1433S_BOVIN Loading...

14-3-3 protein sigma

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. Promotes cytosolic retention of GBP1 GTPase by binding to phosphorylated GBP1, thereby inhibiting the innate immune response. Also acts as a TP53/p53-regulated inhibitor of G2/M progression (By similarity). When bound to KRT17, regulates protein synthesis and epithelial cell growth by stimulating Akt/mTOR pathway (By similarity). Acts to maintain desmosome cell junction adhesion in epithelial cells via interacting with and sequestering PKP3 to the cytoplasm, thereby restricting its translocation to existing desmosome structures and therefore maintaining desmosome protein homeostasis (By similarity). Also acts to facilitate PKP3 exchange at desmosome plaques, thereby maintaining keratinocyte intercellular adhesion (By similarity). May also regulate MDM2 autoubiquitination and degradation and thereby activate p53/TP53 (By similarity).

AlphaFold DB , UniProt , Accession Q0VC36, Species BOVIN (Bos taurus, Bovine), Gene SFN, Length 248 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
1M73.6Confident94.4Very high115 Ų11558.7 Ų58.757%0.56731%0.307SS*.  0140.50-169.1178.7-4800108S5 L6 K9 K32M1-S5 WeakPolarHBondContact CG-OG 3.42Å; M1-S5 PolarHBondContact SD-OG 3.23Å; M1-L6 HydrophobicContact CB-CD2 4.37Å; M1-L6 HydrophobicContact CB-CG 4.35Å; M1-L6 HydrophobicContact CE-CD2 4.29Å; M1-L6 HydrophobicContact CG-CD2 4.29Å; M1-L6 HydrophobicContact CG-CG 4.16Å; M1-L6 HydrophobicContact SD-CD2 3.52Å; M1-L6 VanDerWaalsContact SD-CD2 3.52Å; M1-L6 HydrophobicContact SD-CG 3.87Å; M1-K9 HydrophobicContact CE-CD 4.05Å; M1-K9 HydrophobicContact SD-CD 3.7Å; M1-K32 WeakPolarHBondContact O-CE 3.42Å; M1-K32 PolarHBondContact O-NZ 3.44Å
2E90.9Very high94.7Very high139 Ų13961.7 Ų61.765%0.6532%0.323SS*.  trans-70.2152.2176.6-67.5-49.5128.200112.2A4 S5 L6E2-A4 VanDerWaalsContact C-N 3.35Å; E2-A4 PolarHBondContact O-N 3.37Å; E2-S5 WeakPolarHBondContact O-CB 3.45Å; E2-S5 PolarHBondContact O-N 3.19Å; E2-S5 VanDerWaalsContact O-N 3.08Å; E2-L6 PolarHBondContact O-N 3.35Å; E2-L6 VanDerWaalsContact O-N 3.11Å
3R93.2Very high95Very high23 Ų2357.5 Ų57.59%0.08730%0.303CS..Hα-helixtrans-56.3-48.7-179.3-168.6178.9168.4-85.42.3111.3S5 L6 I7 A29 K32 E34 E35 L36 E40R3-S5 PolarHBondContact O-N 3.49Å; R3-L6 WeakPolarHBondContact O-CA 3.42Å; R3-L6 WeakPolarHBondContact O-CB 3.3Å; R3-L6 PolarHBondContact O-N 3.36Å; R3-I7 PolarHBondContact O-N 3.35Å; R3-A29 HydrophobicContact CG-CB 4.27Å; R3-K32 HydrophobicContact CB-CD 3.67Å; R3-K32 HydrophobicContact CG-CD 4.13Å; R3-E34 WeakPolarHBondContact CD-OE1 3.35Å; R3-E34 WeakPolarHBondContact CD-OE2 3.33Å; R3-E34 IonicContact CZ-OE2 3.29Å; R3-E34 IonicContact NE-OE2 3.19Å; R3-E34 IonicContact NH1-OE2 3.91Å; R3-E35 PolarHBondContact NH2-O 2.98Å; R3-L36 VanDerWaalsContact NH2-CD2 3.32Å; R3-E40 IonicContact CZ-OE1 3.68Å; R3-E40 IonicContact CZ-OE2 2.7Å; R3-E40 IonicContact NH1-OE1 3.15Å; R3-E40 PolarHBondContact NH1-OE1 3Å; R3-E40 IonicContact NH1-OE2 2.75Å; R3-E40 IonicContact NH2-OE1 3.11Å; R3-E40 PolarHBondContact NH2-OE1 2.95Å; R3-E40 IonicContact NH2-OE2 2.71Å; R3-E40 PolarHBondContact NH2-OE2 3.12Å
4A94.6Very high95.3Very high76 Ų7658.4 Ų58.463%0.62831%0.305SS*.Hα-helixtrans-56.4-37177.200000112.9E2 I7 Q8E2-A4 VanDerWaalsContact C-N 3.35Å; E2-A4 PolarHBondContact O-N 3.37Å; A4-I7 PolarHBondContact O-N 3.12Å; A4-Q8 WeakPolarHBondContact O-CB 3.33Å; A4-Q8 PolarHBondContact O-N 3.31Å
5S97Very high95.4Very high48 Ų4864.9 Ų64.934%0.33633%0.333SS..Hα-helixtrans-70.9-31.5176175.90000112.5M1 E2 R3 K9M1-S5 WeakPolarHBondContact CG-OG 3.42Å; M1-S5 PolarHBondContact SD-OG 3.23Å; E2-S5 WeakPolarHBondContact O-CB 3.45Å; E2-S5 PolarHBondContact O-N 3.19Å; E2-S5 VanDerWaalsContact O-N 3.08Å; R3-S5 PolarHBondContact O-N 3.49Å; S5-K9 VanDerWaalsContact O-CG 3.31Å; S5-K9 WeakPolarHBondContact O-CG 3.4Å; S5-K9 PolarHBondContact O-N 2.89Å; S5-K9 VanDerWaalsContact O-N 3.12Å
6L97.8Very high95.6Very high9 Ų964.6 Ų64.65%0.04734%0.343CS..Hα-helixtrans-68.9-45.3174.3-69.2163.5000110.7M1 E2 R3 Q8 K9 A10 F25 A29 K32M1-L6 HydrophobicContact CB-CD2 4.37Å; M1-L6 HydrophobicContact CB-CG 4.35Å; M1-L6 HydrophobicContact CE-CD2 4.29Å; M1-L6 HydrophobicContact CG-CD2 4.29Å; M1-L6 HydrophobicContact CG-CG 4.16Å; M1-L6 HydrophobicContact SD-CD2 3.52Å; M1-L6 VanDerWaalsContact SD-CD2 3.52Å; M1-L6 HydrophobicContact SD-CG 3.87Å; E2-L6 PolarHBondContact O-N 3.35Å; E2-L6 VanDerWaalsContact O-N 3.11Å; R3-L6 WeakPolarHBondContact O-CA 3.42Å; R3-L6 WeakPolarHBondContact O-CB 3.3Å; R3-L6 PolarHBondContact O-N 3.36Å; L6-Q8 VanDerWaalsContact C-N 3.34Å; L6-Q8 PolarHBondContact O-N 2.96Å; L6-K9 PolarHBondContact O-N 3.38Å; L6-K9 VanDerWaalsContact O-N 3.15Å; L6-A10 PolarHBondContact O-N 3.09Å; L6-F25 HydrophobicContact CD2-CD1 4.14Å; L6-A29 HydrophobicContact CB-CB 4.04Å; L6-A29 HydrophobicContact CD1-CB 4.37Å; L6-K32 HydrophobicContact CD1-CD 4.06Å
7I97.9Very high95.7Very high10 Ų1069.2 Ų69.25%0.05136%0.362CS..Hα-helixtrans-60.5-44.1175.9-60.3-55.5000111R3 A4 K9 A10 K11 M26 A29 E40 L43R3-I7 PolarHBondContact O-N 3.35Å; A4-I7 PolarHBondContact O-N 3.12Å; I7-K9 VanDerWaalsContact C-N 3.3Å; I7-K9 PolarHBondContact O-N 3.32Å; I7-A10 WeakPolarHBondContact O-CB 3.39Å; I7-A10 PolarHBondContact O-N 2.92Å; I7-A10 VanDerWaalsContact O-N 3.17Å; I7-K11 WeakPolarHBondContact O-CG 3.47Å; I7-K11 PolarHBondContact O-N 3.19Å; I7-M26 HydrophobicContact CD1-CE 3.79Å; I7-M26 HydrophobicContact CD1-SD 3.64Å; I7-A29 HydrophobicContact CD1-CB 3.65Å; I7-A29 HydrophobicContact CG1-CB 4.39Å; I7-E40 HydrophobicContact CD1-CB 4.42Å; I7-E40 HydrophobicContact CD1-CG 3.94Å; I7-E40 HydrophobicContact CG1-CG 4.23Å; I7-E40 HydrophobicContact CG2-CG 4.1Å; I7-L43 HydrophobicContact CG2-CD1 4.17Å
8Q97.9Very high95.9Very high103 Ų10373.1 Ų73.148%0.48137%0.371SS..Hα-helixtrans-61.4-39176.1-174.559.828.300112.3A4 L6 K11 L12A4-Q8 WeakPolarHBondContact O-CB 3.33Å; A4-Q8 PolarHBondContact O-N 3.31Å; L6-Q8 VanDerWaalsContact C-N 3.34Å; L6-Q8 PolarHBondContact O-N 2.96Å; Q8-K11 PolarHBondContact O-N 3.45Å; Q8-L12 WeakPolarHBondContact O-CG 3.36Å; Q8-L12 PolarHBondContact O-N 2.97Å
9K98.4Very high96Very high78 Ų7872 Ų7234%0.33936%0.363SS..Hα-helixtrans-68.1-36.6175.2-74.6-175.1-177.3-160.40112.4M1 S5 L6 I7 L12 A13 F25M1-K9 HydrophobicContact CE-CD 4.05Å; M1-K9 HydrophobicContact SD-CD 3.7Å; S5-K9 VanDerWaalsContact O-CG 3.31Å; S5-K9 WeakPolarHBondContact O-CG 3.4Å; S5-K9 PolarHBondContact O-N 2.89Å; S5-K9 VanDerWaalsContact O-N 3.12Å; L6-K9 PolarHBondContact O-N 3.38Å; L6-K9 VanDerWaalsContact O-N 3.15Å; I7-K9 VanDerWaalsContact C-N 3.3Å; I7-K9 PolarHBondContact O-N 3.32Å; K9-L12 PolarHBondContact O-N 3.37Å; K9-A13 WeakPolarHBondContact O-CB 3.11Å; K9-A13 PolarHBondContact O-N 3.05Å; K9-F25 HydrophobicContact CB-CD1 4.06Å; K9-F25 HydrophobicContact CB-CD2 3.57Å; K9-F25 HydrophobicContact CB-CE1 4.16Å; K9-F25 HydrophobicContact CB-CE2 3.68Å; K9-F25 HydrophobicContact CB-CG 3.79Å; K9-F25 HydrophobicContact CB-CZ 3.98Å; K9-F25 HydrophobicContact CD-CD1 4.14Å; K9-F25 HydrophobicContact CD-CE1 3.71Å; K9-F25 HydrophobicContact CD-CE2 4.43Å; K9-F25 HydrophobicContact CD-CZ 3.88Å; K9-F25 HydrophobicContact CG-CZ 4.47Å
10A98.5Very high96.1Very high0 Ų074.3 Ų74.30%037%0.372CS..Hα-helixtrans-61.3-44.1173.300000111.4L6 I7 L12 A13 E14 M22 F25 M26L6-A10 PolarHBondContact O-N 3.09Å; I7-A10 WeakPolarHBondContact O-CB 3.39Å; I7-A10 PolarHBondContact O-N 2.92Å; I7-A10 VanDerWaalsContact O-N 3.17Å; A10-L12 VanDerWaalsContact C-N 3.34Å; A10-L12 PolarHBondContact O-N 2.72Å; A10-A13 PolarHBondContact O-N 3.24Å; A10-E14 PolarHBondContact O-N 3.48Å; A10-M22 HydrophobicContact CB-CG 4.13Å; A10-F25 HydrophobicContact CB-CB 4.12Å; A10-M26 HydrophobicContact CB-CG 3.8Å; A10-M26 HydrophobicContact CB-SD 3.55Å; A10-M26 VanDerWaalsContact CB-SD 3.55Å
11K98.4Very high96.2Very high45 Ų4573.4 Ų73.420%0.19637%0.369CS..Hα-helixtrans-61.2-39.7174.4-66.6-177.7-176.6-166.60112.8I7 Q8 Q15 E39 L43I7-K11 WeakPolarHBondContact O-CG 3.47Å; I7-K11 PolarHBondContact O-N 3.19Å; Q8-K11 PolarHBondContact O-N 3.45Å; K11-Q15 WeakPolarHBondContact O-CG 3.34Å; K11-Q15 PolarHBondContact O-N 2.93Å; K11-E39 VanDerWaalsContact CE-OE1 3.28Å; K11-E39 WeakPolarHBondContact CE-OE1 3.31Å; K11-E39 IonicContact NZ-OE1 3.53Å; K11-E39 PolarHBondContact NZ-OE1 2.9Å; K11-E39 IonicContact NZ-OE2 2.76Å; K11-E39 PolarHBondContact NZ-OE2 3.37Å; K11-L43 HydrophobicContact CD-CD1 4.46Å; K11-L43 HydrophobicContact CG-CD1 3.76Å; K11-L43 HydrophobicContact CG-CD2 4.18Å
12L98.6Very high97.4Very high94 Ų9468 Ų6849%0.49234%0.342SS..Hα-helixtrans-67.9-38.8175-69.9171.1000112Q8 K9 A10 Q15 A16Q8-L12 WeakPolarHBondContact O-CG 3.36Å; Q8-L12 PolarHBondContact O-N 2.97Å; K9-L12 PolarHBondContact O-N 3.37Å; A10-L12 VanDerWaalsContact C-N 3.34Å; A10-L12 PolarHBondContact O-N 2.72Å; L12-Q15 PolarHBondContact O-N 3.46Å; L12-A16 WeakPolarHBondContact O-CB 3.48Å; L12-A16 PolarHBondContact O-N 3.39Å; L12-A16 VanDerWaalsContact O-N 3.17Å
13A98.5Very high97.7Very high8 Ų861.7 Ų61.77%0.06631%0.314CS..Hα-helixtrans-66.6-38.7176.800000111.7K9 A10 A16 E17 R18 D21 M22 F25K9-A13 WeakPolarHBondContact O-CB 3.11Å; K9-A13 PolarHBondContact O-N 3.05Å; A10-A13 PolarHBondContact O-N 3.24Å; A13-A16 CarbonylContact O-C 3.54Å; A13-A16 PolarHBondContact O-N 3.32Å; A13-E17 PolarHBondContact O-N 3.14Å; A13-R18 HydrophobicContact CB-CB 4.42Å; A13-R18 PolarHBondContact O-N 3.13Å; A13-D21 HydrophobicContact CB-CB 4.19Å; A13-M22 HydrophobicContact CB-CB 3.86Å; A13-M22 HydrophobicContact CB-CG 4.47Å; A13-F25 HydrophobicContact CB-CD2 4.32Å; A13-F25 HydrophobicContact CB-CE2 4.31Å
14E98.2Very high98Very high70 Ų7063 Ų6333%0.32733%0.33SS..Hα-helixtrans-58.1-50.5172.6-177.2-177.7-146.300111.6A10 A16 E17 M22 L43A10-E14 PolarHBondContact O-N 3.48Å; E14-A16 PolarHBondContact O-N 3.5Å; E14-E17 PolarHBondContact O-N 2.85Å; E14-M22 HydrophobicContact CB-CE 3.9Å; E14-M22 HydrophobicContact CB-SD 3.9Å; E14-M22 HydrophobicContact CG-CE 4.16Å; E14-M22 HydrophobicContact CG-SD 4.37Å; E14-L43 VanDerWaalsContact OE2-CD2 3.28Å; E14-L43 WeakPolarHBondContact OE2-CD2 3.27Å
15Q97.8Very high98.2Very high156 Ų15661.7 Ų61.773%0.72931%0.31SS*.Hα-helixtrans-62.5-24.8178.2-70.4175.538.300113.4K11 L12K11-Q15 WeakPolarHBondContact O-CG 3.34Å; K11-Q15 PolarHBondContact O-N 2.93Å; L12-Q15 PolarHBondContact O-N 3.46Å
16A98.1Very high98.2Very high60 Ų6059.4 Ų59.450%0.49629%0.294SS..THydrogen-bonded Turntrans-95.54.1176.200000113.1L12 A13 E14 R18L12-A16 WeakPolarHBondContact O-CB 3.48Å; L12-A16 PolarHBondContact O-N 3.39Å; L12-A16 VanDerWaalsContact O-N 3.17Å; A13-A16 CarbonylContact O-C 3.54Å; A13-A16 PolarHBondContact O-N 3.32Å; E14-A16 PolarHBondContact O-N 3.5Å; A16-R18 HydrophobicContact CB-CG 4.19Å; A16-R18 PolarHBondContact O-N 3.26Å; A16-R18 VanDerWaalsContact O-N 3.17Å
17E97.6Very high98.2Very high143 Ų14362.3 Ų62.367%0.66831%0.306SS*.THydrogen-bonded Turntrans53.530.5-175.7-56.8-175.3165.200113.8A13 E14 Y19A13-E17 PolarHBondContact O-N 3.14Å; E14-E17 PolarHBondContact O-N 2.85Å; E17-Y19 HydrophobicContact CB-CE2 4Å; E17-Y19 WeakPolarHBondContact O-CD2 3.25Å; E17-Y19 PolarHBondContact O-N 3.47Å
18R98.3Very high98.2Very high139 Ų13964.2 Ų64.253%0.52532%0.32SS..  trans-94.772.1177.2-66.8-174.660.496.18.9110.2A13 A16 E20 D21 M22A13-R18 HydrophobicContact CB-CB 4.42Å; A13-R18 PolarHBondContact O-N 3.13Å; A16-R18 HydrophobicContact CB-CG 4.19Å; A16-R18 PolarHBondContact O-N 3.26Å; A16-R18 VanDerWaalsContact O-N 3.17Å; R18-E20 VanDerWaalsContact C-N 3.32Å; R18-E20 PolarHBondContact O-N 3.41Å; R18-D21 HydrophobicContact CB-CB 4.21Å; R18-D21 IonicContact CZ-OD2 2.78Å; R18-D21 IonicContact NE-OD2 2.66Å; R18-D21 PolarHBondContact NE-OD2 3.37Å; R18-D21 IonicContact NH2-OD1 3.64Å; R18-D21 PolarHBondContact NH2-OD1 3.4Å; R18-D21 IonicContact NH2-OD2 3.82Å; R18-D21 PolarHBondContact NH2-OD2 3.02Å; R18-D21 PolarHBondContact O-N 2.91Å; R18-M22 PolarHBondContact O-N 2.71Å
