; F174-Y178 WeakPolarHBondContact CZ-OH 3.32Å; F174-Y178 VanDerWaalsContact O-CD2 3.22Å; F174-Y178 WeakPolarHBondContact O-CD2 3.33Å; F174-Y178 PolarHBondContact O-N 3.31Å; S175-Y178 PolarHBondContact O-N 3.39Å; S175-Y178 VanDerWaalsContact O-N 3.16Å; Y178-L182 HydrophobicContact CD1-CB 4.48Å; Y178-L182 HydrophobicContact CD1-CD1 3.59Å; Y178-L182 HydrophobicContact CE1-CD1 3.71Å; Y178-L182 CarbonylContact O-C 3.42Å; Y178-N183 PolarHBondContact O-N 3.49Å; Y178-S184 PolarHBondContact O-N 2.89Å; Y178-K187 HydrophobicContact CD1-CB 3.89Å; Y178-K187 HydrophobicContact CD1-CD 4.04Å; Y178-K187 HydrophobicContact CD2-CB 4.45Å; Y178-K187 HydrophobicContact CE1-CB 4.34Å; Y178-K187 HydrophobicContact CE1-CD 3.95Å; Y178-K187 HydrophobicContact CG-CB 3.97Å; Y178-L191 HydrophobicContact CD2-CD2 3.99Å; Y178-L191 HydrophobicContact CE2-CD2 3.91Å
179Y98Very high97.7Very high55 Ų5538 Ų3822%0.21619%0.191CC..Hα-helixtrans-70.3-63179.5-166.7-98000111.9S175 V176 F177 N183 P185 A188 W228 D231S175-Y179 PolarHBondContact O-N 3.06Å; V176-Y179 PolarHBondContact O-N 3.42Å; F177-Y179 VanDerWaalsContact C-N 3.27Å; F177-Y179 PolarHBondContact O-N 3.41Å; Y179-N183 WeakPolarHBondContact O-CA 3.41Å; Y179-N183 PolarHBondContact O-N 3.2Å; Y179-P185 HydrophobicContact CD2-CB 3.95Å; Y179-P185 HydrophobicContact CE2-CB 3.87Å; Y179-A188 HydrophobicContact CD2-CB 4.34Å; Y179-W228 AromaticContact CD1-CD1 3.78Å; Y179-W228 AromaticContact CD1-CE2 3.92Å; Y179-W228 HydrophobicContact CD1-CG 4.47Å; Y179-W228 HydrophobicContact CD1-CZ2 4.46Å; Y179-W228 AromaticContact CD1-NE1 3.38Å; Y179-W228 HydrophobicContact CD2-CB 4.04Å; Y179-W228 AromaticContact CD2-CD1 3.59Å; Y179-W228 AromaticContact CD2-CD2 3.74Å; Y179-W228 HydrophobicContact CD2-CD2 3.74Å; Y179-W228 AromaticContact CD2-CE2 3.91Å; Y179-W228 HydrophobicContact CD2-CE3 4.46Å; Y179-W228 AromaticContact CD2-CG 3.53Å; Y179-W228 HydrophobicContact CD2-CG 3.53Å; Y179-W228 AromaticContact CD2-NE1 3.8Å; Y179-W228 AromaticContact CE1-CD1 3.46Å; Y179-W228 VanDerWaalsContact CE1-CD1 3.46Å; Y179-W228 HydrophobicContact CE1-CG 4.35Å; Y179-W228 AromaticContact CE1-NE1 3.46Å; Y179-W228 HydrophobicContact CE2-CB 3.65Å; Y179-W228 AromaticContact CE2-CD1 3.28Å; Y179-W228 HydrophobicContact CE2-CD2 4.14Å; Y179-W228 AromaticContact CE2-CG 3.41Å; Y179-W228 HydrophobicContact CE2-CG 3.41Å; Y179-W228 VanDerWaalsContact CE2-CG 3.41Å; Y179-W228 AromaticContact CE2-NE1 3.9Å; Y179-W228 AromaticContact CG-CD1 3.83Å; Y179-W228 AromaticContact CG-CD2 3.99Å; Y179-W228 HydrophobicContact CG-CD2 3.99Å; Y179-W228 AromaticContact CG-CE2 3.65Å; Y179-W228 HydrophobicContact CG-CG 4.08Å; Y179-W228 HydrophobicContact CG-CZ2 4.14Å; Y179-W228 AromaticContact CG-NE1 3.55Å; Y179-W228 AromaticContact CZ-CD1 3.2Å; Y179-W228 AromaticContact CZ-CG 3.84Å; Y179-W228 AromaticContact CZ-NE1 3.73Å; Y179-D231 PolarHBondContact OH-OD2 2.87Å
180E95.9Very high97.7Very high102 Ų10241.1 Ų41.148%0.47721%0.212SC..Hα-helixtrans-77.5-31.2-168-63.5-179.6166.500113.6R127 V176R127-E180 IonicContact NH1-OE2 2.7Å; R127-E180 PolarHBondContact NH1-OE2 3Å; V176-E180 HydrophobicContact CG1-CG 3.91Å; V176-E180 VanDerWaalsContact CG1-OE2 3.24Å; V176-E180 WeakPolarHBondContact CG1-OE2 3.2Å; V176-E180 WeakPolarHBondContact O-CB 3.2Å; V176-E180 PolarHBondContact O-N 2.85Å
181I96.8Very high97.7Very high27 Ų2742.1 Ų42.114%0.13822%0.217CC..THydrogen-bonded Turntrans-106.4-44.2-171.7-54.1-56000112.3R127 A130 E131 V142 F177R127-I181 HydrophobicContact CG-CD1 4.2Å; R127-I181 HydrophobicContact CG-CG1 3.78Å; A130-I181 HydrophobicContact CB-CD1 4.34Å; A130-I181 HydrophobicContact CB-CG2 3.94Å; E131-I181 HydrophobicContact CB-CD1 4.49Å; V142-I181 HydrophobicContact CG1-CG2 4.26Å; V142-I181 HydrophobicContact CG2-CG2 3.62Å; F177-I181 HydrophobicContact CD2-CB 3.75Å; F177-I181 HydrophobicContact CD2-CG1 3.82Å; F177-I181 HydrophobicContact CD2-CG2 4.1Å; F177-I181 HydrophobicContact CE2-CB 3.84Å; F177-I181 HydrophobicContact CE2-CG1 4.27Å; F177-I181 HydrophobicContact CE2-CG2 3.68Å; F177-I181 WeakPolarHBondContact O-CB 3.37Å; F177-I181 PolarHBondContact O-N 3.36Å
182L96.6Very high97.6Very high48 Ų4842 Ų4225%0.25122%0.216SC..THydrogen-bonded Turntrans-91.1-2.1179.8-68.1-176000113.6V142 F177 Y178 S184V142-L182 HydrophobicContact CG1-CD2 3.46Å; V142-L182 VanDerWaalsContact CG1-CD2 3.46Å; F177-L182 HydrophobicContact CD1-CD1 4.07Å; F177-L182 HydrophobicContact CD1-CG 4.32Å; F177-L182 HydrophobicContact CE1-CD1 3.33Å; F177-L182 HydrophobicContact CE1-CD2 4.44Å; F177-L182 HydrophobicContact CE1-CG 3.65Å; F177-L182 HydrophobicContact CZ-CD1 3.87Å; F177-L182 HydrophobicContact CZ-CD2 4.15Å; F177-L182 HydrophobicContact CZ-CG 3.76Å; F177-L182 PolarHBondContact O-N 2.94Å; Y178-L182 HydrophobicContact CD1-CB 4.48Å; Y178-L182 HydrophobicContact CD1-CD1 3.59Å; Y178-L182 HydrophobicContact CE1-CD1 3.71Å; Y178-L182 CarbonylContact O-C 3.42Å; L182-S184 PolarHBondContact O-N 2.94Å; L182-S184 VanDerWaalsContact O-N 3.13Å; L182-S184 PolarHBondContact O-OG 2.96Å