19Y98.3Very high98.2Very high52 Ų5259.3 Ų59.320%0.20430%0.297CS..Hα-helixtrans-67.3-28-170.3-59.2-67.7000114.2E17 M22 A23 V46 N50E17-Y19 HydrophobicContact CB-CE2 4Å; E17-Y19 WeakPolarHBondContact O-CD2 3.25Å; E17-Y19 PolarHBondContact O-N 3.47Å; Y19-M22 HydrophobicContact CD1-SD 4.1Å; Y19-M22 WeakPolarHBondContact O-CB 3.28Å; Y19-M22 PolarHBondContact O-N 3.31Å; Y19-A23 WeakPolarHBondContact O-CB 3.5Å; Y19-A23 PolarHBondContact O-N 3.44Å; Y19-V46 HydrophobicContact CE1-CG1 4.28Å; Y19-N50 HydrophobicContact CD1-CB 3.58Å; Y19-N50 HydrophobicContact CD2-CB 3.49Å; Y19-N50 VanDerWaalsContact CD2-CB 3.49Å; Y19-N50 HydrophobicContact CE1-CB 3.94Å; Y19-N50 VanDerWaalsContact CE1-ND2 3.35Å; Y19-N50 WeakPolarHBondContact CE1-ND2 3.46Å; Y19-N50 HydrophobicContact CE2-CB 3.86Å; Y19-N50 HydrophobicContact CG-CB 3.32Å
20E98Very high98.1Very high118 Ų11855.7 Ų55.755%0.55128%0.282SS*.Hα-helixtrans-66.7-43.4174.2-64.973.1-162.600111.2R18 M22 A23 A24 V51R18-E20 VanDerWaalsContact C-N 3.32Å; R18-E20 PolarHBondContact O-N 3.41Å; E20-M22 VanDerWaalsContact C-N 3.35Å; E20-A23 PolarHBondContact O-N 2.82Å; E20-A24 PolarHBondContact O-N 2.86Å; E20-V51 HydrophobicContact CG-CG2 4.27Å
21D98.5Very high98Very high56 Ų5660.4 Ų60.430%0.29930%0.304SS..Hα-helixtrans-65.7-43174.8-68-6.9000109.9A13 R18 A23 A24 F25A13-D21 HydrophobicContact CB-CB 4.19Å; R18-D21 HydrophobicContact CB-CB 4.21Å; R18-D21 IonicContact CZ-OD2 2.78Å; R18-D21 IonicContact NE-OD2 2.66Å; R18-D21 PolarHBondContact NE-OD2 3.37Å; R18-D21 IonicContact NH2-OD1 3.64Å; R18-D21 PolarHBondContact NH2-OD1 3.4Å; R18-D21 IonicContact NH2-OD2 3.82Å; R18-D21 PolarHBondContact NH2-OD2 3.02Å; R18-D21 PolarHBondContact O-N 2.91Å; D21-A23 VanDerWaalsContact C-N 3.32Å; D21-A23 PolarHBondContact O-N 2.88Å; D21-A24 PolarHBondContact O-N 3.16Å; D21-F25 HydrophobicContact CB-CD2 4.41Å; D21-F25 HydrophobicContact CB-CE2 3.87Å; D21-F25 HydrophobicContact CB-CZ 4.46Å; D21-F25 WeakPolarHBondContact O-CD2 3.42Å; D21-F25 VanDerWaalsContact O-CG 3.28Å; D21-F25 WeakPolarHBondContact O-CG 3.31Å; D21-F25 PolarHBondContact O-N 3.24Å
22M98.3Very high97.8Very high0 Ų062.5 Ų62.50%031%0.313CS..Hα-helixtrans-56.3-46.6175.4-165.9-170.4177.400111.2A10 A13 E14 R18 Y19 E20 F25 M26 L43 V46 A47A10-M22 HydrophobicContact CB-CG 4.13Å; A13-M22 HydrophobicContact CB-CB 3.86Å; A13-M22 HydrophobicContact CB-CG 4.47Å; E14-M22 HydrophobicContact CB-CE 3.9Å; E14-M22 HydrophobicContact CB-SD 3.9Å; E14-M22 HydrophobicContact CG-CE 4.16Å; E14-M22 HydrophobicContact CG-SD 4.37Å; R18-M22 PolarHBondContact O-N 2.71Å; Y19-M22 HydrophobicContact CD1-SD 4.1Å; Y19-M22 WeakPolarHBondContact O-CB 3.28Å; Y19-M22 PolarHBondContact O-N 3.31Å; E20-M22 VanDerWaalsContact C-N 3.35Å; M22-F25 PolarHBondContact O-N 3.01Å; M22-M26 WeakPolarHBondContact O-CB 3.46Å; M22-M26 VanDerWaalsContact O-CG 3.31Å; M22-M26 WeakPolarHBondContact O-CG 3.47Å; M22-M26 PolarHBondContact O-N 3.37Å; M22-L43 HydrophobicContact CE-CB 3.89Å; M22-L43 HydrophobicContact CE-CD2 3.48Å; M22-L43 VanDerWaalsContact CE-CD2 3.48Å; M22-L43 HydrophobicContact CE-CG 4.31Å; M22-L43 WeakPolarHBondContact CE-O 3.48Å; M22-V46 HydrophobicContact CE-CB 4.17Å; M22-V46 HydrophobicContact CE-CG1 4.11Å; M22-V46 HydrophobicContact SD-CG1 4.32Å; M22-A47 HydrophobicContact CB-CB 3.94Å; M22-A47 HydrophobicContact CE-CB 4.09Å; M22-A47 HydrophobicContact CG-CB 3.58Å; M22-A47 VanDerWaalsContact SD-CA 3.58Å; M22-A47 HydrophobicContact SD-CB 3.56Å; M22-A47 VanDerWaalsContact SD-CB 3.56Å
23A98.5Very high97.2Very high8 Ų860.4 Ų60.47%0.06631%0.314CS..Hα-helixtrans-63.6-42177.800000111.8Y19 E20 D21 M26 K27 A47 Y48 V51Y19-A23 WeakPolarHBondContact O-CB 3.5Å; Y19-A23 PolarHBondContact O-N 3.44Å; E20-A23 PolarHBondContact O-N 2.82Å; D21-A23 VanDerWaalsContact C-N 3.32Å; D21-A23 PolarHBondContact O-N 2.88Å; A23-M26 PolarHBondContact O-N 2.83Å; A23-K27 VanDerWaalsContact O-CB 3.28Å; A23-K27 WeakPolarHBondContact O-CB 3.46Å; A23-K27 PolarHBondContact O-N 3.17Å; A23-A47 HydrophobicContact CB-CB 4.24Å; A23-Y48 HydrophobicContact CB-CD1 4.01Å; A23-Y48 HydrophobicContact CB-CD2 4.43Å; A23-Y48 HydrophobicContact CB-CE1 3.81Å; A23-Y48 HydrophobicContact CB-CE2 4.21Å; A23-Y48 HydrophobicContact CB-CG 4.33Å; A23-Y48 PolarHBondContact O-OH 2.86Å; A23-V51 HydrophobicContact CB-CG2 4.34Å
24A98.4Very high96.7Very high51 Ų5165.3 Ų65.342%0.42134%0.336SS..Hα-helixtrans-64.5-41.8176.800000112.7E20 D21 S28E20-A24 PolarHBondContact O-N 2.86Å; D21-A24 PolarHBondContact O-N 3.16Å; A24-S28 PolarHBondContact O-N 3.38Å; A24-S28 VanDerWaalsContact O-N 3.16Å; A24-S28 PolarHBondContact O-OG 3.06Å
25F98.5Very high96.4Very high48 Ų4866.5 Ų66.521%0.21134%0.341CS..Hα-helixtrans-66.7-44.3175.4-62.6-43.4000111.8L6 K9 A10 A13 D21 M22 S28 A29L6-F25 HydrophobicContact CD2-CD1 4.14Å; K9-F25 HydrophobicContact CB-CD1 4.06Å; K9-F25 HydrophobicContact CB-CD2 3.57Å; K9-F25 HydrophobicContact CB-CE1 4.16Å; K9-F25 HydrophobicContact CB-CE2 3.68Å; K9-F25 HydrophobicContact CB-CG 3.79Å; K9-F25 HydrophobicContact CB-CZ 3.98Å; K9-F25 HydrophobicContact CD-CD1 4.14Å; K9-F25 HydrophobicContact CD-CE1 3.71Å; K9-F25 HydrophobicContact CD-CE2 4.43Å; K9-F25 HydrophobicContact CD-CZ 3.88Å; K9-F25 HydrophobicContact CG-CZ 4.47Å; A10-F25 HydrophobicContact CB-CB 4.12Å; A13-F25 HydrophobicContact CB-CD2 4.32Å; A13-F25 HydrophobicContact CB-CE2 4.31Å; D21-F25 HydrophobicContact CB-CD2 4.41Å; D21-F25 HydrophobicContact CB-CE2 3.87Å; D21-F25 HydrophobicContact CB-CZ 4.46Å; D21-F25 WeakPolarHBondContact O-CD2 3.42Å; D21-F25 VanDerWaalsContact O-CG 3.28Å; D21-F25 WeakPolarHBondContact O-CG 3.31Å; D21-F25 PolarHBondContact O-N 3.24Å; M22-F25 PolarHBondContact O-N 3.01Å; F25-S28 PolarHBondContact O-N 3.48Å; F25-A29 PolarHBondContact O-N 2.99Å
26M98.3Very high96.3Very high0 Ų059.4 Ų59.40%031%0.309CS..Hα-helixtrans-66.4-39.6178.5-72-52.8-58.600112.2I7 A10 M22 A23 S28 A29 V30 L36 E40 L43 L44I7-M26 HydrophobicContact CD1-CE 3.79Å; I7-M26 HydrophobicContact CD1-SD 3.64Å; A10-M26 HydrophobicContact CB-CG 3.8Å; A10-M26 HydrophobicContact CB-SD 3.55Å; A10-M26 VanDerWaalsContact CB-SD 3.55Å; M22-M26 WeakPolarHBondContact O-CB 3.46Å; M22-M26 VanDerWaalsContact O-CG 3.31Å; M22-M26 WeakPolarHBondContact O-CG 3.47Å; M22-M26 PolarHBondContact O-N 3.37Å; A23-M26 PolarHBondContact O-N 2.83Å; M26-S28 PolarHBondContact O-N 2.86Å; M26-A29 PolarHBondContact O-N 3.29Å; M26-A29 VanDerWaalsContact O-N 3.14Å; M26-V30 WeakPolarHBondContact O-CG2 3.49Å; M26-V30 PolarHBondContact O-N 3Å; M26-L36 HydrophobicContact CE-CD1 4.48Å; M26-E40 HydrophobicContact CE-CB 4.44Å; M26-E40 WeakPolarHBondContact CE-O 3.44Å; M26-L43 HydrophobicContact CE-CB 4.18Å; M26-L43 HydrophobicContact SD-CB 3.98Å; M26-L44 HydrophobicContact CB-CD1 3.78Å; M26-L44 HydrophobicContact CE-CB 3.94Å
27K98.2Very high96.2Very high69 Ų6959.2 Ų59.230%0.330%0.303SS..Hα-helixtrans-53.3-53.6171.1-178.9170-179.1176.10111.3A23 A29 V30 E31 Y48 T98 L102A23-K27 VanDerWaalsContact O-CB 3.28Å; A23-K27 WeakPolarHBondContact O-CB 3.46Å; A23-K27 PolarHBondContact O-N 3.17Å; K27-A29 PolarHBondContact O-N 3.45Å; K27-V30 PolarHBondContact O-N 3.22Å; K27-E31 WeakPolarHBondContact CE-OE1 3.49Å; K27-E31 WeakPolarHBondContact O-CG 3.4Å; K27-E31 PolarHBondContact O-N 3.06Å; K27-Y48 WeakPolarHBondContact CB-OH 3.37Å; K27-T98 HydrophobicContact CD-CG2 3.88Å; K27-L102 HydrophobicContact CB-CD1 4.29Å; K27-L102 HydrophobicContact CG-CD1 4.1Å; K27-L102 HydrophobicContact CG-CD2 4.19Å
28S97.9Very high95.9Very high50 Ų5055.7 Ų55.735%0.3529%0.294SS..Hα-helixtrans-62.2-29.6-179.8-57.90000112.5A24 F25 M26A24-S28 PolarHBondContact O-N 3.38Å; A24-S28 VanDerWaalsContact O-N 3.16Å; A24-S28 PolarHBondContact O-OG 3.06Å; F25-S28 PolarHBondContact O-N 3.48Å; M26-S28 PolarHBondContact O-N 2.86Å
29A97.1Very high95.8Very high0 Ų054.3 Ų54.30%029%0.293CS..Hα-helixtrans-75.3-40.1177.300000111.9R3 L6 I7 F25 M26 K27 K32R3-A29 HydrophobicContact CG-CB 4.27Å; L6-A29 HydrophobicContact CB-CB 4.04Å; L6-A29 HydrophobicContact CD1-CB 4.37Å; I7-A29 HydrophobicContact CD1-CB 3.65Å; I7-A29 HydrophobicContact CG1-CB 4.39Å; F25-A29 PolarHBondContact O-N 2.99Å; M26-A29 PolarHBondContact O-N 3.29Å; M26-A29 VanDerWaalsContact O-N 3.14Å; K27-A29 PolarHBondContact O-N 3.45Å; A29-K32 WeakPolarHBondContact O-CB 3.49Å; A29-K32 PolarHBondContact O-N 3.3Å
30V96.9Very high95.7Very high3 Ų353 Ų532%0.01829%0.289CS..Hα-helixtrans-65.4-43.3176.1171.60000111.3M26 K27 K32 G33 L36 L44 L102 H106 L107M26-V30 WeakPolarHBondContact O-CG2 3.49Å; M26-V30 PolarHBondContact O-N 3Å; K27-V30 PolarHBondContact O-N 3.22Å; V30-K32 PolarHBondContact O-N 3.02Å; V30-G33 PolarHBondContact O-N 2.9Å; V30-L36 HydrophobicContact CG2-CD1 3.93Å; V30-L36 HydrophobicContact CG2-CD2 4.15Å; V30-L36 HydrophobicContact CG2-CG 4.39Å; V30-L44 HydrophobicContact CG2-CD1 4.21Å; V30-L44 HydrophobicContact CG2-CD2 4.37Å; V30-L102 HydrophobicContact CB-CD2 4.35Å; V30-L102 HydrophobicContact CG1-CB 4.49Å; V30-L102 HydrophobicContact CG1-CD2 3.95Å; V30-H106 HydrophobicContact CG1-CB 3.58Å; V30-L107 HydrophobicContact CG1-CD1 4.41Å; V30-L107 HydrophobicContact CG1-CD2 3.79Å; V30-L107 HydrophobicContact CG1-CG 3.95Å; V30-L107 HydrophobicContact CG2-CD2 4Å
31E95.9Very high95.6Very high98 Ų9847.6 Ų47.646%0.45826%0.263SS..THydrogen-bonded Turntrans-64.5-10.8-179.6-71.7172.216700113.6K27 G33 L102K27-E31 WeakPolarHBondContact CE-OE1 3.49Å; K27-E31 WeakPolarHBondContact O-CG 3.4Å; K27-E31 PolarHBondContact O-N 3.06Å; E31-G33 VanDerWaalsContact C-N 3.29Å; E31-L102 HydrophobicContact CG-CD2 3.99Å
32K93.6Very high95.5Very high89 Ų8948.4 Ų48.439%0.38727%0.268SS..THydrogen-bonded Turntrans-78.2-8.4172.1-74.1173.2166.5-88.90114.2M1 R3 L6 A29 V30M1-K32 WeakPolarHBondContact O-CE 3.42Å; M1-K32 PolarHBondContact O-NZ 3.44Å; R3-K32 HydrophobicContact CB-CD 3.67Å; R3-K32 HydrophobicContact CG-CD 4.13Å; L6-K32 HydrophobicContact CD1-CD 4.06Å; A29-K32 WeakPolarHBondContact O-CB 3.49Å; A29-K32 PolarHBondContact O-N 3.3Å; V30-K32 PolarHBondContact O-N 3.02Å
33G86.5Confident95.5Very high51 Ų5148.8 Ų48.853%0.52627%0.27SS..  trans80.625.4167.600000116.1V30 E31V30-G33 PolarHBondContact O-N 2.9Å; E31-G33 VanDerWaalsContact C-N 3.29Å
34E88.5Confident95.5Very high110 Ų11048.5 Ų48.551%0.51427%0.267SS..  trans-105.6137.5171-69.7171.7-138.300110R3 L36R3-E34 WeakPolarHBondContact CD-OE1 3.35Å; R3-E34 WeakPolarHBondContact CD-OE2 3.33Å; R3-E34 IonicContact CZ-OE2 3.29Å; R3-E34 IonicContact NE-OE2 3.19Å; R3-E34 IonicContact NH1-OE2 3.91Å; E34-L36 PolarHBondContact O-N 3.15Å
35E92Very high95.4Very high95 Ų9547.7 Ų47.744%0.44426%0.258SS..PPolyproline II helixtrans-54.7135.2173.1-172.7172.1-154.700110.4R3 G112R3-E35 PolarHBondContact NH2-O 2.98Å; E35-G112 PolarHBondContact OE1-N 3.46Å
36L95.2Very high95.4Very high8 Ų847.7 Ų47.74%0.04226%0.262CS..PPolyproline II helixtrans-78.5133.1178.6-59.5-170.9000110R3 M26 V30 E34 E40 R41 L44 L107R3-L36 VanDerWaalsContact NH2-CD2 3.32Å; M26-L36 HydrophobicContact CE-CD1 4.48Å; V30-L36 HydrophobicContact CG2-CD1 3.93Å; V30-L36 HydrophobicContact CG2-CD2 4.15Å; V30-L36 HydrophobicContact CG2-CG 4.39Å; E34-L36 PolarHBondContact O-N 3.15Å; L36-E40 HydrophobicContact CB-CB 3.98Å; L36-E40 HydrophobicContact CD2-CB 4.13Å; L36-E40 HydrophobicContact CG-CB 4.45Å; L36-R41 HydrophobicContact CB-CB 4.24Å; L36-L44 HydrophobicContact CD1-CB 4.24Å; L36-L44 HydrophobicContact CD1-CD2 4Å; L36-L107 HydrophobicContact CD1-CD2 3.79Å; L36-L107 HydrophobicContact CG-CD2 3.98Å
37S94.8Very high95.4Very high55 Ų5547.7 Ų47.739%0.38526%0.262SS..PPolyproline II helixtrans-63.2165.2163.863.30000111.2E39 E40 R41S37-E39 VanDerWaalsContact C-N 3.25Å; S37-E39 PolarHBondContact O-N 2.95Å; S37-E40 PolarHBondContact N-OE2 3.07Å; S37-E40 PolarHBondContact O-N 3.41Å; S37-E40 VanDerWaalsContact O-N 3.11Å; S37-E40 VanDerWaalsContact OG-CD 3.24Å; S37-E40 VanDerWaalsContact OG-CG 3.25Å; S37-E40 WeakPolarHBondContact OG-CG 3.47Å; S37-E40 PolarHBondContact OG-N 3.43Å; S37-E40 PolarHBondContact OG-OE2 2.89Å; S37-R41 VanDerWaalsContact O-CB 3.31Å; S37-R41 WeakPolarHBondContact O-CB 3.45Å; S37-R41 PolarHBondContact O-N 3.37Å
38C92.4Very high95.4Very high69 Ų6945 Ų4547%0.46625%0.25SS..Hα-helixtrans-55.3-39.9177-174.40000112.5R41 N42C38-R41 PolarHBondContact SG-NH2 3.01Å; C38-N42 WeakPolarHBondContact O-CB 3.42Å; C38-N42 PolarHBondContact O-N 3.24Å; C38-N42 PolarHBondContact O-ND2 3.47Å
39E95.3Very high95.4Very high111 Ų11149 Ų4952%0.51926%0.261SS..Hα-helixtrans-63.9-47.4175.9-170.7-172.8-161.600111.6K11 S37 R41 N42 L43K11-E39 VanDerWaalsContact CE-OE1 3.28Å; K11-E39 WeakPolarHBondContact CE-OE1 3.31Å; K11-E39 IonicContact NZ-OE1 3.53Å; K11-E39 PolarHBondContact NZ-OE1 2.9Å; K11-E39 IonicContact NZ-OE2 2.76Å; K11-E39 PolarHBondContact NZ-OE2 3.37Å; S37-E39 VanDerWaalsContact C-N 3.25Å; S37-E39 PolarHBondContact O-N 2.95Å; E39-R41 PolarHBondContact O-N 3.18Å; E39-N42 PolarHBondContact O-N 3.35Å; E39-L43 WeakPolarHBondContact O-CG 3.4Å; E39-L43 PolarHBondContact O-N 3.37Å
40E96.8Very high95.5Very high23 Ų2352 Ų5211%0.10728%0.278CS..Hα-helixtrans-67.5-37.2-179.2-66.6164.4150.300112.2R3 I7 M26 L36 S37 N42 L43 L44R3-E40 IonicContact CZ-OE1 3.68Å; R3-E40 IonicContact CZ-OE2 2.7Å; R3-E40 IonicContact NH1-OE1 3.15Å; R3-E40 PolarHBondContact NH1-OE1 3Å; R3-E40 IonicContact NH1-OE2 2.75Å; R3-E40 IonicContact NH2-OE1 3.11Å; R3-E40 PolarHBondContact NH2-OE1 2.95Å; R3-E40 IonicContact NH2-OE2 2.71Å; R3-E40 PolarHBondContact NH2-OE2 3.12Å; I7-E40 HydrophobicContact CD1-CB 4.42Å; I7-E40 HydrophobicContact CD1-CG 3.94Å; I7-E40 HydrophobicContact CG1-CG 4.23Å; I7-E40 HydrophobicContact CG2-CG 4.1Å; M26-E40 HydrophobicContact CE-CB 4.44Å; M26-E40 WeakPolarHBondContact CE-O 3.44Å; L36-E40 HydrophobicContact CB-CB 3.98Å; L36-E40 HydrophobicContact CD2-CB 4.13Å; L36-E40 HydrophobicContact CG-CB 4.45Å; S37-E40 PolarHBondContact N-OE2 3.07Å; S37-E40 PolarHBondContact O-N 3.41Å; S37-E40 VanDerWaalsContact O-N 3.11Å; S37-E40 VanDerWaalsContact OG-CD 3.24Å; S37-E40 VanDerWaalsContact OG-CG 3.25Å; S37-E40 WeakPolarHBondContact OG-CG 3.47Å; S37-E40 PolarHBondContact OG-N 3.43Å; S37-E40 PolarHBondContact OG-OE2 2.89Å; E40-N42 VanDerWaalsContact C-N 3.34Å; E40-L43 WeakPolarHBondContact O-CB 3.41Å; E40-L43 PolarHBondContact O-N 3Å; E40-L44 PolarHBondContact O-N 3.36Å
41R96.7Very high95.6Very high5 Ų552.6 Ų52.62%0.01928%0.281CS..Hα-helixtrans-61.9-42.2173.3-178.4-179.372.9-172.21.5111.2L36 S37 C38 E39 L44 S45 E115 S116 F119 Y120L36-R41 HydrophobicContact CB-CB 4.24Å; S37-R41 VanDerWaalsContact O-CB 3.31Å; S37-R41 WeakPolarHBondContact O-CB 3.45Å; S37-R41 PolarHBondContact O-N 3.37Å; C38-R41 PolarHBondContact SG-NH2 3.01Å; E39-R41 PolarHBondContact O-N 3.18Å; R41-L44 PolarHBondContact O-N 3Å; R41-S45 PolarHBondContact O-N 2.88Å; R41-S45 VanDerWaalsContact O-N 3.08Å; R41-E115 IonicContact CZ-OE1 2.7Å; R41-E115 IonicContact NH1-OE1 3.56Å; R41-E115 IonicContact NH2-OE1 3.64Å; R41-E115 PolarHBondContact NH2-OE1 2.68Å; R41-S116 PolarHBondContact NH1-OG 2.99Å; R41-S116 VanDerWaalsContact NH1-OG 3.08Å; R41-F119 VanDerWaalsContact CD-CD1 3.47Å; R41-F119 HydrophobicContact CG-CD1 3.51Å; R41-F119 HydrophobicContact CG-CD2 4.39Å; R41-F119 HydrophobicContact CG-CE1 3.33Å; R41-F119 HydrophobicContact CG-CE2 4.23Å; R41-F119 HydrophobicContact CG-CG 4.06Å; R41-F119 HydrophobicContact CG-CZ 3.7Å; R41-Y120 HydrophobicContact CG-CE1 3.74Å
42N95.5Very high95.7Very high73 Ų7348 Ų4839%0.3926%0.259SS..Hα-helixtrans-66-41.9175-71.9-17.4000111.7C38 E39 E40 L44 S45 V46C38-N42 WeakPolarHBondContact O-CB 3.42Å; C38-N42 PolarHBondContact O-N 3.24Å; C38-N42 PolarHBondContact O-ND2 3.47Å; E39-N42 PolarHBondContact O-N 3.35Å; E40-N42 VanDerWaalsContact C-N 3.34Å; N42-L44 PolarHBondContact O-N 3.43Å; N42-S45 PolarHBondContact O-N 3.38Å; N42-V46 WeakPolarHBondContact O-CG2 3.35Å; N42-V46 PolarHBondContact O-N 3.25Å
43L97.9Very high95.9Very high8 Ų845.1 Ų45.14%0.04226%0.256CS..Hα-helixtrans-58-46.9173.8-72.3170.1000111.6I7 K11 E14 M22 M26 E39 E40 S45 V46 A47I7-L43 HydrophobicContact CG2-CD1 4.17Å; K11-L43 HydrophobicContact CD-CD1 4.46Å; K11-L43 HydrophobicContact CG-CD1 3.76Å; K11-L43 HydrophobicContact CG-CD2 4.18Å; E14-L43 VanDerWaalsContact OE2-CD2 3.28Å; E14-L43 WeakPolarHBondContact OE2-CD2 3.27Å; M22-L43 HydrophobicContact CE-CB 3.89Å; M22-L43 HydrophobicContact CE-CD2 3.48Å; M22-L43 VanDerWaalsContact CE-CD2 3.48Å; M22-L43 HydrophobicContact CE-CG 4.31Å; M22-L43 WeakPolarHBondContact CE-O 3.48Å; M26-L43 HydrophobicContact CE-CB 4.18Å; M26-L43 HydrophobicContact SD-CB 3.98Å; E39-L43 WeakPolarHBondContact O-CG 3.4Å; E39-L43 PolarHBondContact O-N 3.37Å; E40-L43 WeakPolarHBondContact O-CB 3.41Å; E40-L43 PolarHBondContact O-N 3Å; L43-S45 VanDerWaalsContact C-N 3.3Å; L43-S45 PolarHBondContact O-N 3.36Å; L43-V46 PolarHBondContact O-N 2.99Å; L43-A47 WeakPolarHBondContact O-CB 3.48Å; L43-A47 PolarHBondContact O-N 3.5Å
44L98.3Very high96.4Very high3 Ų344.9 Ų44.92%0.01625%0.253CS..Hα-helixtrans-56.5-46.6176.4-179.973.7000111.3M26 V30 L36 E40 R41 N42 A47 Y48 L107 M123M26-L44 HydrophobicContact CB-CD1 3.78Å; M26-L44 HydrophobicContact CE-CB 3.94Å; V30-L44 HydrophobicContact CG2-CD1 4.21Å; V30-L44 HydrophobicContact CG2-CD2 4.37Å; L36-L44 HydrophobicContact CD1-CB 4.24Å; L36-L44 HydrophobicContact CD1-CD2 4Å; E40-L44 PolarHBondContact O-N 3.36Å; R41-L44 PolarHBondContact O-N 3Å; N42-L44 PolarHBondContact O-N 3.43Å; L44-A47 PolarHBondContact O-N 2.91Å; L44-Y48 HydrophobicContact CD1-CD2 3.68Å; L44-Y48 HydrophobicContact CD1-CE2 3.51Å; L44-Y48 HydrophobicContact CG-CD2 4.26Å; L44-Y48 WeakPolarHBondContact O-CD2 3.48Å; L44-Y48 PolarHBondContact O-N 3.34Å; L44-L107 HydrophobicContact CD2-CD1 3.41Å; L44-L107 VanDerWaalsContact CD2-CD1 3.41Å; L44-L107 HydrophobicContact CD2-CD2 4.35Å; L44-M123 HydrophobicContact CG-CE 4.49Å
45S97.8Very high96.9Very high33 Ų3341.3 Ų41.323%0.23124%0.236CC..Hα-helixtrans-63.6-48.3-180-177.80000112R41 N42 L43 A47 K49R41-S45 PolarHBondContact O-N 2.88Å; R41-S45 VanDerWaalsContact O-N 3.08Å; N42-S45 PolarHBondContact O-N 3.38Å; L43-S45 VanDerWaalsContact C-N 3.3Å; L43-S45 PolarHBondContact O-N 3.36Å; S45-A47 VanDerWaalsContact C-N 3.34Å; S45-A47 PolarHBondContact O-N 3.16Å; S45-K49 WeakPolarHBondContact O-CB 3.48Å; S45-K49 PolarHBondContact O-N 3.02Å
46V98.1Very high97.2Very high48 Ų4838.1 Ų38.129%0.29122%0.22SC..Hα-helixtrans-59.4-44.6177.5169.50000111.2Y19 M22 N42 L43 N50Y19-V46 HydrophobicContact CE1-CG1 4.28Å; M22-V46 HydrophobicContact CE-CB 4.17Å; M22-V46 HydrophobicContact CE-CG1 4.11Å; M22-V46 HydrophobicContact SD-CG1 4.32Å; N42-V46 WeakPolarHBondContact O-CG2 3.35Å; N42-V46 PolarHBondContact O-N 3.25Å; L43-V46 PolarHBondContact O-N 2.99Å; V46-N50 PolarHBondContact O-N 2.95Å; V46-N50 VanDerWaalsContact O-N 3.16Å; V46-N50 PolarHBondContact O-ND2 3.22Å
47A98.5Very high97.3Very high0 Ų040.3 Ų40.30%024%0.239CC..Hα-helixtrans-56.4-61.218000000111.3M22 A23 L43 L44 S45 K49 N50 V51M22-A47 HydrophobicContact CB-CB 3.94Å; M22-A47 HydrophobicContact CE-CB 4.09Å; M22-A47 HydrophobicContact CG-CB 3.58Å; 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 4.24Å; L43-A47 WeakPolarHBondContact O-CB 3.48Å; L43-A47 PolarHBondContact O-N 3.5Å; L44-A47 PolarHBondContact O-N 2.91Å; S45-A47 VanDerWaalsContact C-N 3.34Å; S45-A47 PolarHBondContact O-N 3.16Å; A47-K49 PolarHBondContact O-N 3.44Å; A47-N50 PolarHBondContact O-N 3Å; A47-V51 WeakPolarHBondContact O-CG2 3.46Å; A47-V51 PolarHBondContact O-N 3.43Å
48Y98.6Very high97.5Very high12 Ų1239.4 Ų39.45%0.04724%0.235CC..Hα-helixtrans-73.3-31.2-174.4-75.7-77.2000112.8A23 K27 L44 N50 V51 V52 V95 T98 V99 L102 Y127A23-Y48 HydrophobicContact CB-CD1 4.01Å; A23-Y48 HydrophobicContact CB-CD2 4.43Å; A23-Y48 HydrophobicContact CB-CE1 3.81Å; A23-Y48 HydrophobicContact CB-CE2 4.21Å; A23-Y48 HydrophobicContact CB-CG 4.33Å; A23-Y48 PolarHBondContact O-OH 2.86Å; K27-Y48 WeakPolarHBondContact CB-OH 3.37Å; L44-Y48 HydrophobicContact CD1-CD2 3.68Å; L44-Y48 HydrophobicContact CD1-CE2 3.51Å; L44-Y48 HydrophobicContact CG-CD2 4.26Å; L44-Y48 WeakPolarHBondContact O-CD2 3.48Å; L44-Y48 PolarHBondContact O-N 3.34Å; Y48-N50 VanDerWaalsContact C-N 3.32Å; Y48-N50 PolarHBondContact O-N 3.17Å; Y48-V51 PolarHBondContact O-N 3.19Å; Y48-V52 WeakPolarHBondContact O-CB 3.44Å; Y48-V52 VanDerWaalsContact O-CG1 3.29Å; Y48-V52 WeakPolarHBondContact O-CG1 3.01Å; Y48-V52 PolarHBondContact O-N 3.17Å; Y48-V95 HydrophobicContact CD1-CG1 4.05Å; Y48-T98 HydrophobicContact CE1-CG2 4.12Å; Y48-T98 WeakPolarHBondContact OH-CG2 3.01Å; Y48-V99 HydrophobicContact CD1-CG2 3.31Å; Y48-V99 HydrophobicContact CD2-CG2 3.89Å; Y48-V99 HydrophobicContact CE1-CG2 3.67Å; Y48-V99 HydrophobicContact CE2-CG2 4.23Å; Y48-V99 HydrophobicContact CG-CG2 3.41Å; Y48-V99 VanDerWaalsContact CG-CG2 3.41Å; Y48-L102 HydrophobicContact CE2-CD1 4.15Å; Y48-Y127 WeakPolarHBondContact CB-OH 3.44Å; Y48-Y127 PolarHBondContact O-OH 3.49Å
49K98Very high97.7Very high134 Ų13438 Ų3858%0.58322%0.22SC*.Hα-helixtrans-59.4-42174.7179.7-175.7174.9-173.20111.6S45 A47 G53 Y127S45-K49 WeakPolarHBondContact O-CB 3.48Å; S45-K49 PolarHBondContact O-N 3.02Å; A47-K49 PolarHBondContact O-N 3.44Å; K49-G53 WeakPolarHBondContact O-CA 3.28Å; K49-G53 PolarHBondContact O-N 3.08Å; K49-Y127 PolarHBondContact N-OH 2.84Å
50N98.2Very high97.9Very high65 Ų6537.9 Ų37.935%0.34822%0.215SC..Hα-helixtrans-70.7-44.4178.8-80.6-73.3000111.8Y19 V46 A47 Y48 G53 G54Y19-N50 HydrophobicContact CD1-CB 3.58Å; Y19-N50 HydrophobicContact CD2-CB 3.49Å; Y19-N50 VanDerWaalsContact CD2-CB 3.49Å; Y19-N50 HydrophobicContact CE1-CB 3.94Å; Y19-N50 VanDerWaalsContact CE1-ND2 3.35Å; Y19-N50 WeakPolarHBondContact CE1-ND2 3.46Å; Y19-N50 HydrophobicContact CE2-CB 3.86Å; Y19-N50 HydrophobicContact CG-CB 3.32Å; V46-N50 PolarHBondContact O-N 2.95Å; V46-N50 VanDerWaalsContact O-N 3.16Å; V46-N50 PolarHBondContact O-ND2 3.22Å; A47-N50 PolarHBondContact O-N 3Å; Y48-N50 VanDerWaalsContact C-N 3.32Å; Y48-N50 PolarHBondContact O-N 3.17Å; N50-G53 PolarHBondContact O-N 2.7Å; N50-G54 PolarHBondContact O-N 3.11Å
51V98.4Very high97.9Very high14 Ų1441 Ų419%0.08524%0.235CC..Hα-helixtrans-58.9-53.5177.2177.40000110.9E20 A23 A47 Y48 G53 G54 Q55 V95E20-V51 HydrophobicContact CG-CG2 4.27Å; A23-V51 HydrophobicContact CB-CG2 4.34Å; A47-V51 WeakPolarHBondContact O-CG2 3.46Å; A47-V51 PolarHBondContact O-N 3.43Å; Y48-V51 PolarHBondContact O-N 3.19Å; V51-G53 VanDerWaalsContact C-N 3.29Å; V51-G53 PolarHBondContact O-N 2.88Å; V51-G54 PolarHBondContact O-N 3.35Å; V51-Q55 WeakPolarHBondContact O-CG 3.31Å; V51-Q55 PolarHBondContact O-N 3.05Å; V51-V95 HydrophobicContact CG1-CG1 4.17Å; V51-V95 HydrophobicContact CG1-CG2 3.73Å
52V98.3Very high97.9Very high1 Ų141.6 Ų41.61%0.00624%0.239CC..Hα-helixtrans-67.9-31.6-179.778.30000111.9Y48 Q55 R56 L92 V95 Y127 Y130Y48-V52 WeakPolarHBondContact O-CB 3.44Å; Y48-V52 VanDerWaalsContact O-CG1 3.29Å; Y48-V52 WeakPolarHBondContact O-CG1 3.01Å; Y48-V52 PolarHBondContact O-N 3.17Å; V52-Q55 PolarHBondContact O-N 3.2Å; V52-R56 HydrophobicContact CG2-CG 4.4Å; V52-R56 WeakPolarHBondContact O-CB 3.4Å; V52-R56 VanDerWaalsContact O-CG 3.25Å; V52-R56 WeakPolarHBondContact O-CG 3.43Å; V52-R56 PolarHBondContact O-N 3.42Å; V52-L92 HydrophobicContact CG2-CG 4.34Å; V52-V95 HydrophobicContact CB-CG1 4.06Å; V52-V95 HydrophobicContact CG2-CG1 4.43Å; V52-Y127 HydrophobicContact CB-CE1 4.11Å; V52-Y127 HydrophobicContact CG1-CE1 4.01Å; V52-Y127 HydrophobicContact CG2-CE1 4.28Å; V52-Y130 HydrophobicContact CG1-CD2 3.9Å; V52-Y130 HydrophobicContact CG1-CE2 3.71Å; V52-Y130 HydrophobicContact CG2-CD2 3.81Å; V52-Y130 HydrophobicContact CG2-CE2 4.48Å; V52-Y130 HydrophobicContact CG2-CG 4.36Å
53G97.9Very high97.9Very high30 Ų3039.3 Ų39.331%0.30923%0.228SC..Hα-helixtrans-61.6-45.7175.800000112.6K49 N50 V51 R56 A57K49-G53 WeakPolarHBondContact O-CA 3.28Å; K49-G53 PolarHBondContact O-N 3.08Å; N50-G53 PolarHBondContact O-N 2.7Å; V51-G53 VanDerWaalsContact C-N 3.29Å; V51-G53 PolarHBondContact O-N 2.88Å; G53-R56 PolarHBondContact O-N 2.83Å; G53-A57 WeakPolarHBondContact O-CB 3.34Å; G53-A57 PolarHBondContact O-N 3.15Å
54G97.4Very high97.7Very high45 Ų4541.3 Ų41.346%0.46424%0.243SC..Hα-helixtrans-60.4-45.2174.900000112.2N50 V51 A57 A58N50-G54 PolarHBondContact O-N 3.11Å; V51-G54 PolarHBondContact O-N 3.35Å; G54-A57 PolarHBondContact O-N 2.9Å; G54-A58 WeakPolarHBondContact O-CB 3.41Å; G54-A58 PolarHBondContact O-N 3.48Å
55Q98.1Very high97.5Very high36 Ų3644.9 Ų44.917%0.16826%0.261CS..Hα-helixtrans-63.8-43.4178.4-66.1-65.5-4.400112.5V51 V52 A57 A58 W59 V88 E91 L92V51-Q55 WeakPolarHBondContact O-CG 3.31Å; V51-Q55 PolarHBondContact O-N 3.05Å; V52-Q55 PolarHBondContact O-N 3.2Å; Q55-A57 PolarHBondContact O-N 3.24Å; Q55-A58 PolarHBondContact O-N 2.94Å; Q55-W59 WeakPolarHBondContact O-CB 3.49Å; Q55-W59 PolarHBondContact O-N 3.29Å; Q55-V88 WeakPolarHBondContact O-CG1 3.5Å; Q55-E91 PolarHBondContact NE2-OE2 3.48Å; Q55-E91 PolarHBondContact OE1-OE2 3.35Å; Q55-L92 HydrophobicContact CB-CB 4.09Å; Q55-L92 HydrophobicContact CB-CG 4.44Å