183N95.7Very high97.6Very high140 Ų14046.4 Ų46.475%0.74923%0.234SC*.  trans45.945.2-177.1-164.150.8000111.9Y178 Y179 P185Y178-N183 PolarHBondContact O-N 3.49Å; Y179-N183 WeakPolarHBondContact O-CA 3.41Å; Y179-N183 PolarHBondContact O-N 3.2Å; N183-P185 VanDerWaalsContact C-CD 3.43Å; N183-P185 WeakPolarHBondContact O-CD 3.37Å
184S97.1Very high97.6Very high24 Ų2447.8 Ų47.817%0.16824%0.244CC..  trans-121.768.8-173.9-65.10000109.9Y178 L182 E186 K187 A188Y178-S184 PolarHBondContact O-N 2.89Å; L182-S184 PolarHBondContact O-N 2.94Å; L182-S184 VanDerWaalsContact O-N 3.13Å; L182-S184 PolarHBondContact O-OG 2.96Å; S184-E186 VanDerWaalsContact C-N 3.26Å; S184-E186 PolarHBondContact O-N 3.47Å; S184-K187 PolarHBondContact O-N 3.36Å; S184-K187 VanDerWaalsContact O-N 3.14Å; S184-A188 PolarHBondContact O-N 3.31Å
185P96.5Very high97.6Very high22 Ų2248.2 Ų48.214%0.14325%0.247CC..Hα-helixtrans-60.3-32.8-173.724.3-33.8000113.2Y179 N183 K187 A188 C189 T232Y179-P185 HydrophobicContact CD2-CB 3.95Å; Y179-P185 HydrophobicContact CE2-CB 3.87Å; N183-P185 VanDerWaalsContact C-CD 3.43Å; N183-P185 WeakPolarHBondContact O-CD 3.37Å; P185-K187 PolarHBondContact O-N 3.41Å; P185-A188 PolarHBondContact O-N 2.89Å; P185-C189 WeakPolarHBondContact O-CB 3.34Å; P185-C189 PolarHBondContact O-N 2.94Å; P185-C189 PolarHBondContact O-SG 3.19Å; P185-T232 HydrophobicContact CB-CG2 4.12Å; P185-T232 HydrophobicContact CG-CG2 4.22Å
186E96.1Very high97.5Very high138 Ų13849.9 Ų49.965%0.64526%0.255SS*.Hα-helixtrans-66.1-41178.3-54.575.4-165.200111.1S184 S190S184-E186 VanDerWaalsContact C-N 3.26Å; S184-E186 PolarHBondContact O-N 3.47Å; E186-S190 WeakPolarHBondContact O-CB 3.49Å; E186-S190 PolarHBondContact O-N 3.43Å
187K97.4Very high97.5Very high119 Ų11952.4 Ų52.452%0.51727%0.268SS..Hα-helixtrans-68.8-40.9175.8-69.9-177.2-178.7169.90111.2Y178 S184 P185 L191Y178-K187 HydrophobicContact CD1-CB 3.89Å; Y178-K187 HydrophobicContact CD1-CD 4.04Å; Y178-K187 HydrophobicContact CD2-CB 4.45Å; Y178-K187 HydrophobicContact CE1-CB 4.34Å; Y178-K187 HydrophobicContact CE1-CD 3.95Å; Y178-K187 HydrophobicContact CG-CB 3.97Å; S184-K187 PolarHBondContact O-N 3.36Å; S184-K187 VanDerWaalsContact O-N 3.14Å; P185-K187 PolarHBondContact O-N 3.41Å; K187-L191 WeakPolarHBondContact O-CB 3.48Å; K187-L191 PolarHBondContact O-N 3.27Å
188A97.9Very high97.4Very high0 Ų055.7 Ų55.70%028%0.283CS..Hα-helixtrans-59-52176.100000111.1S175 Y179 S184 P185 L191 A192 W228S175-A188 WeakPolarHBondContact CB-O 3.33Å; S175-A188 VanDerWaalsContact O-CB 3.24Å; S175-A188 WeakPolarHBondContact O-CB 3.38Å; Y179-A188 HydrophobicContact CD2-CB 4.34Å; S184-A188 PolarHBondContact O-N 3.31Å; P185-A188 PolarHBondContact O-N 2.89Å; A188-L191 PolarHBondContact O-N 3.2Å; A188-A192 WeakPolarHBondContact O-CB 3.3Å; A188-A192 PolarHBondContact O-N 3.26Å; A188-W228 HydrophobicContact CB-CE3 4.08Å; A188-W228 HydrophobicContact CB-CZ3 3.97Å
189C97.9Very high97.4Very high21 Ų2154.4 Ų54.414%0.14228%0.278CS..Hα-helixtrans-64.6-43.6179.3-66.40000111.9P185 L191 A192 K193 L225P185-C189 WeakPolarHBondContact O-CB 3.34Å; P185-C189 PolarHBondContact O-N 2.94Å; P185-C189 PolarHBondContact O-SG 3.19Å; C189-L191 PolarHBondContact O-N 2.92Å; C189-A192 PolarHBondContact O-N 3.25Å; C189-K193 WeakPolarHBondContact O-CB 3.46Å; C189-K193 PolarHBondContact O-N 3.12Å; C189-L225 HydrophobicContact CB-CD2 4.05Å; C189-L225 WeakPolarHBondContact O-CD2 3.43Å
190S97.8Very high97.3Very high74 Ų7455.9 Ų55.952%0.51729%0.289SS..Hα-helixtrans-59.1-45.9177.7-179.90000112E186 T194E186-S190 WeakPolarHBondContact O-CB 3.49Å; E186-S190 PolarHBondContact O-N 3.43Å; S190-T194 VanDerWaalsContact O-CB 3.32Å; S190-T194 WeakPolarHBondContact O-CB 3.35Å; S190-T194 PolarHBondContact O-N 3.14Å; S190-T194 PolarHBondContact O-OG1 3.38Å
191L98.3Very high97.3Very high20 Ų2055.1 Ų55.111%0.10530%0.299CS..Hα-helixtrans-65-49.2178178.662.2000112.1F153 F174 Y178 K187 A188 C189 T194 A195F153-L191 HydrophobicContact CE1-CD1 4.16Å; F153-L191 HydrophobicContact CE2-CD1 3.61Å; F153-L191 HydrophobicContact CZ-CD1 3.34Å; F174-L191 HydrophobicContact CB-CD2 3.81Å; F174-L191 HydrophobicContact CD1-CD2 3.72Å; F174-L191 HydrophobicContact CG-CD2 3.81Å; Y178-L191 HydrophobicContact CD2-CD2 3.99Å; Y178-L191 HydrophobicContact CE2-CD2 3.91Å; K187-L191 WeakPolarHBondContact O-CB 3.48Å; K187-L191 PolarHBondContact O-N 3.27Å; A188-L191 PolarHBondContact O-N 3.2Å; C189-L191 PolarHBondContact O-N 2.92Å; L191-T194 PolarHBondContact O-N 3.13Å; L191-A195 PolarHBondContact O-N 2.85Å