56R98.1Very high97.2Very high28 Ų2844.7 Ų44.711%0.10626%0.257CS..Hα-helixtrans-63.5-41.7176.2-72.7175.273.1-132.46.6112.5V52 G53 W59 R60 L92 Y130 E133V52-R56 HydrophobicContact CG2-CG 4.4Å; V52-R56 WeakPolarHBondContact O-CB 3.4Å; V52-R56 VanDerWaalsContact O-CG 3.25Å; V52-R56 WeakPolarHBondContact O-CG 3.43Å; V52-R56 PolarHBondContact O-N 3.42Å; G53-R56 PolarHBondContact O-N 2.83Å; R56-W59 PolarHBondContact O-N 3.5Å; R56-R60 VanDerWaalsContact O-CG 3.27Å; R56-R60 WeakPolarHBondContact O-CG 3.44Å; R56-R60 PolarHBondContact O-N 3.23Å; R56-L92 HydrophobicContact CB-CD1 4.45Å; R56-L92 HydrophobicContact CG-CD1 3.54Å; R56-L92 HydrophobicContact CG-CG 4.43Å; R56-Y130 VanDerWaalsContact NE-CD1 3.35Å; R56-E133 IonicContact CZ-OE2 2.64Å; R56-E133 IonicContact NE-OE2 3.4Å; R56-E133 PolarHBondContact NE-OE2 3.15Å; R56-E133 IonicContact NH2-OE1 3.36Å; R56-E133 IonicContact NH2-OE2 2.8Å; R56-E133 PolarHBondContact NH2-OE2 3.38Å
57A98.3Very high96.7Very high53 Ų5348 Ų4844%0.43827%0.269SS..Hα-helixtrans-62.8-45.9176.600000111.2G53 G54 Q55 R60 V61G53-A57 WeakPolarHBondContact O-CB 3.34Å; G53-A57 PolarHBondContact O-N 3.15Å; G54-A57 PolarHBondContact O-N 2.9Å; Q55-A57 PolarHBondContact O-N 3.24Å; A57-R60 PolarHBondContact O-N 3.42Å; A57-V61 WeakPolarHBondContact O-CG2 3.45Å; A57-V61 PolarHBondContact O-N 3Å; A57-V61 VanDerWaalsContact O-N 3.16Å
58A98.2Very high96.3Very high37 Ų3753.5 Ų53.531%0.30629%0.293SS..Hα-helixtrans-59.7-47.2175.600000111.6G54 Q55 R60 V61 L62 V88G54-A58 WeakPolarHBondContact O-CB 3.41Å; G54-A58 PolarHBondContact O-N 3.48Å; Q55-A58 PolarHBondContact O-N 2.94Å; A58-R60 PolarHBondContact O-N 3.16Å; A58-V61 PolarHBondContact O-N 2.98Å; A58-L62 VanDerWaalsContact O-CG 3.31Å; A58-L62 WeakPolarHBondContact O-CG 3.44Å; A58-L62 PolarHBondContact O-N 3.38Å; A58-V88 HydrophobicContact CB-CG1 3.98Å; A58-V88 HydrophobicContact CB-CG2 4.42Å
59W98.1Very high95.7Very high39 Ų3953.4 Ų53.415%0.14829%0.294CS..Hα-helixtrans-59.4-47.5179.5-175.988.2000111.7Q55 R56 V61 L62 S63 V88 E133 V134Q55-W59 WeakPolarHBondContact O-CB 3.49Å; Q55-W59 PolarHBondContact O-N 3.29Å; R56-W59 PolarHBondContact O-N 3.5Å; W59-V61 VanDerWaalsContact C-N 3.34Å; W59-V61 PolarHBondContact O-N 3.42Å; W59-L62 PolarHBondContact O-N 2.91Å; W59-S63 WeakPolarHBondContact O-CB 3.25Å; W59-S63 PolarHBondContact O-N 2.9Å; W59-S63 PolarHBondContact O-OG 3.39Å; W59-V88 HydrophobicContact CB-CG1 3.8Å; W59-E133 HydrophobicContact CZ3-CG 4.07Å; W59-V134 HydrophobicContact CD2-CG1 3.64Å; W59-V134 HydrophobicContact CE3-CG1 4.04Å; W59-V134 HydrophobicContact CG-CG1 4.02Å; W59-V134 HydrophobicContact CH2-CG1 4.26Å; W59-V134 HydrophobicContact CZ2-CB 4.08Å; W59-V134 HydrophobicContact CZ2-CG1 3.88Å; W59-V134 HydrophobicContact CZ3-CG1 4.34Å
60R97.7Very high94.9Very high108 Ų10852.4 Ų52.441%0.40830%0.295SS..Hα-helixtrans-59.9-41.3178.7-72.2167.9179.6179.1-19113R56 A57 A58 S64 E133R56-R60 VanDerWaalsContact O-CG 3.27Å; R56-R60 WeakPolarHBondContact O-CG 3.44Å; R56-R60 PolarHBondContact O-N 3.23Å; A57-R60 PolarHBondContact O-N 3.42Å; A58-R60 PolarHBondContact O-N 3.16Å; R60-S64 WeakPolarHBondContact O-CB 3.37Å; R60-S64 PolarHBondContact O-N 2.97Å; R60-E133 IonicContact CZ-OE1 3.68Å; R60-E133 IonicContact NE-OE1 3.63Å; R60-E133 PolarHBondContact NE-OE1 3.4Å; R60-E133 IonicContact NH2-OE1 3.55Å; R60-E133 PolarHBondContact NH2-OE1 3.41Å; R60-E133 IonicContact NH2-OE2 3.79Å
61V97.5Very high94.1Very high88 Ų8855.7 Ų55.753%0.53331%0.308SS..Hα-helixtrans-63.6-46.9176.3171.10000110.2A57 A58 W59 S64 I65A57-V61 WeakPolarHBondContact O-CG2 3.45Å; A57-V61 PolarHBondContact O-N 3Å; A57-V61 VanDerWaalsContact O-N 3.16Å; A58-V61 PolarHBondContact O-N 2.98Å; W59-V61 VanDerWaalsContact C-N 3.34Å; W59-V61 PolarHBondContact O-N 3.42Å; V61-S64 PolarHBondContact O-N 3.49Å; V61-I65 HydrophobicContact CG1-CD1 3.85Å; V61-I65 WeakPolarHBondContact O-CG1 3.34Å; V61-I65 PolarHBondContact O-N 3.25Å
62L96.7Very high93.2Very high18 Ų1861.8 Ų61.89%0.09434%0.336CS..Hα-helixtrans-64.6-43.2180-67.7169.1000112.1A58 W59 S64 I65 E66 Y84 R85 V88A58-L62 VanDerWaalsContact O-CG 3.31Å; A58-L62 WeakPolarHBondContact O-CG 3.44Å; A58-L62 PolarHBondContact O-N 3.38Å; W59-L62 PolarHBondContact O-N 2.91Å; L62-S64 VanDerWaalsContact C-N 3.29Å; L62-S64 PolarHBondContact O-N 3.4Å; L62-I65 PolarHBondContact O-N 2.84Å; L62-I65 VanDerWaalsContact O-N 3.17Å; L62-E66 WeakPolarHBondContact O-CB 3.35Å; L62-E66 PolarHBondContact O-N 2.92Å; L62-Y84 HydrophobicContact CD1-CD1 3.68Å; L62-Y84 HydrophobicContact CD1-CE1 4.01Å; L62-Y84 HydrophobicContact CD1-CG 4.24Å; L62-Y84 HydrophobicContact CD2-CD1 3.57Å; L62-Y84 HydrophobicContact CD2-CE1 4.14Å; L62-Y84 HydrophobicContact CG-CD1 4.29Å; L62-R85 HydrophobicContact CB-CB 3.95Å; L62-R85 HydrophobicContact CB-CG 4.13Å; L62-V88 HydrophobicContact CD1-CB 4.25Å; L62-V88 HydrophobicContact CD1-CG2 3.7Å
63S94.8Very high91.8Very high25 Ų2566.6 Ų66.618%0.17537%0.37CS..Hα-helixtrans-59.1-39.5173.7-58.60000112W59 Q67 R85W59-S63 WeakPolarHBondContact O-CB 3.25Å; W59-S63 PolarHBondContact O-N 2.9Å; W59-S63 PolarHBondContact O-OG 3.39Å; S63-Q67 WeakPolarHBondContact O-CB 3.31Å; S63-Q67 PolarHBondContact O-N 3.4Å; S63-R85 VanDerWaalsContact OG-CD 3.28Å; S63-R85 WeakPolarHBondContact OG-CD 3.5Å
64S94.5Very high90.2Very high50 Ų5067.1 Ų67.135%0.3537%0.369SS..Hα-helixtrans-67.9-37.6175.9-174.40000112.8R60 V61 L62 K68R60-S64 WeakPolarHBondContact O-CB 3.37Å; R60-S64 PolarHBondContact O-N 2.97Å; V61-S64 PolarHBondContact O-N 3.49Å; L62-S64 VanDerWaalsContact C-N 3.29Å; L62-S64 PolarHBondContact O-N 3.4Å; S64-K68 WeakPolarHBondContact O-CG 3.42Å; S64-K68 PolarHBondContact O-N 3.37Å
65I93.6Very high88.7Confident78 Ų7873.1 Ų73.140%0.439%0.385SS..Hα-helixtrans-67.4-45.1175.9-66166.1000110.3V61 L62 Q67 K68 S69 V81V61-I65 HydrophobicContact CG1-CD1 3.85Å; V61-I65 WeakPolarHBondContact O-CG1 3.34Å; V61-I65 PolarHBondContact O-N 3.25Å; L62-I65 PolarHBondContact O-N 2.84Å; L62-I65 VanDerWaalsContact O-N 3.17Å; I65-Q67 PolarHBondContact O-N 3.4Å; I65-K68 PolarHBondContact O-N 3.3Å; I65-S69 WeakPolarHBondContact O-CB 3.01Å; I65-S69 PolarHBondContact O-N 2.7Å; I65-S69 PolarHBondContact O-OG 3.15Å; I65-V81 HydrophobicContact CB-CG1 4.14Å; I65-V81 HydrophobicContact CG2-CG1 3.88Å; I65-V81 HydrophobicContact CG2-CG2 3.88Å
66E91.1Very high87.4Confident29 Ų2979.9 Ų79.914%0.13642%0.416CS..Hα-helixtrans-58.2-49.1178.2-171.9-176.2-140.900110.6L62 K68 S69 N70 V81 Q82 R85L62-E66 WeakPolarHBondContact O-CB 3.35Å; L62-E66 PolarHBondContact O-N 2.92Å; E66-K68 PolarHBondContact O-N 2.9Å; E66-S69 PolarHBondContact O-N 2.73Å; E66-S69 PolarHBondContact O-OG 3.42Å; E66-N70 PolarHBondContact O-N 3.07Å; E66-N70 VanDerWaalsContact O-N 3.09Å; E66-N70 PolarHBondContact O-ND2 3.43Å; E66-V81 HydrophobicContact CB-CG1 3.84Å; E66-Q82 WeakPolarHBondContact OE1-CA 3.45Å; E66-Q82 VanDerWaalsContact OE1-CB 3.3Å; E66-Q82 WeakPolarHBondContact OE1-CB 3.47Å; E66-Q82 WeakPolarHBondContact OE1-CG 3.45Å; E66-R85 VanDerWaalsContact CD-NE 3.34Å; E66-R85 IonicContact OE1-CZ 3.21Å; E66-R85 IonicContact OE1-NE 3.31Å; E66-R85 PolarHBondContact OE1-NE 3.14Å; E66-R85 IonicContact OE1-NH2 3.37Å; E66-R85 PolarHBondContact OE1-NH2 3.45Å; E66-R85 VanDerWaalsContact OE2-CD 3.25Å; E66-R85 WeakPolarHBondContact OE2-CD 3.5Å; E66-R85 IonicContact OE2-CZ 3.97Å; E66-R85 IonicContact OE2-NE 2.71Å; E66-R85 PolarHBondContact OE2-NE 3Å; E66-R85 IonicContact OE2-NH2 3.83Å
67Q89.6Confident86.2Confident117 Ų11785.1 Ų85.155%0.54744%0.44SS..Hα-helixtrans-56.3-48.4177.6-174.8-176.2-18.200112.1S63 I65 S69 N70 E71S63-Q67 WeakPolarHBondContact O-CB 3.31Å; S63-Q67 PolarHBondContact O-N 3.4Å; I65-Q67 PolarHBondContact O-N 3.4Å; Q67-S69 PolarHBondContact O-N 3.12Å; Q67-N70 PolarHBondContact O-N 3.2Å; Q67-E71 PolarHBondContact NE2-OE1 3.17Å; Q67-E71 WeakPolarHBondContact O-CG 3.43Å; Q67-E71 PolarHBondContact O-N 2.87Å; Q67-E71 VanDerWaalsContact O-N 3.14Å
68K89.4Confident85.5Confident116 Ų11683 Ų8350%0.50442%0.423SS..Hα-helixtrans-63.9-39.4178.3-71172.4-177.5172.70112.4S64 I65 E66 N70 E71 E72S64-K68 WeakPolarHBondContact O-CG 3.42Å; S64-K68 PolarHBondContact O-N 3.37Å; I65-K68 PolarHBondContact O-N 3.3Å; E66-K68 PolarHBondContact O-N 2.9Å; K68-N70 VanDerWaalsContact C-N 3.26Å; K68-N70 PolarHBondContact O-N 2.85Å; K68-E71 PolarHBondContact O-N 2.75Å; K68-E72 PolarHBondContact O-N 2.71Å
69S85.3Confident85Confident11 Ų1185.3 Ų85.38%0.07744%0.435CS..Hα-helixtrans-64.1-33.8179.571.50000112.8I65 E66 Q67 S74I65-S69 WeakPolarHBondContact O-CB 3.01Å; I65-S69 PolarHBondContact O-N 2.7Å; I65-S69 PolarHBondContact O-OG 3.15Å; E66-S69 PolarHBondContact O-N 2.73Å; E66-S69 PolarHBondContact O-OG 3.42Å; Q67-S69 PolarHBondContact O-N 3.12Å; S69-S74 WeakPolarHBondContact CA-OG 3.39Å; S69-S74 PolarHBondContact O-N 3.29Å; S69-S74 PolarHBondContact O-OG 3.37Å
70N81.2Confident84.7Confident113 Ų11390.1 Ų90.160%0.60446%0.459SS*.Hα-helixtrans-73.4-35.8175.9-68.9-23.5000112.2E66 Q67 K68E66-N70 PolarHBondContact O-N 3.07Å; E66-N70 VanDerWaalsContact O-N 3.09Å; E66-N70 PolarHBondContact O-ND2 3.43Å; Q67-N70 PolarHBondContact O-N 3.2Å; K68-N70 VanDerWaalsContact C-N 3.26Å; K68-N70 PolarHBondContact O-N 2.85Å
71E82.2Confident84.5Confident133 Ų13386 Ų8662%0.62145%0.446SS*.Hα-helixtrans-69.3-38.1176.1-72171.6-166.700112.4Q67 K68 S73Q67-E71 PolarHBondContact NE2-OE1 3.17Å; Q67-E71 WeakPolarHBondContact O-CG 3.43Å; Q67-E71 PolarHBondContact O-N 2.87Å; Q67-E71 VanDerWaalsContact O-N 3.14Å; K68-E71 PolarHBondContact O-N 2.75Å; E71-S73 VanDerWaalsContact C-N 3.27Å; E71-S73 PolarHBondContact O-N 2.88Å
72E79.1Confident84.3Confident143 Ų14385.9 Ų85.967%0.66844%0.44SS*.THydrogen-bonded Turntrans-81.93.7-177.4-68.9179.5-176.900114K68 S74K68-E72 PolarHBondContact O-N 2.71Å; E72-S74 PolarHBondContact O-N 2.84Å; E72-S74 VanDerWaalsContact O-N 3.12Å
73S68.1Low84.3Confident101 Ų10191.8 Ų91.871%0.70647%0.467SS*.THydrogen-bonded Turntrans52.427.8-172.853.80000113.7E71 E75E71-S73 VanDerWaalsContact C-N 3.27Å; E71-S73 PolarHBondContact O-N 2.88Å; S73-E75 PolarHBondContact O-N 3.16Å
74S65.7Low84.4Confident41 Ų4196.7 Ų96.729%0.28748%0.482SS..  trans-80.169.317764.20000110.7S69 E72 E76 K77S69-S74 WeakPolarHBondContact CA-OG 3.39Å; S69-S74 PolarHBondContact O-N 3.29Å; S69-S74 PolarHBondContact O-OG 3.37Å; E72-S74 PolarHBondContact O-N 2.84Å; E72-S74 VanDerWaalsContact O-N 3.12Å; S74-E76 PolarHBondContact O-N 3.46Å; S74-K77 PolarHBondContact O-N 3.2Å
75E65.8Low84.5Confident172 Ų17295.7 Ų95.780%0.80447%0.471SS*.THydrogen-bonded Turntrans-53.9-26.2-174.6-68.5-177.6172.500113.8S73 K77 P79S73-E75 PolarHBondContact O-N 3.16Å; E75-K77 PolarHBondContact O-N 2.64Å; E75-P79 WeakPolarHBondContact O-CD 3.24Å
76E69.8Low84.6Confident177 Ų17796 Ų9683%0.82747%0.471SS*.THydrogen-bonded Turntrans-72.2-29.8-172.4-155.9174.5-155.300113.9S74S74-E76 PolarHBondContact O-N 3.46Å
77K74.2Confident84.9Confident138 Ų13899.9 Ų99.960%0.649%0.487SS*.THydrogen-bonded Turntrans-100.9-19.4-176.8-68-174.5-179.2176.40114.5S74 E75 E80 V81S74-K77 PolarHBondContact O-N 3.2Å; E75-K77 PolarHBondContact O-N 2.64Å; K77-E80 PolarHBondContact O-N 3.22Å; K77-V81 WeakPolarHBondContact O-CG2 3.34Å; K77-V81 PolarHBondContact O-N 3.23Å
78G82.6Confident85.3Confident9 Ų994.5 Ų94.59%0.09346%0.462CS..Hα-helixtrans-52.1-51.4-176.200000113.4E80 V81 Q82G78-E80 PolarHBondContact O-N 3.03Å; G78-V81 PolarHBondContact O-N 3.43Å; G78-Q82 WeakPolarHBondContact O-CB 3.24Å; G78-Q82 PolarHBondContact O-N 3.34Å
79P88.7Confident85.7Confident85 Ų8590 Ų9055%0.55244%0.443SS*.Hα-helixtrans-62.8-40.9-177.5-25.335.2000114.4E75 Q82 E83E75-P79 WeakPolarHBondContact O-CD 3.24Å; P79-Q82 PolarHBondContact O-N 2.91Å; P79-E83 WeakPolarHBondContact O-CB 3.46Å; P79-E83 PolarHBondContact O-N 2.84Å
80E91.1Very high86.3Confident140 Ų14094.2 Ų94.265%0.65447%0.468SS*.Hα-helixtrans-68.1-38.9-179.6-63.9-178.116100111.7K77 G78 Y84K77-E80 PolarHBondContact O-N 3.22Å; G78-E80 PolarHBondContact O-N 3.03Å; E80-Y84 PolarHBondContact O-N 2.83Å; E80-Y84 VanDerWaalsContact O-N 3.12Å
81V93.3Very high87.1Confident23 Ų2392.5 Ų92.514%0.13946%0.457CS..Hα-helixtrans-68.3-43.2176.9177.90000110.5I65 E66 K77 G78 Y84 R85I65-V81 HydrophobicContact CB-CG1 4.14Å; I65-V81 HydrophobicContact CG2-CG1 3.88Å; I65-V81 HydrophobicContact CG2-CG2 3.88Å; E66-V81 HydrophobicContact CB-CG1 3.84Å; K77-V81 WeakPolarHBondContact O-CG2 3.34Å; K77-V81 PolarHBondContact O-N 3.23Å; G78-V81 PolarHBondContact O-N 3.43Å; V81-Y84 PolarHBondContact O-N 3.23Å; V81-R85 WeakPolarHBondContact O-CB 3.41Å; V81-R85 PolarHBondContact O-N 3.35Å
82Q93.7Very high87.9Confident84 Ų8486.2 Ų86.239%0.39343%0.427SS..Hα-helixtrans-59-50.8175.8179.7178.2-1.700111.3E66 G78 P79 Y84 R85 E86E66-Q82 WeakPolarHBondContact OE1-CA 3.45Å; E66-Q82 VanDerWaalsContact OE1-CB 3.3Å; E66-Q82 WeakPolarHBondContact OE1-CB 3.47Å; E66-Q82 WeakPolarHBondContact OE1-CG 3.45Å; G78-Q82 WeakPolarHBondContact O-CB 3.24Å; G78-Q82 PolarHBondContact O-N 3.34Å; P79-Q82 PolarHBondContact O-N 2.91Å; Q82-Y84 VanDerWaalsContact C-N 3.27Å; Q82-Y84 PolarHBondContact O-N 3.35Å; Q82-R85 WeakPolarHBondContact O-CB 3.47Å; Q82-R85 PolarHBondContact O-N 2.76Å; Q82-R85 VanDerWaalsContact O-N 3.16Å; Q82-E86 HydrophobicContact CG-CG 4.44Å; Q82-E86 WeakPolarHBondContact CG-OE1 3.35Å; Q82-E86 PolarHBondContact NE2-OE1 3Å; Q82-E86 WeakPolarHBondContact O-CG 3.47Å; Q82-E86 PolarHBondContact O-N 3.34Å
83E95.7Very high88.8Confident143 Ų14382.8 Ų82.867%0.66841%0.408SS*.Hα-helixtrans-56.6-43.8179.1-177.4-178.2175.800111.1P79 E86 K87P79-E83 WeakPolarHBondContact O-CB 3.46Å; P79-E83 PolarHBondContact O-N 2.84Å; E83-E86 PolarHBondContact O-N 3.14Å; E83-K87 PolarHBondContact O-N 3.18Å
84Y96.9Very high90.2Very high127 Ų12779.6 Ų79.650%0.49839%0.392SS..Hα-helixtrans-71.1-35.8179.7-166.7-135.3000112.8L62 E80 V81 Q82 K87 V88L62-Y84 HydrophobicContact CD1-CD1 3.68Å; L62-Y84 HydrophobicContact CD1-CE1 4.01Å; L62-Y84 HydrophobicContact CD1-CG 4.24Å; L62-Y84 HydrophobicContact CD2-CD1 3.57Å; L62-Y84 HydrophobicContact CD2-CE1 4.14Å; L62-Y84 HydrophobicContact CG-CD1 4.29Å; E80-Y84 PolarHBondContact O-N 2.83Å; E80-Y84 VanDerWaalsContact O-N 3.12Å; V81-Y84 PolarHBondContact O-N 3.23Å; Q82-Y84 VanDerWaalsContact C-N 3.27Å; Q82-Y84 PolarHBondContact O-N 3.35Å; Y84-K87 HydrophobicContact CD2-CD 4.16Å; Y84-K87 HydrophobicContact CE2-CD 4.23Å; Y84-K87 PolarHBondContact O-N 3.47Å; Y84-V88 WeakPolarHBondContact O-CG2 2.96Å; Y84-V88 PolarHBondContact O-N 3.09Å; Y84-V88 VanDerWaalsContact O-N 3.13Å
85R96.8Very high91.8Very high30 Ų3078.8 Ų78.811%0.11339%0.385CS..Hα-helixtrans-60.7-45.9172.1-174.4-171.256.465.85111.2L62 S63 E66 V81 Q82 K87 V88 E89L62-R85 HydrophobicContact CB-CB 3.95Å; L62-R85 HydrophobicContact CB-CG 4.13Å; S63-R85 VanDerWaalsContact OG-CD 3.28Å; S63-R85 WeakPolarHBondContact OG-CD 3.5Å; E66-R85 VanDerWaalsContact CD-NE 3.34Å; E66-R85 IonicContact OE1-CZ 3.21Å; E66-R85 IonicContact OE1-NE 3.31Å; E66-R85 PolarHBondContact OE1-NE 3.14Å; E66-R85 IonicContact OE1-NH2 3.37Å; E66-R85 PolarHBondContact OE1-NH2 3.45Å; E66-R85 VanDerWaalsContact OE2-CD 3.25Å; E66-R85 WeakPolarHBondContact OE2-CD 3.5Å; E66-R85 IonicContact OE2-CZ 3.97Å; E66-R85 IonicContact OE2-NE 2.71Å; E66-R85 PolarHBondContact OE2-NE 3Å; E66-R85 IonicContact OE2-NH2 3.83Å; V81-R85 WeakPolarHBondContact O-CB 3.41Å; V81-R85 PolarHBondContact O-N 3.35Å; Q82-R85 WeakPolarHBondContact O-CB 3.47Å; Q82-R85 PolarHBondContact O-N 2.76Å; Q82-R85 VanDerWaalsContact O-N 3.16Å; R85-K87 VanDerWaalsContact C-N 3.33Å; R85-K87 PolarHBondContact O-N 2.83Å; R85-V88 PolarHBondContact O-N 3.02Å; R85-E89 IonicContact NH1-OE2 3.78Å; R85-E89 PolarHBondContact NH1-OE2 3.12Å; R85-E89 VanDerWaalsContact NH1-OE2 3.07Å; R85-E89 WeakPolarHBondContact O-CB 3.28Å; R85-E89 PolarHBondContact O-N 3.24Å
86E96.6Very high93.3Very high84 Ų8470.6 Ų70.639%0.39335%0.346SS..Hα-helixtrans-65.4-34.6179.6-72.1176.1-176.300112.4Q82 E83 E89 T90Q82-E86 HydrophobicContact CG-CG 4.44Å; Q82-E86 WeakPolarHBondContact CG-OE1 3.35Å; Q82-E86 PolarHBondContact NE2-OE1 3Å; Q82-E86 WeakPolarHBondContact O-CG 3.47Å; Q82-E86 PolarHBondContact O-N 3.34Å; E83-E86 PolarHBondContact O-N 3.14Å; E86-E89 PolarHBondContact O-N 3.23Å; E86-T90 PolarHBondContact O-N 2.94Å; E86-T90 PolarHBondContact O-OG1 3.08Å
87K98Very high94.7Very high111 Ų11166.7 Ų66.748%0.48333%0.331SS..Hα-helixtrans-60.8-51.1170.7180-175.7170.9-171.90111.5E83 Y84 R85 E89 T90 E91E83-K87 PolarHBondContact O-N 3.18Å; Y84-K87 HydrophobicContact CD2-CD 4.16Å; Y84-K87 HydrophobicContact CE2-CD 4.23Å; Y84-K87 PolarHBondContact O-N 3.47Å; R85-K87 VanDerWaalsContact C-N 3.33Å; R85-K87 PolarHBondContact O-N 2.83Å; K87-E89 VanDerWaalsContact C-N 3.28Å; K87-E89 PolarHBondContact O-N 3.37Å; K87-T90 WeakPolarHBondContact O-CB 3.41Å; K87-T90 PolarHBondContact O-N 3.11Å; K87-T90 VanDerWaalsContact O-N 3.15Å; K87-E91 WeakPolarHBondContact CE-OE1 3.47Å; K87-E91 WeakPolarHBondContact O-CG 3.48Å; K87-E91 PolarHBondContact O-N 3.43Å
88V98.1Very high95.9Very high4 Ų462.1 Ų62.12%0.02432%0.315CS..Hα-helixtrans-61.3-39.2178170.40000111Q55 A58 W59 L62 Y84 R85 T90 E91 L92Q55-V88 WeakPolarHBondContact O-CG1 3.5Å; A58-V88 HydrophobicContact CB-CG1 3.98Å; A58-V88 HydrophobicContact CB-CG2 4.42Å; W59-V88 HydrophobicContact CB-CG1 3.8Å; L62-V88 HydrophobicContact CD1-CB 4.25Å; L62-V88 HydrophobicContact CD1-CG2 3.7Å; Y84-V88 WeakPolarHBondContact O-CG2 2.96Å; Y84-V88 PolarHBondContact O-N 3.09Å; Y84-V88 VanDerWaalsContact O-N 3.13Å; R85-V88 PolarHBondContact O-N 3.02Å; V88-T90 VanDerWaalsContact C-N 3.34Å; V88-T90 PolarHBondContact O-N 3Å; V88-E91 PolarHBondContact O-N 3.2Å; V88-L92 WeakPolarHBondContact O-CB 3.34Å; V88-L92 PolarHBondContact O-N 3.27Å
89E97.5Very high96.6Very high22 Ų2261.9 Ų61.910%0.10331%0.312CS..Hα-helixtrans-60.2-43.5174.3-175.2178.8151.600112.1R85 E86 K87 L92 R93 V134R85-E89 IonicContact NH1-OE2 3.78Å; R85-E89 PolarHBondContact NH1-OE2 3.12Å; R85-E89 VanDerWaalsContact NH1-OE2 3.07Å; R85-E89 WeakPolarHBondContact O-CB 3.28Å; R85-E89 PolarHBondContact O-N 3.24Å; E86-E89 PolarHBondContact O-N 3.23Å; K87-E89 VanDerWaalsContact C-N 3.28Å; K87-E89 PolarHBondContact O-N 3.37Å; E89-L92 PolarHBondContact O-N 2.97Å; E89-R93 WeakPolarHBondContact O-CB 3.02Å; E89-R93 VanDerWaalsContact O-CG 3.31Å; E89-R93 WeakPolarHBondContact O-CG 3.29Å; E89-R93 PolarHBondContact O-N 3.47Å; E89-R93 IonicContact OE1-CZ 3.48Å; E89-R93 VanDerWaalsContact OE1-CZ 3.3Å; E89-R93 IonicContact OE1-NE 2.86Å; E89-R93 PolarHBondContact OE1-NE 3.5Å; E89-R93 VanDerWaalsContact OE1-NE 3.08Å; E89-R93 IonicContact OE1-NH2 3.07Å; E89-R93 PolarHBondContact OE1-NH2 2.99Å; E89-V134 HydrophobicContact CG-CB 3.95Å; E89-V134 HydrophobicContact CG-CG2 3.93Å
90T97.9Very high97.1Very high99 Ų9958.2 Ų58.261%0.60729%0.288SS*.Hα-helixtrans-62.6-42.3176.6-59.40000111.5E86 K87 V88 R93 G94E86-T90 PolarHBondContact O-N 2.94Å; E86-T90 PolarHBondContact O-OG1 3.08Å; K87-T90 WeakPolarHBondContact O-CB 3.41Å; K87-T90 PolarHBondContact O-N 3.11Å; K87-T90 VanDerWaalsContact O-N 3.15Å; V88-T90 VanDerWaalsContact C-N 3.34Å; V88-T90 PolarHBondContact O-N 3Å; T90-R93 PolarHBondContact O-N 3.22Å; T90-G94 PolarHBondContact O-N 3.42Å
91E98.1Very high97.4Very high77 Ų7753.1 Ų53.136%0.3627%0.273SS..Hα-helixtrans-64.1-44.8176.1-69.2176-171.400111.6Q55 K87 V88 G94 V95Q55-E91 PolarHBondContact NE2-OE2 3.48Å; Q55-E91 PolarHBondContact OE1-OE2 3.35Å; K87-E91 WeakPolarHBondContact CE-OE1 3.47Å; K87-E91 WeakPolarHBondContact O-CG 3.48Å; K87-E91 PolarHBondContact O-N 3.43Å; V88-E91 PolarHBondContact O-N 3.2Å; E91-G94 PolarHBondContact O-N 3.38Å; E91-V95 WeakPolarHBondContact O-CG2 3.4Å; E91-V95 PolarHBondContact O-N 3.44Å
92L98.2Very high97.7Very high0 Ų052.3 Ų52.30%027%0.268CS..Hα-helixtrans-58.4-49.5175-174.8161.7000111.2V52 Q55 R56 V88 E89 G94 V95 C96 V134V52-L92 HydrophobicContact CG2-CG 4.34Å; Q55-L92 HydrophobicContact CB-CB 4.09Å; Q55-L92 HydrophobicContact CB-CG 4.44Å; R56-L92 HydrophobicContact CB-CD1 4.45Å; R56-L92 HydrophobicContact CG-CD1 3.54Å; R56-L92 HydrophobicContact CG-CG 4.43Å; V88-L92 WeakPolarHBondContact O-CB 3.34Å; V88-L92 PolarHBondContact O-N 3.27Å; E89-L92 PolarHBondContact O-N 2.97Å; L92-G94 VanDerWaalsContact C-N 3.32Å; L92-G94 PolarHBondContact O-N 2.93Å; L92-V95 PolarHBondContact O-N 2.87Å; L92-C96 PolarHBondContact O-N 2.88Å; L92-C96 PolarHBondContact O-SG 3.42Å; L92-V134 HydrophobicContact CD1-CG1 3.86Å; L92-V134 HydrophobicContact CD2-CG1 4.5Å; L92-V134 HydrophobicContact CD2-CG2 4.07Å
93R97.9Very high97.9Very high71 Ų7148.3 Ų48.327%0.26825%0.249SC..Hα-helixtrans-57.5-45.7177.4-73.4175.6-177.1-121.69111.1E89 T90 V95 C96 D97 L131 V134E89-R93 WeakPolarHBondContact O-CB 3.02Å; E89-R93 VanDerWaalsContact O-CG 3.31Å; E89-R93 WeakPolarHBondContact O-CG 3.29Å; E89-R93 PolarHBondContact O-N 3.47Å; E89-R93 IonicContact OE1-CZ 3.48Å; E89-R93 VanDerWaalsContact OE1-CZ 3.3Å; E89-R93 IonicContact OE1-NE 2.86Å; E89-R93 PolarHBondContact OE1-NE 3.5Å; E89-R93 VanDerWaalsContact OE1-NE 3.08Å; E89-R93 IonicContact OE1-NH2 3.07Å; E89-R93 PolarHBondContact OE1-NH2 2.99Å; T90-R93 PolarHBondContact O-N 3.22Å; R93-V95 VanDerWaalsContact C-N 3.32Å; R93-V95 PolarHBondContact O-N 3.07Å; R93-C96 PolarHBondContact O-N 2.98Å; R93-C96 VanDerWaalsContact O-N 3.15Å; R93-D97 WeakPolarHBondContact O-CB 3.46Å; R93-D97 VanDerWaalsContact O-CG 3.28Å; R93-D97 PolarHBondContact O-N 3.44Å; R93-L131 HydrophobicContact CB-CD2 4.16Å; R93-L131 HydrophobicContact CG-CD2 3.8Å; R93-V134 HydrophobicContact CG-CG2 4.44Å
94G98.2Very high98Very high35 Ų3544.1 Ų44.136%0.36123%0.231SC..Hα-helixtrans-60.5-37.1177.600000114.1T90 E91 L92 T98T90-G94 PolarHBondContact O-N 3.42Å; E91-G94 PolarHBondContact O-N 3.38Å; L92-G94 VanDerWaalsContact C-N 3.32Å; L92-G94 PolarHBondContact O-N 2.93Å; G94-T98 WeakPolarHBondContact O-CB 3.48Å; G94-T98 PolarHBondContact O-N 3.38Å; G94-T98 VanDerWaalsContact O-N 3.11Å; G94-T98 PolarHBondContact O-OG1 3.01Å
95V98.4Very high97.9Very high23 Ų2341.7 Ų41.714%0.13923%0.23CC..Hα-helixtrans-66.4-47173.6175.10000110.5Y48 V51 V52 E91 L92 R93 T98 V99 Y127Y48-V95 HydrophobicContact CD1-CG1 4.05Å; V51-V95 HydrophobicContact CG1-CG1 4.17Å; V51-V95 HydrophobicContact CG1-CG2 3.73Å; V52-V95 HydrophobicContact CB-CG1 4.06Å; V52-V95 HydrophobicContact CG2-CG1 4.43Å; E91-V95 WeakPolarHBondContact O-CG2 3.4Å; E91-V95 PolarHBondContact O-N 3.44Å; L92-V95 PolarHBondContact O-N 2.87Å; R93-V95 VanDerWaalsContact C-N 3.32Å; R93-V95 PolarHBondContact O-N 3.07Å; V95-T98 PolarHBondContact O-N 2.79Å; V95-V99 WeakPolarHBondContact O-CG2 3.34Å; V95-V99 PolarHBondContact O-N 2.77Å; V95-V99 VanDerWaalsContact O-N 3.09Å; V95-Y127 HydrophobicContact CG1-CE1 4.42Å
96C98.5Very high97.9Very high0 Ų042.6 Ų42.60%024%0.235CC..Hα-helixtrans-61.1-47.5177.8-69.20000112.5L92 R93 T98 V99 L100 Y127 L131L92-C96 PolarHBondContact O-N 2.88Å; L92-C96 PolarHBondContact O-SG 3.42Å; R93-C96 PolarHBondContact O-N 2.98Å; R93-C96 VanDerWaalsContact O-N 3.15Å; C96-T98 VanDerWaalsContact C-N 3.27Å; C96-T98 PolarHBondContact O-N 3.4Å; C96-V99 PolarHBondContact O-N 3.07Å; C96-V99 VanDerWaalsContact O-N 3.14Å; C96-L100 WeakPolarHBondContact O-CB 3.42Å; C96-L100 VanDerWaalsContact O-CG 3.24Å; C96-L100 WeakPolarHBondContact O-CG 3.1Å; C96-L100 PolarHBondContact O-N 3.35Å; C96-Y127 HydrophobicContact CB-CD1 4.16Å; C96-L131 HydrophobicContact CB-CD1 3.92Å; C96-L131 HydrophobicContact CB-CD2 3.59Å; C96-L131 HydrophobicContact CB-CG 3.56Å
97D98.4Very high97.9Very high95 Ų9539 Ų3951%0.50822%0.219SC..Hα-helixtrans-61.6-37.4179.7-69.3-19.5000111.6R93 G101R93-D97 WeakPolarHBondContact O-CB 3.46Å; R93-D97 VanDerWaalsContact O-CG 3.28Å; R93-D97 PolarHBondContact O-N 3.44Å; D97-G101 PolarHBondContact O-N 3.41Å
98T98.5Very high97.8Very high43 Ų4335.4 Ų35.426%0.26420%0.204SC..Hα-helixtrans-61.2-49.2173.9-64.70000111.1K27 Y48 G94 V95 C96 G101 L102K27-T98 HydrophobicContact CD-CG2 3.88Å; Y48-T98 HydrophobicContact CE1-CG2 4.12Å; Y48-T98 WeakPolarHBondContact OH-CG2 3.01Å; G94-T98 WeakPolarHBondContact O-CB 3.48Å; G94-T98 PolarHBondContact O-N 3.38Å; G94-T98 VanDerWaalsContact O-N 3.11Å; G94-T98 PolarHBondContact O-OG1 3.01Å; V95-T98 PolarHBondContact O-N 2.79Å; C96-T98 VanDerWaalsContact C-N 3.27Å; C96-T98 PolarHBondContact O-N 3.4Å; T98-G101 PolarHBondContact O-N 3.29Å; T98-L102 HydrophobicContact CG2-CD1 4.3Å; T98-L102 WeakPolarHBondContact O-CG 3.49Å; T98-L102 PolarHBondContact O-N 3.08Å