192A98.2Very high97.2Very high0 Ų057.5 Ų57.50%031%0.31CS..Hα-helixtrans-64.1-42.4-178.500000111.7A188 C189 A195 F196 L221 L225 W228A188-A192 WeakPolarHBondContact O-CB 3.3Å; A188-A192 PolarHBondContact O-N 3.26Å; C189-A192 PolarHBondContact O-N 3.25Å; A192-A195 PolarHBondContact O-N 2.97Å; A192-F196 WeakPolarHBondContact O-CB 3.44Å; A192-F196 PolarHBondContact O-N 3.24Å; A192-L221 HydrophobicContact CB-CD2 3.85Å; A192-L225 HydrophobicContact CB-CD1 4.34Å; A192-L225 HydrophobicContact CB-CD2 3.85Å; A192-L225 HydrophobicContact CB-CG 3.93Å; A192-W228 HydrophobicContact CB-CZ3 4.38Å
193K97.9Very high97Very high112 Ų11257.2 Ų57.249%0.48731%0.309SS..Hα-helixtrans-64.2-46.2177.2-174.7179.1-175.3-610111.6C189 A195 F196 D197 L225C189-K193 WeakPolarHBondContact O-CB 3.46Å; C189-K193 PolarHBondContact O-N 3.12Å; K193-A195 PolarHBondContact O-N 3.35Å; K193-F196 PolarHBondContact O-N 3.18Å; K193-D197 WeakPolarHBondContact CG-OD2 3.28Å; K193-D197 IonicContact NZ-OD2 3.21Å; K193-D197 PolarHBondContact NZ-OD2 3.14Å; K193-D197 WeakPolarHBondContact O-CB 3.47Å; K193-D197 VanDerWaalsContact O-CG 3.24Å; K193-D197 PolarHBondContact O-N 3.45Å; K193-L225 HydrophobicContact CB-CD1 4.15Å; K193-L225 HydrophobicContact CB-CD2 4.07Å
194T98.4Very high96.8Very high58 Ų5858.7 Ų58.736%0.35632%0.317SS..Hα-helixtrans-58.8-47.9177.5-58.30000110.9S190 L191 F196 D197 E198S190-T194 VanDerWaalsContact O-CB 3.32Å; S190-T194 WeakPolarHBondContact O-CB 3.35Å; S190-T194 PolarHBondContact O-N 3.14Å; S190-T194 PolarHBondContact O-OG1 3.38Å; L191-T194 PolarHBondContact O-N 3.13Å; T194-F196 VanDerWaalsContact C-N 3.34Å; T194-F196 PolarHBondContact O-N 3.01Å; T194-D197 PolarHBondContact O-N 3.35Å; T194-E198 HydrophobicContact CG2-CG 4.29Å; T194-E198 WeakPolarHBondContact O-CB 3.44Å; T194-E198 VanDerWaalsContact O-CG 3.26Å; T194-E198 WeakPolarHBondContact O-CG 3.16Å; T194-E198 PolarHBondContact O-N 3.14Å
195A98.2Very high96.3Very high10 Ų1061.6 Ų61.68%0.08333%0.334CS..Hα-helixtrans-63.5-39.4179.200000112.7A171 L191 A192 K193 A199 L221A171-A195 HydrophobicContact CB-CB 3.42Å; A171-A195 VanDerWaalsContact CB-CB 3.42Å; L191-A195 PolarHBondContact O-N 2.85Å; A192-A195 PolarHBondContact O-N 2.97Å; K193-A195 PolarHBondContact O-N 3.35Å; A195-A199 VanDerWaalsContact O-CB 3.28Å; A195-A199 WeakPolarHBondContact O-CB 3.45Å; A195-A199 PolarHBondContact O-N 3.02Å; A195-A199 VanDerWaalsContact O-N 3.07Å; A195-L221 HydrophobicContact CB-CD1 4.33Å
196F97.9Very high95.9Very high36 Ų3661.8 Ų61.816%0.15833%0.333CS..Hα-helixtrans-66.1-47.5177-175.9-98.6000112A192 K193 T194 A199 I200 M218 L221 R222A192-F196 WeakPolarHBondContact O-CB 3.44Å; A192-F196 PolarHBondContact O-N 3.24Å; K193-F196 PolarHBondContact O-N 3.18Å; T194-F196 VanDerWaalsContact C-N 3.34Å; T194-F196 PolarHBondContact O-N 3.01Å; F196-A199 PolarHBondContact O-N 2.88Å; F196-I200 HydrophobicContact CD1-CD1 3.68Å; F196-I200 HydrophobicContact CD1-CG1 4.35Å; F196-I200 HydrophobicContact CE1-CD1 3.1Å; F196-I200 HydrophobicContact CE1-CG1 4.12Å; F196-I200 HydrophobicContact CE2-CD1 4.21Å; F196-I200 HydrophobicContact CG-CD1 4.46Å; F196-I200 HydrophobicContact CZ-CD1 3.42Å; F196-I200 VanDerWaalsContact CZ-CD1 3.42Å; F196-I200 HydrophobicContact CZ-CG1 4.26Å; F196-I200 WeakPolarHBondContact O-CB 3.36Å; F196-I200 WeakPolarHBondContact O-CG1 3.25Å; F196-I200 PolarHBondContact O-N 3.43Å; F196-M218 HydrophobicContact CD2-CB 4.1Å; F196-M218 WeakPolarHBondContact CD2-O 3.38Å; F196-M218 HydrophobicContact CE2-CB 4.09Å; F196-M218 WeakPolarHBondContact CE2-O 3.37Å; F196-L221 HydrophobicContact CD2-CB 4.42Å; F196-R222 HydrophobicContact CD2-CB 4.38Å; F196-R222 HydrophobicContact CE2-CB 3.84Å; F196-R222 HydrophobicContact CE2-CG 4.47Å; F196-R222 HydrophobicContact CZ-CB 4.13Å; F196-R222 HydrophobicContact CZ-CG 4.26Å
197D97.9Very high95.5Very high69 Ų6958 Ų5837%0.36932%0.322SS..Hα-helixtrans-64.9-43.4-179.5-69-15.5000111.5K193 T194 I200 A201K193-D197 WeakPolarHBondContact CG-OD2 3.28Å; K193-D197 IonicContact NZ-OD2 3.21Å; K193-D197 PolarHBondContact NZ-OD2 3.14Å; K193-D197 WeakPolarHBondContact O-CB 3.47Å; K193-D197 VanDerWaalsContact O-CG 3.24Å; K193-D197 PolarHBondContact O-N 3.45Å; T194-D197 PolarHBondContact O-N 3.35Å; D197-I200 PolarHBondContact O-N 2.94Å; D197-A201 PolarHBondContact O-N 3.31Å; D197-A201 VanDerWaalsContact O-N 3.07Å
198E97.5Very high95.1Very high68 Ų6861.3 Ų61.332%0.31834%0.339SS..Hα-helixtrans-61.7-42.7175.1-71.7177.4174.700111.6P162 R167 T194 A201 E202P162-E198 HydrophobicContact CB-CB 3.82Å; P162-E198 HydrophobicContact CG-CB 4.24Å; R167-E198 IonicContact CZ-OE2 3.68Å; R167-E198 IonicContact NH2-OE2 2.75Å; R167-E198 PolarHBondContact NH2-OE2 2.97Å; T194-E198 HydrophobicContact CG2-CG 4.29Å; T194-E198 WeakPolarHBondContact O-CB 3.44Å; T194-E198 VanDerWaalsContact O-CG 3.26Å; T194-E198 WeakPolarHBondContact O-CG 3.16Å; T194-E198 PolarHBondContact O-N 3.14Å; E198-A201 PolarHBondContact O-N 3.4Å; E198-E202 PolarHBondContact O-N 3.45Å