99V98.6Very high97.4Very high3 Ų342.3 Ų42.32%0.01823%0.234CC..Hα-helixtrans-65.9-46.6-179171.40000111.4Y48 V95 C96 G101 L102 L103 M123 Y127Y48-V99 HydrophobicContact CD1-CG2 3.31Å; Y48-V99 HydrophobicContact CD2-CG2 3.89Å; Y48-V99 HydrophobicContact CE1-CG2 3.67Å; Y48-V99 HydrophobicContact CE2-CG2 4.23Å; Y48-V99 HydrophobicContact CG-CG2 3.41Å; Y48-V99 VanDerWaalsContact CG-CG2 3.41Å; V95-V99 WeakPolarHBondContact O-CG2 3.34Å; V95-V99 PolarHBondContact O-N 2.77Å; V95-V99 VanDerWaalsContact O-N 3.09Å; C96-V99 PolarHBondContact O-N 3.07Å; C96-V99 VanDerWaalsContact O-N 3.14Å; V99-G101 VanDerWaalsContact C-N 3.29Å; V99-G101 PolarHBondContact O-N 2.93Å; V99-L102 PolarHBondContact O-N 2.95Å; V99-L103 HydrophobicContact CG1-CD1 3.64Å; V99-L103 HydrophobicContact CG1-CG 4.18Å; V99-L103 WeakPolarHBondContact O-CB 3.28Å; V99-L103 VanDerWaalsContact O-CG 3.25Å; V99-L103 WeakPolarHBondContact O-CG 3.47Å; V99-L103 PolarHBondContact O-N 3.3Å; V99-M123 HydrophobicContact CG1-CE 3.78Å; V99-M123 HydrophobicContact CG1-CG 4.46Å; V99-Y127 HydrophobicContact CB-CD1 3.89Å; V99-Y127 HydrophobicContact CB-CD2 4.26Å; V99-Y127 HydrophobicContact CB-CE1 3.94Å; V99-Y127 HydrophobicContact CB-CE2 4.37Å; V99-Y127 HydrophobicContact CB-CG 4.04Å; V99-Y127 HydrophobicContact CG1-CD1 4.05Å; V99-Y127 HydrophobicContact CG1-CD2 3.5Å; V99-Y127 VanDerWaalsContact CG1-CD2 3.5Å; V99-Y127 HydrophobicContact CG1-CE1 4.12Å; V99-Y127 HydrophobicContact CG1-CE2 3.63Å; V99-Y127 HydrophobicContact CG1-CG 3.74Å; V99-Y127 HydrophobicContact CG2-CD1 4.12Å; V99-Y127 HydrophobicContact CG2-CE1 3.66Å; V99-Y127 HydrophobicContact CG2-CE2 4.4Å
100L98.7Very high97Very high9 Ų946.7 Ų46.75%0.04725%0.254CS..Hα-helixtrans-59-42.4177.4-68.2172.1000111.1C96 L103 D104 K124 Y128 L131C96-L100 WeakPolarHBondContact O-CB 3.42Å; C96-L100 VanDerWaalsContact O-CG 3.24Å; C96-L100 WeakPolarHBondContact O-CG 3.1Å; C96-L100 PolarHBondContact O-N 3.35Å; L100-L103 PolarHBondContact O-N 3.45Å; L100-D104 WeakPolarHBondContact O-CB 3.43Å; L100-D104 PolarHBondContact O-N 3.17Å; L100-K124 HydrophobicContact CD2-CG 3.82Å; L100-Y128 HydrophobicContact CD1-CD1 3.92Å; L100-Y128 HydrophobicContact CD1-CE1 3.66Å; L100-Y128 HydrophobicContact CD1-CE2 4.33Å; L100-Y128 HydrophobicContact CD1-CG 4.37Å; L100-Y128 HydrophobicContact CD2-CD2 3.79Å; L100-Y128 HydrophobicContact CD2-CE1 4.43Å; L100-Y128 HydrophobicContact CD2-CE2 3.62Å; L100-Y128 HydrophobicContact CD2-CG 4.25Å; L100-L131 HydrophobicContact CD1-CD1 3.63Å
101G98.2Very high96.6Very high33 Ų3342.6 Ų42.634%0.3423%0.23SC..Hα-helixtrans-61-43.3174.600000113.4D97 T98 V99 T105D97-G101 PolarHBondContact O-N 3.41Å; T98-G101 PolarHBondContact O-N 3.29Å; V99-G101 VanDerWaalsContact C-N 3.29Å; V99-G101 PolarHBondContact O-N 2.93Å; G101-T105 WeakPolarHBondContact O-CB 3.27Å; G101-T105 PolarHBondContact O-N 3.27Å; G101-T105 PolarHBondContact O-OG1 3.39Å
102L98.2Very high96.2Very high6 Ų642.1 Ų42.13%0.03125%0.246CC..Hα-helixtrans-65.2-41.5175.7-69.9173.3000112.1K27 V30 E31 Y48 T98 V99 H106 L107K27-L102 HydrophobicContact CB-CD1 4.29Å; K27-L102 HydrophobicContact CG-CD1 4.1Å; K27-L102 HydrophobicContact CG-CD2 4.19Å; V30-L102 HydrophobicContact CB-CD2 4.35Å; V30-L102 HydrophobicContact CG1-CB 4.49Å; V30-L102 HydrophobicContact CG1-CD2 3.95Å; E31-L102 HydrophobicContact CG-CD2 3.99Å; Y48-L102 HydrophobicContact CE2-CD1 4.15Å; T98-L102 HydrophobicContact CG2-CD1 4.3Å; T98-L102 WeakPolarHBondContact O-CG 3.49Å; T98-L102 PolarHBondContact O-N 3.08Å; V99-L102 PolarHBondContact O-N 2.95Å; L102-H106 WeakPolarHBondContact O-CB 3.16Å; L102-H106 PolarHBondContact O-N 2.96Å; L102-L107 HydrophobicContact CB-CD1 4.34Å; L102-L107 PolarHBondContact O-N 2.92Å; L102-L107 VanDerWaalsContact O-N 3.08Å
103L98.2Very high96Very high0 Ų045.3 Ų45.30%026%0.263CS..Iπ-helixtrans-61.5-49.3178.1-71.8166.6000111.1V99 L100 L107 I108 Y120 M123 K124V99-L103 HydrophobicContact CG1-CD1 3.64Å; V99-L103 HydrophobicContact CG1-CG 4.18Å; V99-L103 WeakPolarHBondContact O-CB 3.28Å; V99-L103 VanDerWaalsContact O-CG 3.25Å; V99-L103 WeakPolarHBondContact O-CG 3.47Å; V99-L103 PolarHBondContact O-N 3.3Å; L100-L103 PolarHBondContact O-N 3.45Å; L103-L107 HydrophobicContact CD2-CB 4.25Å; L103-L107 HydrophobicContact CD2-CD1 3.83Å; L103-L107 HydrophobicContact CG-CD1 4.34Å; L103-L107 PolarHBondContact O-N 3.18Å; L103-I108 HydrophobicContact CB-CD1 3.99Å; L103-I108 HydrophobicContact CB-CG1 4.34Å; L103-I108 WeakPolarHBondContact O-CB 3.39Å; L103-I108 WeakPolarHBondContact O-CG1 3.16Å; L103-I108 PolarHBondContact O-N 2.98Å; L103-Y120 HydrophobicContact CD2-CD1 3.86Å; L103-Y120 HydrophobicContact CD2-CG 4.12Å; L103-M123 HydrophobicContact CD1-CB 4.3Å; L103-M123 HydrophobicContact CD1-CG 4.18Å; L103-M123 HydrophobicContact CD2-CB 4.35Å; L103-M123 HydrophobicContact CD2-CG 4.49Å; L103-M123 HydrophobicContact CD2-SD 4.21Å; L103-K124 HydrophobicContact CD1-CB 3.93Å
104D97.2Very high95.9Very high54 Ų5442.7 Ų42.729%0.28926%0.257SS..Iπ-helixtrans-76.2-28.3-175.9-73.6-18.7000113.6L100 K109 K124L100-D104 WeakPolarHBondContact O-CB 3.43Å; L100-D104 PolarHBondContact O-N 3.17Å; D104-K109 WeakPolarHBondContact O-CD 3.29Å; D104-K109 WeakPolarHBondContact O-CE 3.37Å; D104-K109 PolarHBondContact O-NZ 3.25Å; D104-K124 VanDerWaalsContact OD1-CE 3.28Å; D104-K124 WeakPolarHBondContact OD1-CE 3.34Å; D104-K124 IonicContact OD1-NZ 3.3Å; D104-K124 PolarHBondContact OD1-NZ 2.99Å; D104-K124 IonicContact OD2-NZ 2.68Å; D104-K124 PolarHBondContact OD2-NZ 3.42Å
105T96Very high95.8Very high77 Ų7744.3 Ų44.347%0.47226%0.255SS..Iπ-helixtrans-91.5-36.6-176.1-51.70000112.6G101G101-T105 WeakPolarHBondContact O-CB 3.27Å; G101-T105 PolarHBondContact O-N 3.27Å; G101-T105 PolarHBondContact O-OG1 3.39Å
106H95.6Very high95.7Very high48 Ų4843.4 Ų43.422%0.22225%0.25CC..Iπ-helixtrans-122.9-53-171-58.7-76000112.7V30 L102 E110V30-H106 HydrophobicContact CG1-CB 3.58Å; L102-H106 WeakPolarHBondContact O-CB 3.16Å; L102-H106 PolarHBondContact O-N 2.96Å; H106-E110 VanDerWaalsContact O-CB 3.29Å; H106-E110 WeakPolarHBondContact O-CB 3.5Å; H106-E110 WeakPolarHBondContact O-CG 3.35Å; H106-E110 PolarHBondContact O-N 3.32Å
107L97.2Very high95.7Very high10 Ų1047 Ų475%0.05226%0.263CS..Iπ-helixtrans-81.1-46.7-161-58.9163.8000113.7V30 L36 L44 L102 L103 A111 Y120V30-L107 HydrophobicContact CG1-CD1 4.41Å; V30-L107 HydrophobicContact CG1-CD2 3.79Å; V30-L107 HydrophobicContact CG1-CG 3.95Å; V30-L107 HydrophobicContact CG2-CD2 4Å; L36-L107 HydrophobicContact CD1-CD2 3.79Å; L36-L107 HydrophobicContact CG-CD2 3.98Å; L44-L107 HydrophobicContact CD2-CD1 3.41Å; L44-L107 VanDerWaalsContact CD2-CD1 3.41Å; L44-L107 HydrophobicContact CD2-CD2 4.35Å; L102-L107 HydrophobicContact CB-CD1 4.34Å; L102-L107 PolarHBondContact O-N 2.92Å; L102-L107 VanDerWaalsContact O-N 3.08Å; L103-L107 HydrophobicContact CD2-CB 4.25Å; L103-L107 HydrophobicContact CD2-CD1 3.83Å; L103-L107 HydrophobicContact CG-CD1 4.34Å; L103-L107 PolarHBondContact O-N 3.18Å; L107-A111 WeakPolarHBondContact O-CB 3.25Å; L107-A111 PolarHBondContact O-N 3.4Å; L107-Y120 HydrophobicContact CB-CD1 3.87Å; L107-Y120 HydrophobicContact CB-CD2 3.89Å; L107-Y120 HydrophobicContact CB-CE1 3.92Å; L107-Y120 HydrophobicContact CB-CE2 3.95Å; L107-Y120 HydrophobicContact CB-CG 3.88Å; L107-Y120 HydrophobicContact CD1-CD1 4.24Å; L107-Y120 HydrophobicContact CD1-CE1 4.14Å; L107-Y120 HydrophobicContact CD2-CE1 4.04Å; L107-Y120 HydrophobicContact CG-CE1 4.26Å; L107-Y120 WeakPolarHBondContact O-CD2 3.48Å; L107-Y120 WeakPolarHBondContact O-CE2 3.27Å
108I96.2Very high95.7Very high35 Ų3542.5 Ų42.518%0.17924%0.239CC..THydrogen-bonded Turntrans-69.3-37.4-178.8-66.2171.2000110.6L103 L121 K124L103-I108 HydrophobicContact CB-CD1 3.99Å; L103-I108 HydrophobicContact CB-CG1 4.34Å; L103-I108 WeakPolarHBondContact O-CB 3.39Å; L103-I108 WeakPolarHBondContact O-CG1 3.16Å; L103-I108 PolarHBondContact O-N 2.98Å; I108-L121 HydrophobicContact CD1-CD2 4.08Å; I108-K124 HydrophobicContact CD1-CB 4.41Å; I108-K124 HydrophobicContact CD1-CD 3.74Å
109K90.2Very high95.6Very high148 Ų14841.7 Ų41.764%0.64323%0.232SC*.THydrogen-bonded Turntrans-68.1-37.7-179.1-72.9178178.1154.90113D104D104-K109 WeakPolarHBondContact O-CD 3.29Å; D104-K109 WeakPolarHBondContact O-CE 3.37Å; D104-K109 PolarHBondContact O-NZ 3.25Å
110E87.8Confident95.6Very high115 Ų11541.6 Ų41.654%0.53723%0.231SC..THydrogen-bonded Turntrans-94.21.5-176.3-57.9-60140.800113.1H106 G112H106-E110 VanDerWaalsContact O-CB 3.29Å; H106-E110 WeakPolarHBondContact O-CB 3.5Å; H106-E110 WeakPolarHBondContact O-CG 3.35Å; H106-E110 PolarHBondContact O-N 3.32Å; E110-G112 PolarHBondContact O-N 3.03Å; E110-G112 VanDerWaalsContact O-N 3.09Å
111A90.8Very high95.6Very high13 Ų1341.3 Ų41.311%0.10723%0.23CC..  trans-69.7106.7-179.600000111.2L107 R117 Y120L107-A111 WeakPolarHBondContact O-CB 3.25Å; L107-A111 PolarHBondContact O-N 3.4Å; A111-R117 HydrophobicContact CB-CB 4.4Å; A111-R117 HydrophobicContact CB-CG 3.52Å; A111-Y120 HydrophobicContact CB-CD2 3.97Å; A111-Y120 HydrophobicContact CB-CE2 4.1Å
112G89.6Confident95.7Very high67 Ų6741.6 Ų41.669%0.69122%0.222SC*.  trans-76.7-22.5-174.600000114.4E35 E110E35-G112 PolarHBondContact OE1-N 3.46Å; E110-G112 PolarHBondContact O-N 3.03Å; E110-G112 VanDerWaalsContact O-N 3.09Å
113D94.2Very high95.7Very high67 Ų6741.8 Ų41.836%0.35822%0.222SC..SBendtrans-123.9164.7-174.674.780.7000113.3E115 S116 R117D113-E115 PolarHBondContact O-N 3.01Å; D113-E115 VanDerWaalsContact OD1-CA 3.29Å; D113-E115 WeakPolarHBondContact OD1-CA 3.35Å; D113-E115 WeakPolarHBondContact OD1-CB 3.34Å; D113-E115 PolarHBondContact OD1-N 2.94Å; D113-S116 PolarHBondContact OD1-N 2.89Å; D113-S116 PolarHBondContact OD1-OG 3.06Å; D113-S116 VanDerWaalsContact OD2-CB 3.31Å; D113-S116 WeakPolarHBondContact OD2-CB 3.31Å; D113-S116 PolarHBondContact OD2-OG 3.24Å; D113-R117 VanDerWaalsContact O-CG 3.32Å; D113-R117 WeakPolarHBondContact O-CG 3.44Å; D113-R117 PolarHBondContact O-N 2.86Å; D113-R117 VanDerWaalsContact O-N 3.14Å; D113-R117 PolarHBondContact O-NE 3.08Å
114A95.5Very high95.7Very high16 Ų1643.7 Ų43.713%0.13223%0.231CC..Hα-helixtrans-64.3-38-179.300000113.3R117 V118 I157 E161A114-R117 PolarHBondContact O-N 3.44Å; A114-V118 WeakPolarHBondContact O-CB 3.47Å; A114-V118 VanDerWaalsContact O-CG2 3.24Å; A114-V118 WeakPolarHBondContact O-CG2 3.23Å; A114-V118 PolarHBondContact O-N 3.47Å; A114-I157 HydrophobicContact CB-CG2 4.24Å; A114-E161 HydrophobicContact CB-CB 3.83Å; A114-E161 HydrophobicContact CB-CG 4.46Å; A114-E161 VanDerWaalsContact CB-OE2 3.29Å; A114-E161 WeakPolarHBondContact CB-OE2 3.49Å
115E95.7Very high95.8Very high68 Ų6841.1 Ų41.132%0.31822%0.217SC..Hα-helixtrans-66.5-45.8-177.5-172.4-175.4112.600110.6R41 D113 V118 F119 M162 I168R41-E115 IonicContact CZ-OE1 2.7Å; R41-E115 IonicContact NH1-OE1 3.56Å; R41-E115 IonicContact NH2-OE1 3.64Å; R41-E115 PolarHBondContact NH2-OE1 2.68Å; D113-E115 PolarHBondContact O-N 3.01Å; D113-E115 VanDerWaalsContact OD1-CA 3.29Å; D113-E115 WeakPolarHBondContact OD1-CA 3.35Å; D113-E115 WeakPolarHBondContact OD1-CB 3.34Å; D113-E115 PolarHBondContact OD1-N 2.94Å; E115-V118 PolarHBondContact O-N 2.93Å; E115-F119 VanDerWaalsContact O-CB 3.25Å; E115-F119 WeakPolarHBondContact O-CB 3.18Å; E115-F119 PolarHBondContact O-N 3.21Å; E115-M162 HydrophobicContact CG-CE 4.37Å; E115-I168 VanDerWaalsContact CD-CD1 3.45Å; E115-I168 HydrophobicContact CG-CD1 3.2Å; E115-I168 HydrophobicContact CG-CG1 4.46Å; E115-I168 WeakPolarHBondContact OE1-CD1 3.34Å
116S96.7Very high95.9Very high5 Ų537.8 Ų37.84%0.03520%0.196CC..Hα-helixtrans-62.3-44.5175.2-650000111.9R41 D113 F119 Y120R41-S116 PolarHBondContact NH1-OG 2.99Å; R41-S116 VanDerWaalsContact NH1-OG 3.08Å; D113-S116 PolarHBondContact OD1-N 2.89Å; D113-S116 PolarHBondContact OD1-OG 3.06Å; D113-S116 VanDerWaalsContact OD2-CB 3.31Å; D113-S116 WeakPolarHBondContact OD2-CB 3.31Å; D113-S116 PolarHBondContact OD2-OG 3.24Å; S116-F119 PolarHBondContact O-N 3.37Å; S116-Y120 WeakPolarHBondContact O-CD2 3.19Å; S116-Y120 PolarHBondContact O-N 2.98Å