199A96.9Very high94.6Very high0 Ų069.8 Ų69.80%038%0.379CS..Hα-helixtrans-70.9-35.817900000113T163 L168 A195 F196 A201 E202 L203 M218T163-A199 HydrophobicContact CG2-CB 4.42Å; T163-A199 WeakPolarHBondContact CG2-O 3.42Å; L168-A199 HydrophobicContact CD1-CB 4.4Å; L168-A199 HydrophobicContact CD2-CB 3.66Å; A195-A199 VanDerWaalsContact O-CB 3.28Å; A195-A199 WeakPolarHBondContact O-CB 3.45Å; A195-A199 PolarHBondContact O-N 3.02Å; A195-A199 VanDerWaalsContact O-N 3.07Å; F196-A199 PolarHBondContact O-N 2.88Å; A199-A201 VanDerWaalsContact C-N 3.33Å; A199-E202 PolarHBondContact O-N 3.22Å; A199-L203 WeakPolarHBondContact O-CA 3.46Å; A199-L203 PolarHBondContact O-N 3.37Å; A199-M218 HydrophobicContact CB-CE 3.82Å; A199-M218 HydrophobicContact CB-CG 4.22Å; A199-M218 HydrophobicContact CB-SD 3.88Å
200I96.2Very high94.2Very high86 Ų8670.2 Ų70.244%0.44138%0.382SS..Hα-helixtrans-61.2-44.4172.7-79.2-173.9000110.8F196 D197 E202 L203 M218F196-I200 HydrophobicContact CD1-CD1 3.68Å; F196-I200 HydrophobicContact CD1-CG1 4.35Å; F196-I200 HydrophobicContact CE1-CD1 3.1Å; F196-I200 HydrophobicContact CE1-CG1 4.12Å; F196-I200 HydrophobicContact CE2-CD1 4.21Å; F196-I200 HydrophobicContact CG-CD1 4.46Å; F196-I200 HydrophobicContact CZ-CD1 3.42Å; F196-I200 VanDerWaalsContact CZ-CD1 3.42Å; F196-I200 HydrophobicContact CZ-CG1 4.26Å; F196-I200 WeakPolarHBondContact O-CB 3.36Å; F196-I200 WeakPolarHBondContact O-CG1 3.25Å; F196-I200 PolarHBondContact O-N 3.43Å; D197-I200 PolarHBondContact O-N 2.94Å; I200-E202 PolarHBondContact O-N 3.28Å; I200-L203 WeakPolarHBondContact O-CB 3.32Å; I200-L203 PolarHBondContact O-N 3.1Å; I200-M218 HydrophobicContact CB-CE 4.41Å; I200-M218 HydrophobicContact CG1-CE 3.51Å
201A96.5Very high93.9Very high85 Ų8572.5 Ų72.570%0.70238%0.38SS*.Hα-helixtrans-62.3-25.4-177.300000113.1D197 E198 A199D197-A201 PolarHBondContact O-N 3.31Å; D197-A201 VanDerWaalsContact O-N 3.07Å; E198-A201 PolarHBondContact O-N 3.4Å; A199-A201 VanDerWaalsContact C-N 3.33Å
202E95.2Very high93.7Very high77 Ų7779.2 Ų79.236%0.3641%0.409SS..THydrogen-bonded Turntrans-112.79.7-179.4-66.4-172.7-151.700113.4P162 T163 E198 A199 I200 D204 T205P162-E202 WeakPolarHBondContact CD-OE2 3.4Å; T163-E202 HydrophobicContact CG2-CB 3.91Å; T163-E202 WeakPolarHBondContact CG2-O 3.12Å; E198-E202 PolarHBondContact O-N 3.45Å; A199-E202 PolarHBondContact O-N 3.22Å; I200-E202 PolarHBondContact O-N 3.28Å; E202-D204 PolarHBondContact O-N 2.93Å; E202-T205 WeakPolarHBondContact O-CB 3.45Å; E202-T205 PolarHBondContact O-N 3.29Å; E202-T205 PolarHBondContact O-OG1 2.98Å
203L92.2Very high93.6Very high43 Ų4383.5 Ų83.523%0.22543%0.431CS..G310 helixtrans-59.7-34.3-172.3-171.462.5000113A199 I200 T205 L206 T215 M218A199-L203 WeakPolarHBondContact O-CA 3.46Å; A199-L203 PolarHBondContact O-N 3.37Å; I200-L203 WeakPolarHBondContact O-CB 3.32Å; I200-L203 PolarHBondContact O-N 3.1Å; L203-T205 PolarHBondContact O-N 2.84Å; L203-T205 VanDerWaalsContact O-N 3.16Å; L203-L206 HydrophobicContact CD1-CD2 3.95Å; L203-L206 WeakPolarHBondContact O-CB 3.4Å; L203-L206 PolarHBondContact O-N 2.93Å; L203-L206 VanDerWaalsContact O-N 3.15Å; L203-T215 HydrophobicContact CD1-CG2 4.2Å; L203-M218 HydrophobicContact CD1-CE 4.3Å; L203-M218 HydrophobicContact CD1-SD 3.96Å
204D90.8Very high93.5Very high171 Ų17178.1 Ų78.191%0.91441%0.408SS*.G310 helixtrans-65.7-14.4178.4-67.6-23.2000113.4E202E202-D204 PolarHBondContact O-N 2.93Å
205T87.5Confident93.4Very high85 Ų8577.4 Ų77.452%0.52140%0.404SS..G310 helixtrans-88.4-7.5178.371.40000113.4E202 L203E202-T205 WeakPolarHBondContact O-CB 3.45Å; E202-T205 PolarHBondContact O-N 3.29Å; E202-T205 PolarHBondContact O-OG1 2.98Å; L203-T205 PolarHBondContact O-N 2.84Å; L203-T205 VanDerWaalsContact O-N 3.16Å
206L88.1Confident93.3Very high26 Ų2681.7 Ų81.714%0.13643%0.425CS..  trans-73.5135.7-169.9-169.356.3000112L203 Y211L203-L206 HydrophobicContact CD1-CD2 3.95Å; L203-L206 WeakPolarHBondContact O-CB 3.4Å; L203-L206 PolarHBondContact O-N 2.93Å; L203-L206 VanDerWaalsContact O-N 3.15Å; L206-Y211 HydrophobicContact CD2-CD2 4.05Å; L206-Y211 HydrophobicContact CG-CD2 4.44Å
207S87.9Confident93.4Very high59 Ų5981.3 Ų81.341%0.41342%0.424SS..  trans-70.2151.9175.170.40000111.7E209 S210 Y211S207-E209 PolarHBondContact O-N 3.34Å; S207-S210 PolarHBondContact O-N 3.02Å; S207-S210 VanDerWaalsContact O-N 3.16Å; S207-S210 PolarHBondContact OG-N 3.02Å; S207-Y211 WeakPolarHBondContact O-CB 3.49Å; S207-Y211 PolarHBondContact O-N 2.98Å