117R97.6Very high96.1Very high76 Ų7635.8 Ų35.829%0.28719%0.187SC..Hα-helixtrans-59.1-49.7175.5-73.3-180-63.9158.15.6111.9A111 D113 A114 F119 Y120 L121 I157 E161A111-R117 HydrophobicContact CB-CB 4.4Å; A111-R117 HydrophobicContact CB-CG 3.52Å; D113-R117 VanDerWaalsContact O-CG 3.32Å; D113-R117 WeakPolarHBondContact O-CG 3.44Å; D113-R117 PolarHBondContact O-N 2.86Å; D113-R117 VanDerWaalsContact O-N 3.14Å; D113-R117 PolarHBondContact O-NE 3.08Å; A114-R117 PolarHBondContact O-N 3.44Å; R117-F119 VanDerWaalsContact C-N 3.35Å; R117-F119 PolarHBondContact O-N 2.92Å; R117-Y120 PolarHBondContact O-N 3.38Å; R117-L121 WeakPolarHBondContact O-CB 3.4Å; R117-L121 WeakPolarHBondContact O-CG 3.27Å; R117-L121 PolarHBondContact O-N 3.29Å; R117-I157 HydrophobicContact CB-CD1 4.47Å; R117-E161 IonicContact NH2-OE1 3.69Å; R117-E161 PolarHBondContact NH2-OE1 3.49Å; R117-E161 IonicContact NH2-OE2 2.64Å; R117-E161 PolarHBondContact NH2-OE2 3.38Å
118V98.5Very high96.1Very high0 Ų037.4 Ų37.40%019%0.193CC..Hα-helixtrans-63.5-41.4179.2172.10000111A114 E115 Y120 K122 A154 I157 M162 I168 L172A114-V118 WeakPolarHBondContact O-CB 3.47Å; A114-V118 VanDerWaalsContact O-CG2 3.24Å; A114-V118 WeakPolarHBondContact O-CG2 3.23Å; A114-V118 PolarHBondContact O-N 3.47Å; E115-V118 PolarHBondContact O-N 2.93Å; V118-Y120 PolarHBondContact O-N 3.16Å; V118-K122 WeakPolarHBondContact O-CB 3.36Å; V118-K122 PolarHBondContact O-N 2.81Å; V118-A154 HydrophobicContact CG1-CB 4.42Å; V118-I157 HydrophobicContact CG2-CB 3.82Å; V118-I157 HydrophobicContact CG2-CG2 3.6Å; V118-M162 HydrophobicContact CB-SD 4.01Å; V118-M162 HydrophobicContact CG1-SD 4.07Å; V118-M162 HydrophobicContact CG2-SD 3.79Å; V118-I168 HydrophobicContact CB-CG2 4.32Å; V118-I168 HydrophobicContact CG1-CG2 3.74Å; V118-L172 HydrophobicContact CG1-CD2 3.99Å
119F98.1Very high96.2Very high25 Ų2536.5 Ų36.511%0.1119%0.187CC..Hα-helixtrans-58.5-49.2176.8-173.9-78.8000111.7R41 E115 S116 R117 M123 I168R41-F119 VanDerWaalsContact CD-CD1 3.47Å; R41-F119 HydrophobicContact CG-CD1 3.51Å; R41-F119 HydrophobicContact CG-CD2 4.39Å; R41-F119 HydrophobicContact CG-CE1 3.33Å; R41-F119 HydrophobicContact CG-CE2 4.23Å; R41-F119 HydrophobicContact CG-CG 4.06Å; R41-F119 HydrophobicContact CG-CZ 3.7Å; E115-F119 VanDerWaalsContact O-CB 3.25Å; E115-F119 WeakPolarHBondContact O-CB 3.18Å; E115-F119 PolarHBondContact O-N 3.21Å; S116-F119 PolarHBondContact O-N 3.37Å; R117-F119 VanDerWaalsContact C-N 3.35Å; R117-F119 PolarHBondContact O-N 2.92Å; F119-M123 HydrophobicContact CE1-SD 4.42Å; F119-M123 WeakPolarHBondContact O-CB 3.3Å; F119-M123 PolarHBondContact O-N 2.84Å; F119-I168 HydrophobicContact CB-CG2 4.5Å; F119-I168 HydrophobicContact CD2-CD1 4.18Å; F119-I168 HydrophobicContact CD2-CG1 4.37Å
120Y98.5Very high96.6Very high2 Ų230.5 Ų30.51%0.00816%0.161CC..Hα-helixtrans-71.8-38.4-178.4-62.8-44.6000112.9R41 L103 L107 A111 S116 R117 V118 M123 K124R41-Y120 HydrophobicContact CG-CE1 3.74Å; L103-Y120 HydrophobicContact CD2-CD1 3.86Å; L103-Y120 HydrophobicContact CD2-CG 4.12Å; L107-Y120 HydrophobicContact CB-CD1 3.87Å; L107-Y120 HydrophobicContact CB-CD2 3.89Å; L107-Y120 HydrophobicContact CB-CE1 3.92Å; L107-Y120 HydrophobicContact CB-CE2 3.95Å; L107-Y120 HydrophobicContact CB-CG 3.88Å; L107-Y120 HydrophobicContact CD1-CD1 4.24Å; L107-Y120 HydrophobicContact CD1-CE1 4.14Å; L107-Y120 HydrophobicContact CD2-CE1 4.04Å; L107-Y120 HydrophobicContact CG-CE1 4.26Å; L107-Y120 WeakPolarHBondContact O-CD2 3.48Å; L107-Y120 WeakPolarHBondContact O-CE2 3.27Å; A111-Y120 HydrophobicContact CB-CD2 3.97Å; A111-Y120 HydrophobicContact CB-CE2 4.1Å; S116-Y120 WeakPolarHBondContact O-CD2 3.19Å; S116-Y120 PolarHBondContact O-N 2.98Å; R117-Y120 PolarHBondContact O-N 3.38Å; V118-Y120 PolarHBondContact O-N 3.16Å; Y120-M123 WeakPolarHBondContact O-CB 3.48Å; Y120-M123 PolarHBondContact O-N 3.02Å; Y120-K124 WeakPolarHBondContact O-CB 3.45Å; Y120-K124 PolarHBondContact O-N 2.98Å
121L98.7Very high97.1Very high3 Ų325.6 Ų25.62%0.01614%0.138CC..Hα-helixtrans-66.8-41175.2-74166.6000111.9I108 R117 M123 K124 G125 E153 A154 I157I108-L121 HydrophobicContact CD1-CD2 4.08Å; R117-L121 WeakPolarHBondContact O-CB 3.4Å; R117-L121 WeakPolarHBondContact O-CG 3.27Å; R117-L121 PolarHBondContact O-N 3.29Å; L121-M123 VanDerWaalsContact C-N 3.32Å; L121-M123 PolarHBondContact O-N 2.62Å; L121-K124 WeakPolarHBondContact O-CB 3.42Å; L121-K124 PolarHBondContact O-N 2.85Å; L121-G125 PolarHBondContact O-N 3.19Å; L121-E153 HydrophobicContact CD1-CB 4.26Å; L121-E153 HydrophobicContact CD1-CG 3.79Å; L121-E153 HydrophobicContact CD2-CB 4.5Å; L121-E153 HydrophobicContact CD2-CG 4.36Å; L121-A154 HydrophobicContact CB-CB 3.7Å; L121-I157 HydrophobicContact CD1-CD1 3.71Å
122K98.6Very high97.4Very high39 Ų3925 Ų2517%0.1713%0.133CC..Hα-helixtrans-56.5-48.5170.3177.7-168.1169.4-67.20110.7V118 K124 G125 D126 G171 L172 N175V118-K122 WeakPolarHBondContact O-CB 3.36Å; V118-K122 PolarHBondContact O-N 2.81Å; K122-K124 VanDerWaalsContact C-N 3.32Å; K122-K124 PolarHBondContact O-N 3.41Å; K122-G125 PolarHBondContact O-N 3.18Å; K122-D126 IonicContact NZ-OD2 3.26Å; K122-D126 PolarHBondContact NZ-OD2 3.32Å; K122-D126 PolarHBondContact O-N 3.43Å; K122-G171 WeakPolarHBondContact CE-O 3.44Å; K122-L172 HydrophobicContact CB-CB 4.49Å; K122-L172 HydrophobicContact CB-CD1 3.91Å; K122-L172 HydrophobicContact CD-CB 4.05Å; K122-L172 HydrophobicContact CG-CB 4.23Å; K122-L172 HydrophobicContact CG-CD1 3.95Å; K122-N175 WeakPolarHBondContact CE-ND2 3.22Å; K122-N175 PolarHBondContact NZ-ND2 3.33Å
123M98.6Very high97.7Very high9 Ų923.5 Ų23.54%0.04411%0.108CC..Hα-helixtrans-59.2-44.7177.2-167.7174.8-177.900110.5L44 V99 L103 F119 Y120 L121 G125 D126 Y127L44-M123 HydrophobicContact CG-CE 4.49Å; V99-M123 HydrophobicContact CG1-CE 3.78Å; V99-M123 HydrophobicContact CG1-CG 4.46Å; L103-M123 HydrophobicContact CD1-CB 4.3Å; L103-M123 HydrophobicContact CD1-CG 4.18Å; L103-M123 HydrophobicContact CD2-CB 4.35Å; L103-M123 HydrophobicContact CD2-CG 4.49Å; L103-M123 HydrophobicContact CD2-SD 4.21Å; F119-M123 HydrophobicContact CE1-SD 4.42Å; F119-M123 WeakPolarHBondContact O-CB 3.3Å; F119-M123 PolarHBondContact O-N 2.84Å; Y120-M123 WeakPolarHBondContact O-CB 3.48Å; Y120-M123 PolarHBondContact O-N 3.02Å; L121-M123 VanDerWaalsContact C-N 3.32Å; L121-M123 PolarHBondContact O-N 2.62Å; M123-G125 VanDerWaalsContact C-N 3.34Å; M123-G125 PolarHBondContact O-N 2.8Å; M123-D126 WeakPolarHBondContact O-CA 3.25Å; M123-D126 WeakPolarHBondContact O-CB 3.36Å; M123-D126 PolarHBondContact O-N 3.21Å; M123-Y127 HydrophobicContact CE-CE2 3.67Å; M123-Y127 HydrophobicContact CG-CD2 3.86Å; M123-Y127 HydrophobicContact CG-CE2 3.68Å; M123-Y127 VanDerWaalsContact O-CD2 3.27Å; M123-Y127 WeakPolarHBondContact O-CD2 3.4Å; M123-Y127 PolarHBondContact O-N 3.46Å
124K98.8Very high97.8Very high40 Ų4020.4 Ų20.417%0.1749%0.091CC..Hα-helixtrans-56.1-46.7175.2-173172.7178.3173.10112L100 L103 D104 I108 Y120 L121 K122 D126 Y127 Y128 A150L100-K124 HydrophobicContact CD2-CG 3.82Å; L103-K124 HydrophobicContact CD1-CB 3.93Å; D104-K124 VanDerWaalsContact OD1-CE 3.28Å; D104-K124 WeakPolarHBondContact OD1-CE 3.34Å; D104-K124 IonicContact OD1-NZ 3.3Å; D104-K124 PolarHBondContact OD1-NZ 2.99Å; D104-K124 IonicContact OD2-NZ 2.68Å; D104-K124 PolarHBondContact OD2-NZ 3.42Å; I108-K124 HydrophobicContact CD1-CB 4.41Å; I108-K124 HydrophobicContact CD1-CD 3.74Å; Y120-K124 WeakPolarHBondContact O-CB 3.45Å; Y120-K124 PolarHBondContact O-N 2.98Å; L121-K124 WeakPolarHBondContact O-CB 3.42Å; L121-K124 PolarHBondContact O-N 2.85Å; K122-K124 VanDerWaalsContact C-N 3.32Å; K122-K124 PolarHBondContact O-N 3.41Å; K124-D126 VanDerWaalsContact C-N 3.34Å; K124-D126 PolarHBondContact O-N 3.1Å; K124-Y127 PolarHBondContact O-N 3.25Å; K124-Y128 HydrophobicContact CD-CE2 4.35Å; K124-Y128 HydrophobicContact CG-CD2 3.94Å; K124-Y128 HydrophobicContact CG-CE2 3.75Å; K124-Y128 VanDerWaalsContact O-CD2 3.29Å; K124-Y128 WeakPolarHBondContact O-CD2 3.33Å; K124-Y128 PolarHBondContact O-N 3.11Å; K124-Y128 VanDerWaalsContact O-N 3.08Å; K124-A150 HydrophobicContact CB-CB 4.06Å; K124-A150 HydrophobicContact CD-CB 4.21Å; K124-A150 HydrophobicContact CG-CB 3.95Å
125G98.8Very high97.7Very high0 Ų019.9 Ų19.90%09%0.087CC..Hα-helixtrans-58.2-43.9173.400000112.6L121 K122 M123 Y127 Y128 R129L121-G125 PolarHBondContact O-N 3.19Å; K122-G125 PolarHBondContact O-N 3.18Å; M123-G125 VanDerWaalsContact C-N 3.34Å; M123-G125 PolarHBondContact O-N 2.8Å; G125-Y127 PolarHBondContact O-N 3.01Å; G125-Y128 PolarHBondContact O-N 3.38Å; G125-R129 VanDerWaalsContact O-CB 3.31Å; G125-R129 WeakPolarHBondContact O-CB 3.47Å; G125-R129 PolarHBondContact O-N 3.2Å
126D98.8Very high97.3Very high7 Ų721.6 Ų21.64%0.03710%0.102CC..Hα-helixtrans-60.2-45177.7-73.3-38.9000112.6K122 M123 K124 R129 Y130 Y151 N175K122-D126 IonicContact NZ-OD2 3.26Å; K122-D126 PolarHBondContact NZ-OD2 3.32Å; K122-D126 PolarHBondContact O-N 3.43Å; M123-D126 WeakPolarHBondContact O-CA 3.25Å; M123-D126 WeakPolarHBondContact O-CB 3.36Å; M123-D126 PolarHBondContact O-N 3.21Å; K124-D126 VanDerWaalsContact C-N 3.34Å; K124-D126 PolarHBondContact O-N 3.1Å; D126-R129 WeakPolarHBondContact O-CB 3.28Å; D126-R129 PolarHBondContact O-N 3.08Å; D126-R129 IonicContact OD1-CZ 3.62Å; D126-R129 IonicContact OD1-NE 3.99Å; D126-R129 IonicContact OD1-NH2 2.97Å; D126-R129 PolarHBondContact OD1-NH2 3.46Å; D126-Y130 HydrophobicContact CB-CE2 4.21Å; D126-Y130 WeakPolarHBondContact O-CD1 3.49Å; D126-Y130 VanDerWaalsContact O-CD2 3.23Å; D126-Y130 WeakPolarHBondContact O-CD2 3.34Å; D126-Y130 PolarHBondContact O-N 2.86Å; D126-Y151 VanDerWaalsContact CA-OH 3.27Å; D126-Y151 WeakPolarHBondContact CA-OH 3Å; D126-Y151 PolarHBondContact N-OH 2.95Å; D126-Y151 PolarHBondContact OD1-OH 3.4Å; D126-N175 WeakPolarHBondContact OD1-CB 3.46Å; D126-N175 PolarHBondContact OD1-ND2 3.43Å; D126-N175 PolarHBondContact OD2-ND2 2.93Å
127Y98.7Very high96.9Very high6 Ų624.3 Ų24.32%0.02413%0.131CC..Hα-helixtrans-73.5-34.3-179.3-78.7-90.8000113Y48 K49 V52 V95 C96 V99 M123 K124 G125 R129 Y130 L131Y48-Y127 WeakPolarHBondContact CB-OH 3.44Å; Y48-Y127 PolarHBondContact O-OH 3.49Å; K49-Y127 PolarHBondContact N-OH 2.84Å; V52-Y127 HydrophobicContact CB-CE1 4.11Å; V52-Y127 HydrophobicContact CG1-CE1 4.01Å; V52-Y127 HydrophobicContact CG2-CE1 4.28Å; V95-Y127 HydrophobicContact CG1-CE1 4.42Å; C96-Y127 HydrophobicContact CB-CD1 4.16Å; V99-Y127 HydrophobicContact CB-CD1 3.89Å; V99-Y127 HydrophobicContact CB-CD2 4.26Å; V99-Y127 HydrophobicContact CB-CE1 3.94Å; V99-Y127 HydrophobicContact CB-CE2 4.37Å; V99-Y127 HydrophobicContact CB-CG 4.04Å; V99-Y127 HydrophobicContact CG1-CD1 4.05Å; V99-Y127 HydrophobicContact CG1-CD2 3.5Å; V99-Y127 VanDerWaalsContact CG1-CD2 3.5Å; V99-Y127 HydrophobicContact CG1-CE1 4.12Å; V99-Y127 HydrophobicContact CG1-CE2 3.63Å; V99-Y127 HydrophobicContact CG1-CG 3.74Å; V99-Y127 HydrophobicContact CG2-CD1 4.12Å; V99-Y127 HydrophobicContact CG2-CE1 3.66Å; V99-Y127 HydrophobicContact CG2-CE2 4.4Å; M123-Y127 HydrophobicContact CE-CE2 3.67Å; M123-Y127 HydrophobicContact CG-CD2 3.86Å; M123-Y127 HydrophobicContact CG-CE2 3.68Å; M123-Y127 VanDerWaalsContact O-CD2 3.27Å; M123-Y127 WeakPolarHBondContact O-CD2 3.4Å; M123-Y127 PolarHBondContact O-N 3.46Å; K124-Y127 PolarHBondContact O-N 3.25Å; G125-Y127 PolarHBondContact O-N 3.01Å; Y127-R129 VanDerWaalsContact C-N 3.32Å; Y127-Y130 AromaticContact CD1-CD2 3.99Å; Y127-Y130 HydrophobicContact CD1-CD2 3.99Å; Y127-Y130 HydrophobicContact CD1-CE2 4.42Å; Y127-Y130 HydrophobicContact CD2-CE2 4.47Å; Y127-Y130 HydrophobicContact CE1-CD2 4.27Å; Y127-Y130 HydrophobicContact CE1-CE2 4.41Å; Y127-Y130 HydrophobicContact CE2-CE2 4.41Å; Y127-Y130 HydrophobicContact CG-CD2 4.22Å; Y127-Y130 HydrophobicContact CG-CE2 4.47Å; Y127-Y130 PolarHBondContact O-N 3.17Å; Y127-L131 WeakPolarHBondContact O-CG 3.41Å; Y127-L131 PolarHBondContact O-N 3.08Å
128Y98.7Very high96.3Very high44 Ų4427.9 Ų27.917%0.17316%0.156CC..Hα-helixtrans-65.7-36.4168-79.3-61.2000112.2L100 K124 G125 Y130 L131 A132 I143L100-Y128 HydrophobicContact CD1-CD1 3.92Å; L100-Y128 HydrophobicContact CD1-CE1 3.66Å; L100-Y128 HydrophobicContact CD1-CE2 4.33Å; L100-Y128 HydrophobicContact CD1-CG 4.37Å; L100-Y128 HydrophobicContact CD2-CD2 3.79Å; L100-Y128 HydrophobicContact CD2-CE1 4.43Å; L100-Y128 HydrophobicContact CD2-CE2 3.62Å; L100-Y128 HydrophobicContact CD2-CG 4.25Å; K124-Y128 HydrophobicContact CD-CE2 4.35Å; K124-Y128 HydrophobicContact CG-CD2 3.94Å; K124-Y128 HydrophobicContact CG-CE2 3.75Å; K124-Y128 VanDerWaalsContact O-CD2 3.29Å; K124-Y128 WeakPolarHBondContact O-CD2 3.33Å; K124-Y128 PolarHBondContact O-N 3.11Å; K124-Y128 VanDerWaalsContact O-N 3.08Å; G125-Y128 PolarHBondContact O-N 3.38Å; Y128-Y130 VanDerWaalsContact C-N 3.33Å; Y128-Y130 PolarHBondContact O-N 3.45Å; Y128-L131 HydrophobicContact CD1-CD1 4.13Å; Y128-L131 WeakPolarHBondContact O-CB 3.42Å; Y128-L131 PolarHBondContact O-N 3.34Å; Y128-A132 WeakPolarHBondContact O-CB 3.37Å; Y128-A132 PolarHBondContact O-N 3.44Å; Y128-I143 HydrophobicContact CD1-CG2 4.18Å; Y128-I143 WeakPolarHBondContact O-CG2 3.48Å