208E87.6Confident93.4Very high188 Ų18878.5 Ų78.588%0.87941%0.409SS*.Hα-helixtrans-56.4-35176.5-169.7176.4-179.800112.2Y211E208-Y211 PolarHBondContact O-N 2.83Å
209E87.9Confident93.4Very high177 Ų17778.2 Ų78.283%0.82741%0.407SS*.Hα-helixtrans-64.3-42.1178.4-173.6178.1-171.600112.8S207S207-E209 PolarHBondContact O-N 3.34Å
210S90.3Very high93.4Very high31 Ų3181.7 Ų81.722%0.21743%0.426CS..Hα-helixtrans-88-15.6-179.8-62.60000113.3S207 K212 D213 S214S207-S210 PolarHBondContact O-N 3.02Å; S207-S210 VanDerWaalsContact O-N 3.16Å; S207-S210 PolarHBondContact OG-N 3.02Å; S210-K212 VanDerWaalsContact C-N 3.34Å; S210-K212 PolarHBondContact O-N 2.76Å; S210-D213 PolarHBondContact O-N 2.65Å; S210-S214 PolarHBondContact O-N 3.17Å; S210-S214 PolarHBondContact O-OG 3.03Å
211Y91.7Very high93.5Very high121 Ų12177.6 Ų77.648%0.47541%0.405SS..Hα-helixtrans-53.8-48.4-170.2-170.7-90.4000112.9L206 S207 E208 T215L206-Y211 HydrophobicContact CD2-CD2 4.05Å; L206-Y211 HydrophobicContact CG-CD2 4.44Å; S207-Y211 WeakPolarHBondContact O-CB 3.49Å; S207-Y211 PolarHBondContact O-N 2.98Å; E208-Y211 PolarHBondContact O-N 2.83Å; Y211-T215 HydrophobicContact CD1-CG2 4.2Å; Y211-T215 HydrophobicContact CD2-CG2 4.5Å; Y211-T215 HydrophobicContact CE1-CG2 3.9Å; Y211-T215 HydrophobicContact CE2-CG2 4.22Å; Y211-T215 HydrophobicContact CG-CG2 4.49Å; Y211-T215 WeakPolarHBondContact O-CB 3.19Å; Y211-T215 VanDerWaalsContact O-CG2 3.25Å; Y211-T215 WeakPolarHBondContact O-CG2 3.46Å; Y211-T215 PolarHBondContact O-N 3.14Å; Y211-T215 PolarHBondContact O-OG1 3.34Å
212K93.9Very high93.6Very high162 Ų16279.1 Ų79.170%0.70439%0.392SS*.Hα-helixtrans-63.8-45.1-178-175.9-177.2174.8-172.80112.3S210 T215 L216S210-K212 VanDerWaalsContact C-N 3.34Å; S210-K212 PolarHBondContact O-N 2.76Å; K212-T215 PolarHBondContact O-OG1 3.41Å; K212-L216 WeakPolarHBondContact O-CB 3.11Å; K212-L216 PolarHBondContact O-N 3.11Å; K212-L216 VanDerWaalsContact O-N 3.15Å
213D94.4Very high93.7Very high89 Ų8978.7 Ų78.748%0.47639%0.392SS..Hα-helixtrans-72.2-44.8-175.6-71.7-13.7000111.2P165 S210 L216 I217P165-D213 HydrophobicContact CB-CB 4.17Å; P165-D213 HydrophobicContact CG-CB 4.15Å; S210-D213 PolarHBondContact O-N 2.65Å; D213-L216 PolarHBondContact O-N 2.91Å; D213-I217 VanDerWaalsContact O-CG1 3.26Å; D213-I217 WeakPolarHBondContact O-CG1 3.5Å; D213-I217 PolarHBondContact O-N 3.36Å; D213-I217 VanDerWaalsContact O-N 3.07Å
214S96.2Very high93.9Very high0 Ų078.3 Ų78.30%039%0.391CS..Hα-helixtrans-64.7-44.7178.6-59.40000112.1T163 P165 S210 L216 I217 M218T163-S214 WeakPolarHBondContact O-CB 3.44Å; T163-S214 PolarHBondContact O-OG 2.85Å; P165-S214 WeakPolarHBondContact CD-OG 3.37Å; P165-S214 WeakPolarHBondContact CG-OG 3.25Å; S210-S214 PolarHBondContact O-N 3.17Å; S210-S214 PolarHBondContact O-OG 3.03Å; S214-L216 VanDerWaalsContact C-N 3.33Å; S214-L216 PolarHBondContact O-N 2.9Å; S214-I217 PolarHBondContact O-N 3.29Å; S214-I217 VanDerWaalsContact O-N 3.16Å; S214-M218 VanDerWaalsContact O-CG 3.25Å; S214-M218 WeakPolarHBondContact O-CG 3.27Å; S214-M218 PolarHBondContact O-N 3.2Å
215T96.4Very high94.2Very high43 Ų4371.4 Ų71.426%0.26435%0.353SS..Hα-helixtrans-65.7-36.2179.753.30000112.2L203 Y211 K212 M218 Q219L203-T215 HydrophobicContact CD1-CG2 4.2Å; Y211-T215 HydrophobicContact CD1-CG2 4.2Å; Y211-T215 HydrophobicContact CD2-CG2 4.5Å; Y211-T215 HydrophobicContact CE1-CG2 3.9Å; Y211-T215 HydrophobicContact CE2-CG2 4.22Å; Y211-T215 HydrophobicContact CG-CG2 4.49Å; Y211-T215 WeakPolarHBondContact O-CB 3.19Å; Y211-T215 VanDerWaalsContact O-CG2 3.25Å; Y211-T215 WeakPolarHBondContact O-CG2 3.46Å; Y211-T215 PolarHBondContact O-N 3.14Å; Y211-T215 PolarHBondContact O-OG1 3.34Å; K212-T215 PolarHBondContact O-OG1 3.41Å; T215-M218 PolarHBondContact O-N 3.03Å; T215-Q219 WeakPolarHBondContact O-CB 3.46Å; T215-Q219 PolarHBondContact O-N 3.42Å
216L97.2Very high94.6Very high99 Ų9971.5 Ų71.552%0.51835%0.354SS..Hα-helixtrans-61.6-43.2171.8178.662.6000111.7K212 D213 S214 Q219 L220K212-L216 WeakPolarHBondContact O-CB 3.11Å; K212-L216 PolarHBondContact O-N 3.11Å; K212-L216 VanDerWaalsContact O-N 3.15Å; D213-L216 PolarHBondContact O-N 2.91Å; S214-L216 VanDerWaalsContact C-N 3.33Å; S214-L216 PolarHBondContact O-N 2.9Å; L216-Q219 WeakPolarHBondContact O-CB 3.3Å; L216-Q219 PolarHBondContact O-N 2.93Å; L216-L220 WeakPolarHBondContact O-CG 3.39Å; L216-L220 PolarHBondContact O-N 3.45Å; L216-L220 VanDerWaalsContact O-N 3.12Å
217I98Very high94.8Very high28 Ų2874.7 Ų74.714%0.14437%0.371CS..Hα-helixtrans-69.7-39.7178.8-62164.8000111.2P165 L168 L172 D213 S214 Q219 L220 L221P165-I217 HydrophobicContact CB-CD1 4.19Å; P165-I217 VanDerWaalsContact O-CD1 3.29Å; P165-I217 WeakPolarHBondContact O-CD1 3.36Å; L168-I217 HydrophobicContact CB-CB 4.18Å; L168-I217 HydrophobicContact CB-CG2 3.6Å; L172-I217 HydrophobicContact CB-CG2 4.28Å; L172-I217 HydrophobicContact CD2-CG2 4.18Å; D213-I217 VanDerWaalsContact O-CG1 3.26Å; D213-I217 WeakPolarHBondContact O-CG1 3.5Å; D213-I217 PolarHBondContact O-N 3.36Å; D213-I217 VanDerWaalsContact O-N 3.07Å; S214-I217 PolarHBondContact O-N 3.29Å; S214-I217 VanDerWaalsContact O-N 3.16Å; I217-Q219 VanDerWaalsContact C-N 3.28Å; I217-Q219 PolarHBondContact O-N 3.13Å; I217-L220 WeakPolarHBondContact O-CB 3.37Å; I217-L220 PolarHBondContact O-N 3.45Å; I217-L221 PolarHBondContact O-N 3.1Å
218M97.9Very high95.2Very high10 Ų1072.2 Ų72.25%0.04935%0.352CS..Hα-helixtrans-60.6-39.4174.1-70.517072.200111.6L168 F196 A199 I200 L203 S214 T215 L221 R222L168-M218 HydrophobicContact CD1-CG 3.96Å; L168-M218 HydrophobicContact CD1-SD 4.4Å; L168-M218 HydrophobicContact CD2-CG 4.17Å; F196-M218 HydrophobicContact CD2-CB 4.1Å; F196-M218 WeakPolarHBondContact CD2-O 3.38Å; F196-M218 HydrophobicContact CE2-CB 4.09Å; F196-M218 WeakPolarHBondContact CE2-O 3.37Å; A199-M218 HydrophobicContact CB-CE 3.82Å; A199-M218 HydrophobicContact CB-CG 4.22Å; A199-M218 HydrophobicContact CB-SD 3.88Å; I200-M218 HydrophobicContact CB-CE 4.41Å; I200-M218 HydrophobicContact CG1-CE 3.51Å; L203-M218 HydrophobicContact CD1-CE 4.3Å; L203-M218 HydrophobicContact CD1-SD 3.96Å; S214-M218 VanDerWaalsContact O-CG 3.25Å; S214-M218 WeakPolarHBondContact O-CG 3.27Å; S214-M218 PolarHBondContact O-N 3.2Å; T215-M218 PolarHBondContact O-N 3.03Å; M218-L221 WeakPolarHBondContact O-CB 3.41Å; M218-L221 PolarHBondContact O-N 3.45Å; M218-R222 PolarHBondContact O-N 3.48Å
219Q97.9Very high95.3Very high62 Ų6266 Ų6629%0.2933%0.327SS..Hα-helixtrans-59.7-46.5173.3177.455.738.600111.4T215 L216 I217 L221 R222 D223T215-Q219 WeakPolarHBondContact O-CB 3.46Å; T215-Q219 PolarHBondContact O-N 3.42Å; L216-Q219 WeakPolarHBondContact O-CB 3.3Å; L216-Q219 PolarHBondContact O-N 2.93Å; I217-Q219 VanDerWaalsContact C-N 3.28Å; I217-Q219 PolarHBondContact O-N 3.13Å; Q219-L221 PolarHBondContact O-N 3.13Å; Q219-R222 WeakPolarHBondContact O-CB 3.47Å; Q219-R222 PolarHBondContact O-N 3.18Å; Q219-D223 PolarHBondContact NE2-OD1 3.19Å; Q219-D223 PolarHBondContact NE2-OD2 3.17Å; Q219-D223 PolarHBondContact O-N 3.39Å
220L98.3Very high95.2Very high74 Ų7460.5 Ų60.539%0.38731%0.308SS..Hα-helixtrans-63-39.2176.5-66.3172.1000112.7L172 L216 I217 D223 N224L172-L220 HydrophobicContact CD1-CB 4.09Å; L172-L220 HydrophobicContact CD2-CB 3.94Å; L172-L220 HydrophobicContact CD2-CD1 3.92Å; L216-L220 WeakPolarHBondContact O-CG 3.39Å; L216-L220 PolarHBondContact O-N 3.45Å; L216-L220 VanDerWaalsContact O-N 3.12Å; I217-L220 WeakPolarHBondContact O-CB 3.37Å; I217-L220 PolarHBondContact O-N 3.45Å; L220-D223 PolarHBondContact O-N 3.35Å; L220-N224 PolarHBondContact O-N 3.39Å
221L98.3Very high94.6Very high0 Ų062.1 Ų62.10%032%0.315CS..Hα-helixtrans-59.8-45.5174-78.5167.8000111.5L168 L172 A192 A195 F196 I217 M218 Q219 N224 L225L168-L221 HydrophobicContact CD2-CD1 4.01Å; L172-L221 HydrophobicContact CB-CD2 3.92Å; L172-L221 HydrophobicContact CB-CG 4.23Å; L172-L221 HydrophobicContact CD1-CD2 3.98Å; L172-L221 HydrophobicContact CD1-CG 4.18Å; A192-L221 HydrophobicContact CB-CD2 3.85Å; A195-L221 HydrophobicContact CB-CD1 4.33Å; F196-L221 HydrophobicContact CD2-CB 4.42Å; I217-L221 PolarHBondContact O-N 3.1Å; M218-L221 WeakPolarHBondContact O-CB 3.41Å; M218-L221 PolarHBondContact O-N 3.45Å; Q219-L221 PolarHBondContact O-N 3.13Å; L221-N224 PolarHBondContact O-N 2.99Å; L221-L225 WeakPolarHBondContact O-CG 3.49Å; L221-L225 PolarHBondContact O-N 3.23Å
222R97.5Very high93.5Very high117 Ų11758.5 Ų58.544%0.44231%0.305SS..Hα-helixtrans-63.3-41.5177.3-172.2-172.274.2-172.96.2112.3F196 M218 Q219 L225 T226F196-R222 HydrophobicContact CD2-CB 4.38Å; F196-R222 HydrophobicContact CE2-CB 3.84Å; F196-R222 HydrophobicContact CE2-CG 4.47Å; F196-R222 HydrophobicContact CZ-CB 4.13Å; F196-R222 HydrophobicContact CZ-CG 4.26Å; M218-R222 PolarHBondContact O-N 3.48Å; Q219-R222 WeakPolarHBondContact O-CB 3.47Å; Q219-R222 PolarHBondContact O-N 3.18Å; R222-L225 PolarHBondContact O-N 3.28Å; R222-T226 PolarHBondContact O-N 3.26Å; R222-T226 PolarHBondContact O-OG1 3.46Å
223D97.6Very high92.1Very high67 Ų6757.1 Ų57.136%0.35830%0.301SS..Hα-helixtrans-66.8-41.3-179.1-64.8-12.8000110.7Q219 L220 T226 L227Q219-D223 PolarHBondContact NE2-OD1 3.19Å; Q219-D223 PolarHBondContact NE2-OD2 3.17Å; Q219-D223 PolarHBondContact O-N 3.39Å; L220-D223 PolarHBondContact O-N 3.35Å; D223-T226 PolarHBondContact O-N 3.34Å; D223-L227 PolarHBondContact O-N 2.89Å
224N96.5Very high90.3Very high35 Ų3554.6 Ų54.619%0.18730%0.296CS..Hα-helixtrans-61.3-45.4172.2-78.51.6000112.4L172 L220 L221 T226 L227 W228L172-N224 VanDerWaalsContact CD1-ND2 3.31Å; L172-N224 WeakPolarHBondContact CD1-ND2 3.28Å; L220-N224 PolarHBondContact O-N 3.39Å; L221-N224 PolarHBondContact O-N 2.99Å; N224-T226 VanDerWaalsContact C-N 3.26Å; N224-T226 PolarHBondContact O-N 3.24Å; N224-L227 PolarHBondContact O-N 2.93Å; N224-W228 HydrophobicContact CB-CD2 4.19Å; N224-W228 HydrophobicContact CB-CE3 4.05Å; N224-W228 HydrophobicContact CB-CH2 3.67Å; N224-W228 HydrophobicContact CB-CZ2 3.8Å; N224-W228 HydrophobicContact CB-CZ3 3.79Å; N224-W228 WeakPolarHBondContact ND2-CH2 3.37Å; N224-W228 WeakPolarHBondContact O-CB 3.49Å; N224-W228 VanDerWaalsContact O-CD2 3.27Å; N224-W228 PolarHBondContact O-N 3.22Å
225L96.4Very high88.2Confident26 Ų2660.3 Ų60.314%0.13633%0.327CS..Hα-helixtrans-57.7-41.4176-77.2168.5000111.8C189 A192 K193 L221 R222 T229C189-L225 HydrophobicContact CB-CD2 4.05Å; C189-L225 WeakPolarHBondContact O-CD2 3.43Å; A192-L225 HydrophobicContact CB-CD1 4.34Å; A192-L225 HydrophobicContact CB-CD2 3.85Å; A192-L225 HydrophobicContact CB-CG 3.93Å; K193-L225 HydrophobicContact CB-CD1 4.15Å; K193-L225 HydrophobicContact CB-CD2 4.07Å; L221-L225 WeakPolarHBondContact O-CG 3.49Å; L221-L225 PolarHBondContact O-N 3.23Å; R222-L225 PolarHBondContact O-N 3.28Å; L225-T229 WeakPolarHBondContact O-CB 3.42Å; L225-T229 VanDerWaalsContact O-CG2 3.23Å; L225-T229 WeakPolarHBondContact O-CG2 3.26Å; L225-T229 PolarHBondContact O-N 3.45Å; L225-T229 VanDerWaalsContact O-N 3.08Å; L225-T229 PolarHBondContact O-OG1 2.89Å
226T95.5Very high86Confident87 Ų8765.2 Ų65.253%0.53435%0.347SS..Hα-helixtrans-64-46.9178.6-54.80000110.8R222 D223 N224 T229 S230R222-T226 PolarHBondContact O-N 3.26Å; R222-T226 PolarHBondContact O-OG1 3.46Å; D223-T226 PolarHBondContact O-N 3.34Å; N224-T226 VanDerWaalsContact C-N 3.26Å; N224-T226 PolarHBondContact O-N 3.24Å; T226-T229 PolarHBondContact O-OG1 3.5Å; T226-S230 PolarHBondContact O-N 3.2Å; T226-S230 PolarHBondContact O-OG 3.22Å
227L94.3Very high83.6Confident93 Ų9363.7 Ų63.749%0.48735%0.348SS..Hα-helixtrans-62.1-49.2178.9-178.966.1000112.2D223 N224 T229 S230 D231D223-L227 PolarHBondContact O-N 2.89Å; N224-L227 PolarHBondContact O-N 2.93Å; L227-T229 VanDerWaalsContact C-N 3.33Å; L227-T229 PolarHBondContact O-N 3.37Å; L227-S230 PolarHBondContact O-N 3.18Å; L227-S230 PolarHBondContact O-OG 3.35Å; L227-D231 PolarHBondContact O-N 3.15Å
228W94.6Very high80.9Confident7 Ų769.9 Ų69.93%0.02738%0.377CS..Hα-helixtrans-74.3-24.5-174.1-58.1-26.4000113.5S175 V176 Y179 A188 A192 N224 T232S175-W228 WeakPolarHBondContact OG-CH2 3.4Å; V176-W228 HydrophobicContact CG2-CH2 3.92Å; V176-W228 HydrophobicContact CG2-CZ2 3.95Å; Y179-W228 AromaticContact CD1-CD1 3.78Å; Y179-W228 AromaticContact CD1-CE2 3.92Å; Y179-W228 HydrophobicContact CD1-CG 4.47Å; Y179-W228 HydrophobicContact CD1-CZ2 4.46Å; Y179-W228 AromaticContact CD1-NE1 3.38Å; Y179-W228 HydrophobicContact CD2-CB 4.04Å; Y179-W228 AromaticContact CD2-CD1 3.59Å; Y179-W228 AromaticContact CD2-CD2 3.74Å; Y179-W228 HydrophobicContact CD2-CD2 3.74Å; Y179-W228 AromaticContact CD2-CE2 3.91Å; Y179-W228 HydrophobicContact CD2-CE3 4.46Å; Y179-W228 AromaticContact CD2-CG 3.53Å; Y179-W228 HydrophobicContact CD2-CG 3.53Å; Y179-W228 AromaticContact CD2-NE1 3.8Å; Y179-W228 AromaticContact CE1-CD1 3.46Å; Y179-W228 VanDerWaalsContact CE1-CD1 3.46Å; Y179-W228 HydrophobicContact CE1-CG 4.35Å; Y179-W228 AromaticContact CE1-NE1 3.46Å; Y179-W228 HydrophobicContact CE2-CB 3.65Å; Y179-W228 AromaticContact CE2-CD1 3.28Å; Y179-W228 HydrophobicContact CE2-CD2 4.14Å; Y179-W228 AromaticContact CE2-CG 3.41Å; Y179-W228 HydrophobicContact CE2-CG 3.41Å; Y179-W228 VanDerWaalsContact CE2-CG 3.41Å; Y179-W228 AromaticContact CE2-NE1 3.9Å; Y179-W228 AromaticContact CG-CD1 3.83Å; Y179-W228 AromaticContact CG-CD2 3.99Å; Y179-W228 HydrophobicContact CG-CD2 3.99Å; Y179-W228 AromaticContact CG-CE2 3.65Å; Y179-W228 HydrophobicContact CG-CG 4.08Å; Y179-W228 HydrophobicContact CG-CZ2 4.14Å; Y179-W228 AromaticContact CG-NE1 3.55Å; Y179-W228 AromaticContact CZ-CD1 3.2Å; Y179-W228 AromaticContact CZ-CG 3.84Å; Y179-W228 AromaticContact CZ-NE1 3.73Å; A188-W228 HydrophobicContact CB-CE3 4.08Å; A188-W228 HydrophobicContact CB-CZ3 3.97Å; A192-W228 HydrophobicContact CB-CZ3 4.38Å; N224-W228 HydrophobicContact CB-CD2 4.19Å; N224-W228 HydrophobicContact CB-CE3 4.05Å; N224-W228 HydrophobicContact CB-CH2 3.67Å; N224-W228 HydrophobicContact CB-CZ2 3.8Å; N224-W228 HydrophobicContact CB-CZ3 3.79Å; N224-W228 WeakPolarHBondContact ND2-CH2 3.37Å; N224-W228 WeakPolarHBondContact O-CB 3.49Å; N224-W228 VanDerWaalsContact O-CD2 3.27Å; N224-W228 PolarHBondContact O-N 3.22Å; W228-T232 PolarHBondContact O-N 3.4Å; W228-T232 PolarHBondContact O-OG1 2.69Å
229T89.8Confident78.5Confident57 Ų5773.7 Ų73.735%0.3541%0.41SS..Hα-helixtrans-82.3-23174.654.30000113.2L225 T226 L227 T232 Q233L225-T229 WeakPolarHBondContact O-CB 3.42Å; L225-T229 VanDerWaalsContact O-CG2 3.23Å; L225-T229 WeakPolarHBondContact O-CG2 3.26Å; L225-T229 PolarHBondContact O-N 3.45Å; L225-T229 VanDerWaalsContact O-N 3.08Å; L225-T229 PolarHBondContact O-OG1 2.89Å; T226-T229 PolarHBondContact O-OG1 3.5Å; L227-T229 VanDerWaalsContact C-N 3.33Å; L227-T229 PolarHBondContact O-N 3.37Å; T229-T232 PolarHBondContact O-OG1 3.38Å; T229-Q233 WeakPolarHBondContact O-CG 3.34Å
230S86Confident75.8Confident62 Ų6273.6 Ų73.643%0.43443%0.426SS..Hα-helixtrans-73.7-36.9168.554.10000112.2T226 L227 Q233 G234T226-S230 PolarHBondContact O-N 3.2Å; T226-S230 PolarHBondContact O-OG 3.22Å; L227-S230 PolarHBondContact O-N 3.18Å; L227-S230 PolarHBondContact O-OG 3.35Å; S230-Q233 PolarHBondContact O-N 2.97Å; S230-G234 PolarHBondContact O-N 2.85Å; S230-G234 VanDerWaalsContact O-N 3.12Å
231D77.4Confident73.2Confident66 Ų6678.4 Ų78.435%0.35345%0.446SS..Hα-helixtrans-64.7-43.2179.5-69.9-4.6000111.1Y179 L227 Q233 G234 D235Y179-D231 PolarHBondContact OH-OD2 2.87Å; L227-D231 PolarHBondContact O-N 3.15Å; D231-Q233 PolarHBondContact O-N 2.97Å; D231-G234 PolarHBondContact O-N 2.96Å; D231-D235 PolarHBondContact O-N 3.28Å
232T70.3Confident70.2Confident45 Ų4581.9 Ų81.928%0.27648%0.482SS..Hα-helixtrans-67.6-31.6177.644.50000114P185 W228 T229 E236P185-T232 HydrophobicContact CB-CG2 4.12Å; P185-T232 HydrophobicContact CG-CG2 4.22Å; W228-T232 PolarHBondContact O-N 3.4Å; W228-T232 PolarHBondContact O-OG1 2.69Å; T229-T232 PolarHBondContact O-OG1 3.38Å; T232-E236 WeakPolarHBondContact O-CG 3.47Å; T232-E236 PolarHBondContact O-N 3.36Å
233Q63.3Low67.2Low132 Ų13279.8 Ų79.862%0.61750%0.497SS*.Hα-helixtrans-73.8-29.6174.8-72.1175.831.300112.6T229 S230 D231 A237T229-Q233 WeakPolarHBondContact O-CG 3.34Å; S230-Q233 PolarHBondContact O-N 2.97Å; D231-Q233 PolarHBondContact O-N 2.97Å; Q233-A237 PolarHBondContact O-N 3.42Å
234G56.2Low64.4Low36 Ų3685.3 Ų85.337%0.37152%0.52SS..Hα-helixtrans-67.5-45.9174.700000112.4S230 D231 E236 A237 E238S230-G234 PolarHBondContact O-N 2.85Å; S230-G234 VanDerWaalsContact O-N 3.12Å; D231-G234 PolarHBondContact O-N 2.96Å; G234-E236 VanDerWaalsContact C-N 3.33Å; G234-E236 PolarHBondContact O-N 2.88Å; G234-A237 PolarHBondContact O-N 3.26Å; G234-A237 VanDerWaalsContact O-N 3.17Å; G234-E238 PolarHBondContact O-N 3.49Å; G234-E238 VanDerWaalsContact O-N 3.13Å
235D53.4Low61.6Low120 Ų12094.9 Ų94.964%0.64257%0.571SS**Hα-helixtrans-66-34.8178.3-72.7-13.8000112.2D231 A237 A239D231-D235 PolarHBondContact O-N 3.28Å; D235-A237 VanDerWaalsContact C-N 3.35Å; D235-A239 PolarHBondContact O-N 3.27Å; D235-A239 VanDerWaalsContact O-N 3.13Å
236E50Low59.8Low147 Ų14798.3 Ų98.369%0.68759%0.593SS**Hα-helixtrans-68.4-31.9173.6-75.8-178.7-179.200112.7T232 G234 G240T232-E236 WeakPolarHBondContact O-CG 3.47Å; T232-E236 PolarHBondContact O-N 3.36Å; G234-E236 VanDerWaalsContact C-N 3.33Å; G234-E236 PolarHBondContact O-N 2.88Å; E236-G240 PolarHBondContact O-N 3.43Å
237A46.8Very low58Low66 Ų6698.9 Ų98.955%0.54560%0.596SS.*Hα-helixtrans-72.4-38.7176.800000112.1Q233 G234 D235 G240Q233-A237 PolarHBondContact O-N 3.42Å; G234-A237 PolarHBondContact O-N 3.26Å; G234-A237 VanDerWaalsContact O-N 3.17Å; D235-A237 VanDerWaalsContact C-N 3.35Å; A237-G240 PolarHBondContact O-N 2.82Å
238E41.4Very low55.9Low158 Ų15899.2 Ų99.274%0.73860%0.602SS**Hα-helixtrans-71.3-30175.2-71.6-166.2174.900112.6G234 G240G234-E238 PolarHBondContact O-N 3.49Å; G234-E238 VanDerWaalsContact O-N 3.13Å; E238-G240 PolarHBondContact O-N 3.35Å
239A47.4Very low53.7Low90 Ų90104.6 Ų104.674%0.74464%0.636SS**THydrogen-bonded Turntrans-69.6-13.1171.700000113.4D235D235-A239 PolarHBondContact O-N 3.27Å; D235-A239 VanDerWaalsContact O-N 3.13Å
240G41.6Very low51.4Low61 Ų61107.6 Ų107.663%0.62965%0.654SS**THydrogen-bonded Turntrans-91.7-11.3-178.300000116.1E236 A237 E238 G242E236-G240 PolarHBondContact O-N 3.43Å; A237-G240 PolarHBondContact O-N 2.82Å; E238-G240 PolarHBondContact O-N 3.35Å; G240-G242 PolarHBondContact O-N 3.05Å
241E42.2Very low49.1Very low175 Ų175110.7 Ų110.782%0.81867%0.669SS**SBendtrans-93.784.5172.6-65.7-167.2170.800108.9
242G35.6Very low47.1Very low72 Ų72113.9 Ų113.974%0.74269%0.691SS**  65.595.494.900000110.9G240G240-G242 PolarHBondContact O-N 3.05Å
243G35.7Very low45.3Very low73 Ų73119.2 Ų119.275%0.75372%0.723SS**  73.791.958.400000109.6
244E37.4Very low43.8Very low183 Ų183118.1 Ų118.186%0.85573%0.732SS**  trans-176.8114.5153.6-105167.4-157.500111.3
245N38.1Very low42.7Very low236 Ų236125.5 Ų125.5100%1.26277%0.765SS**  trans61.40156.8-59.2-29.2000120.4

Retrieved 245 of 245 residues in 762.3 ms (Link to these results)

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