129R98.4Very high95.9Very high17 Ų1731.2 Ų31.26%0.06417%0.173CC..Hα-helixtrans-61-42.4174-176.3176.655.8101.1-8.8111.6G125 D126 Y127 A132 E133 Y151 F179 I183G125-R129 VanDerWaalsContact O-CB 3.31Å; G125-R129 WeakPolarHBondContact O-CB 3.47Å; G125-R129 PolarHBondContact O-N 3.2Å; D126-R129 WeakPolarHBondContact O-CB 3.28Å; D126-R129 PolarHBondContact O-N 3.08Å; D126-R129 IonicContact OD1-CZ 3.62Å; D126-R129 IonicContact OD1-NE 3.99Å; D126-R129 IonicContact OD1-NH2 2.97Å; D126-R129 PolarHBondContact OD1-NH2 3.46Å; Y127-R129 VanDerWaalsContact C-N 3.32Å; R129-A132 PolarHBondContact O-N 3.14Å; R129-E133 PolarHBondContact O-N 3.16Å; R129-E133 VanDerWaalsContact O-N 3.12Å; R129-Y151 PolarHBondContact NE-OH 2.64Å; R129-F179 HydrophobicContact CB-CD2 4.39Å; R129-F179 HydrophobicContact CG-CD2 4.19Å; R129-I183 HydrophobicContact CG-CG1 3.67Å
130Y98.4Very high95.7Very high22 Ų2234 Ų349%0.08619%0.186CC..Hα-helixtrans-65-37.9175-54.2-29.5000112.4V52 R56 D126 Y127 Y128 E133V52-Y130 HydrophobicContact CG1-CD2 3.9Å; V52-Y130 HydrophobicContact CG1-CE2 3.71Å; V52-Y130 HydrophobicContact CG2-CD2 3.81Å; V52-Y130 HydrophobicContact CG2-CE2 4.48Å; V52-Y130 HydrophobicContact CG2-CG 4.36Å; R56-Y130 VanDerWaalsContact NE-CD1 3.35Å; D126-Y130 HydrophobicContact CB-CE2 4.21Å; D126-Y130 WeakPolarHBondContact O-CD1 3.49Å; D126-Y130 VanDerWaalsContact O-CD2 3.23Å; D126-Y130 WeakPolarHBondContact O-CD2 3.34Å; D126-Y130 PolarHBondContact O-N 2.86Å; Y127-Y130 AromaticContact CD1-CD2 3.99Å; Y127-Y130 HydrophobicContact CD1-CD2 3.99Å; Y127-Y130 HydrophobicContact CD1-CE2 4.42Å; Y127-Y130 HydrophobicContact CD2-CE2 4.47Å; Y127-Y130 HydrophobicContact CE1-CD2 4.27Å; Y127-Y130 HydrophobicContact CE1-CE2 4.41Å; Y127-Y130 HydrophobicContact CE2-CE2 4.41Å; Y127-Y130 HydrophobicContact CG-CD2 4.22Å; Y127-Y130 HydrophobicContact CG-CE2 4.47Å; Y127-Y130 PolarHBondContact O-N 3.17Å; Y128-Y130 VanDerWaalsContact C-N 3.33Å; Y128-Y130 PolarHBondContact O-N 3.45Å; Y130-E133 WeakPolarHBondContact O-CB 3.47Å
131L98Very high95.5Very high11 Ų1141.1 Ų41.16%0.05822%0.216CC..Hα-helixtrans-64.1-41.2171.6-73.4175.3000111.8R93 C96 L100 Y127 Y128 E133 V134 A135 I143R93-L131 HydrophobicContact CB-CD2 4.16Å; R93-L131 HydrophobicContact CG-CD2 3.8Å; C96-L131 HydrophobicContact CB-CD1 3.92Å; C96-L131 HydrophobicContact CB-CD2 3.59Å; C96-L131 HydrophobicContact CB-CG 3.56Å; L100-L131 HydrophobicContact CD1-CD1 3.63Å; Y127-L131 WeakPolarHBondContact O-CG 3.41Å; Y127-L131 PolarHBondContact O-N 3.08Å; Y128-L131 HydrophobicContact CD1-CD1 4.13Å; Y128-L131 WeakPolarHBondContact O-CB 3.42Å; Y128-L131 PolarHBondContact O-N 3.34Å; L131-E133 VanDerWaalsContact C-N 3.26Å; L131-E133 PolarHBondContact O-N 3.34Å; L131-V134 WeakPolarHBondContact O-CG2 3.4Å; L131-V134 PolarHBondContact O-N 3.16Å; L131-A135 VanDerWaalsContact O-CB 3.24Å; L131-A135 WeakPolarHBondContact O-CB 3.34Å; L131-A135 PolarHBondContact O-N 3.22Å; L131-I143 HydrophobicContact CB-CD1 4.37Å; L131-I143 HydrophobicContact CB-CG2 3.66Å
132A97.2Very high95.3Very high0 Ų048.8 Ų48.80%025%0.245CC..Hα-helixtrans-65-31.4-178.500000112.7Y128 R129 V134 K140 I143 I144 I183Y128-A132 WeakPolarHBondContact O-CB 3.37Å; Y128-A132 PolarHBondContact O-N 3.44Å; R129-A132 PolarHBondContact O-N 3.14Å; A132-V134 VanDerWaalsContact C-N 3.31Å; A132-V134 PolarHBondContact O-N 3.2Å; A132-K140 WeakPolarHBondContact O-CE 3.37Å; A132-I143 HydrophobicContact CB-CG2 3.81Å; A132-I144 HydrophobicContact CB-CG1 3.96Å; A132-I183 HydrophobicContact CB-CG2 3.6Å
133E96Very high95.3Very high36 Ų3648 Ų4817%0.16824%0.243CC..Hα-helixtrans-60.8-39.3176.2-178.6172.2-157.400112.1R56 W59 R60 R129 Y130 L131 I183R56-E133 IonicContact CZ-OE2 2.64Å; R56-E133 IonicContact NE-OE2 3.4Å; R56-E133 PolarHBondContact NE-OE2 3.15Å; R56-E133 IonicContact NH2-OE1 3.36Å; R56-E133 IonicContact NH2-OE2 2.8Å; R56-E133 PolarHBondContact NH2-OE2 3.38Å; W59-E133 HydrophobicContact CZ3-CG 4.07Å; R60-E133 IonicContact CZ-OE1 3.68Å; R60-E133 IonicContact NE-OE1 3.63Å; R60-E133 PolarHBondContact NE-OE1 3.4Å; R60-E133 IonicContact NH2-OE1 3.55Å; R60-E133 PolarHBondContact NH2-OE1 3.41Å; R60-E133 IonicContact NH2-OE2 3.79Å; R129-E133 PolarHBondContact O-N 3.16Å; R129-E133 VanDerWaalsContact O-N 3.12Å; Y130-E133 WeakPolarHBondContact O-CB 3.47Å; L131-E133 VanDerWaalsContact C-N 3.26Å; L131-E133 PolarHBondContact O-N 3.34Å; E133-I183 HydrophobicContact CB-CD1 4.31Å
134V95.1Very high95.3Very high3 Ų349 Ų492%0.01825%0.248CC..Hα-helixtrans-100.1-11.5-178.2-53.40000113.7W59 E89 L92 R93 L131 A132W59-V134 HydrophobicContact CD2-CG1 3.64Å; W59-V134 HydrophobicContact CE3-CG1 4.04Å; W59-V134 HydrophobicContact CG-CG1 4.02Å; W59-V134 HydrophobicContact CH2-CG1 4.26Å; W59-V134 HydrophobicContact CZ2-CB 4.08Å; W59-V134 HydrophobicContact CZ2-CG1 3.88Å; W59-V134 HydrophobicContact CZ3-CG1 4.34Å; E89-V134 HydrophobicContact CG-CB 3.95Å; E89-V134 HydrophobicContact CG-CG2 3.93Å; L92-V134 HydrophobicContact CD1-CG1 3.86Å; L92-V134 HydrophobicContact CD2-CG1 4.5Å; L92-V134 HydrophobicContact CD2-CG2 4.07Å; R93-V134 HydrophobicContact CG-CG2 4.44Å; L131-V134 WeakPolarHBondContact O-CG2 3.4Å; L131-V134 PolarHBondContact O-N 3.16Å; A132-V134 VanDerWaalsContact C-N 3.31Å; A132-V134 PolarHBondContact O-N 3.2Å
135A93.9Very high95.2Very high4 Ų450.5 Ų50.53%0.03326%0.258CS..  trans-69.6139.5-177.200000112.7L131 K140 I143L131-A135 VanDerWaalsContact O-CB 3.24Å; L131-A135 WeakPolarHBondContact O-CB 3.34Å; L131-A135 PolarHBondContact O-N 3.22Å; A135-K140 HydrophobicContact CB-CB 4.05Å; A135-K140 HydrophobicContact CB-CG 4.21Å; A135-K140 WeakPolarHBondContact O-CD 3.43Å; A135-I143 HydrophobicContact CB-CD1 3.63Å
136T87.7Confident95.2Very high105 Ų10552.5 Ų52.564%0.64427%0.272SS*.  trans-121.9156.4174.657.90000110.9
137G88.9Confident95.2Very high61 Ų6152.2 Ų52.263%0.62927%0.27SS*.THydrogen-bonded Turntrans67.7-153174.800000114.5D139 K140G137-D139 PolarHBondContact O-N 2.78Å; G137-K140 WeakPolarHBondContact O-CB 3.28Å; G137-K140 PolarHBondContact O-N 3.45Å
138D84.2Confident95.2Very high152 Ų15256 Ų5681%0.81328%0.284SS*.THydrogen-bonded Turntrans-65.8-24.5-169-65.2-22.9000113.9K140D138-K140 VanDerWaalsContact C-N 3.28Å; D138-K140 PolarHBondContact O-N 3.29Å
139D88.8Confident95.2Very high69 Ų6957.4 Ų57.437%0.36930%0.301SS..Hα-helixtrans-69.4-27.7179.8-71.8-10.5000112.5G137 K141 R142 I143G137-D139 PolarHBondContact O-N 2.78Å; D139-K141 VanDerWaalsContact C-N 3.32Å; D139-K141 PolarHBondContact O-N 2.66Å; D139-R142 PolarHBondContact O-N 3.25Å; D139-R142 IonicContact OD1-CZ 3.6Å; D139-R142 IonicContact OD1-NE 2.77Å; D139-R142 IonicContact OD1-NH2 2.76Å; D139-R142 PolarHBondContact OD1-NH2 2.99Å; D139-I143 HydrophobicContact CB-CD1 4.36Å; D139-I143 WeakPolarHBondContact O-CG1 3.15Å; D139-I143 PolarHBondContact O-N 2.99Å; D139-I143 VanDerWaalsContact O-N 3.08Å
140K94Very high95.2Very high85 Ų8556.8 Ų56.837%0.3730%0.299SS..Hα-helixtrans-57.2-44.8-176.3-172.9173-170.11620111.8A132 A135 G137 D138 R142 I143 I144A132-K140 WeakPolarHBondContact O-CE 3.37Å; A135-K140 HydrophobicContact CB-CB 4.05Å; A135-K140 HydrophobicContact CB-CG 4.21Å; A135-K140 WeakPolarHBondContact O-CD 3.43Å; G137-K140 WeakPolarHBondContact O-CB 3.28Å; G137-K140 PolarHBondContact O-N 3.45Å; D138-K140 VanDerWaalsContact C-N 3.28Å; D138-K140 PolarHBondContact O-N 3.29Å; K140-R142 PolarHBondContact O-N 3.05Å; K140-I143 PolarHBondContact O-N 3.07Å; K140-I144 HydrophobicContact CG-CD1 3.89Å; K140-I144 HydrophobicContact CG-CG1 4.41Å; K140-I144 VanDerWaalsContact O-CG1 3.27Å; K140-I144 WeakPolarHBondContact O-CG1 3.48Å; K140-I144 PolarHBondContact O-N 3.48Å
141K94.8Very high95.2Very high151 Ų15155.7 Ų55.766%0.65730%0.295SS*.Hα-helixtrans-61.6-44.9-179.9-174.8176179.4178.90111.9D139 I143 I144 D145D139-K141 VanDerWaalsContact C-N 3.32Å; D139-K141 PolarHBondContact O-N 2.66Å; K141-I143 VanDerWaalsContact C-N 3.3Å; K141-I143 PolarHBondContact O-N 3.12Å; K141-I144 PolarHBondContact O-N 3.31Å; K141-D145 PolarHBondContact O-N 2.91Å
142R96Very high95.2Very high163 Ų16359.1 Ų59.162%0.61531%0.31SS*.Hα-helixtrans-62.4-39.2179.2-62.5-168.7-68.4144.7-5.9111.9D139 K140 S146D139-R142 PolarHBondContact O-N 3.25Å; D139-R142 IonicContact OD1-CZ 3.6Å; D139-R142 IonicContact OD1-NE 2.77Å; D139-R142 IonicContact OD1-NH2 2.76Å; D139-R142 PolarHBondContact OD1-NH2 2.99Å; K140-R142 PolarHBondContact O-N 3.05Å; R142-S146 WeakPolarHBondContact O-CB 3.29Å; R142-S146 PolarHBondContact O-N 3.35Å; R142-S146 PolarHBondContact O-OG 3.28Å
143I97.7Very high95.3Very high24 Ų2463.5 Ų63.512%0.12333%0.331CS..Hα-helixtrans-67.1-44.3177.4-65.5165.6000110.5Y128 L131 A132 A135 D139 K140 K141 S146 A147Y128-I143 HydrophobicContact CD1-CG2 4.18Å; Y128-I143 WeakPolarHBondContact O-CG2 3.48Å; L131-I143 HydrophobicContact CB-CD1 4.37Å; L131-I143 HydrophobicContact CB-CG2 3.66Å; A132-I143 HydrophobicContact CB-CG2 3.81Å; A135-I143 HydrophobicContact CB-CD1 3.63Å; D139-I143 HydrophobicContact CB-CD1 4.36Å; D139-I143 WeakPolarHBondContact O-CG1 3.15Å; D139-I143 PolarHBondContact O-N 2.99Å; D139-I143 VanDerWaalsContact O-N 3.08Å; K140-I143 PolarHBondContact O-N 3.07Å; K141-I143 VanDerWaalsContact C-N 3.3Å; K141-I143 PolarHBondContact O-N 3.12Å; I143-S146 PolarHBondContact O-N 3.3Å; I143-A147 PolarHBondContact O-N 3.35Å
144I97.7Very high95.4Very high28 Ų2861.8 Ų61.814%0.14432%0.323CS..Hα-helixtrans-60.2-46.6176-68.9174.1000110.9A132 K140 K141 S146 A147 R148 F179 I183A132-I144 HydrophobicContact CB-CG1 3.96Å; K140-I144 HydrophobicContact CG-CD1 3.89Å; K140-I144 HydrophobicContact CG-CG1 4.41Å; K140-I144 VanDerWaalsContact O-CG1 3.27Å; K140-I144 WeakPolarHBondContact O-CG1 3.48Å; K140-I144 PolarHBondContact O-N 3.48Å; K141-I144 PolarHBondContact O-N 3.31Å; I144-S146 VanDerWaalsContact C-N 3.28Å; I144-S146 PolarHBondContact O-N 3.36Å; I144-A147 PolarHBondContact O-N 2.98Å; I144-R148 WeakPolarHBondContact O-CB 3.47Å; I144-R148 PolarHBondContact O-N 3.03Å; I144-F179 HydrophobicContact CG2-CE2 4.25Å; I144-F179 HydrophobicContact CG2-CZ 3.85Å; I144-I183 HydrophobicContact CD1-CG2 4.11Å; I144-I183 HydrophobicContact CG1-CG2 3.72Å
145D97.5Very high95.6Very high72 Ų7261.9 Ų61.939%0.38532%0.323SS..Hα-helixtrans-63.2-36.8178.5-70.5-25.5000111.4K141 R148 S149K141-D145 PolarHBondContact O-N 2.91Å; D145-R148 PolarHBondContact O-N 3.13Å; D145-R148 IonicContact OD1-NH1 3.22Å; D145-S149 WeakPolarHBondContact O-CB 3.39Å; D145-S149 PolarHBondContact O-N 3.16Å
146S98.3Very high95.8Very high43 Ų4366.1 Ų66.130%0.30135%0.346SS..Hα-helixtrans-67.3-42.4175.7-57.70000112.4R142 I143 I144 S149 A150R142-S146 WeakPolarHBondContact O-CB 3.29Å; R142-S146 PolarHBondContact O-N 3.35Å; R142-S146 PolarHBondContact O-OG 3.28Å; I143-S146 PolarHBondContact O-N 3.3Å; I144-S146 VanDerWaalsContact C-N 3.28Å; I144-S146 PolarHBondContact O-N 3.36Å; S146-S149 PolarHBondContact O-N 2.84Å; S146-A150 PolarHBondContact O-N 2.69Å; S146-A150 VanDerWaalsContact O-N 3.08Å
147A98.6Very high96.3Very high0 Ų062.3 Ų62.30%032%0.321CS..Hα-helixtrans-59.5-50.5173.400000110.9I143 I144 S149 A150 Y151 F179I143-A147 PolarHBondContact O-N 3.35Å; I144-A147 PolarHBondContact O-N 2.98Å; A147-S149 VanDerWaalsContact C-N 3.34Å; A147-S149 PolarHBondContact O-N 3.04Å; A147-A150 PolarHBondContact O-N 3.25Å; A147-Y151 WeakPolarHBondContact O-CD2 3.16Å; A147-Y151 PolarHBondContact O-N 2.91Å; A147-F179 HydrophobicContact CB-CD2 3.96Å; A147-F179 HydrophobicContact CB-CE2 3.48Å; A147-F179 VanDerWaalsContact CB-CE2 3.48Å; A147-F179 HydrophobicContact CB-CZ 4.09Å
148R98.6Very high96.7Very high86 Ų8659.4 Ų59.433%0.32529%0.291SS..Hα-helixtrans-58.2-45.9178.8-176.5-179.4-76.3146.3-9.8111.5I144 D145 A150 Y151 Q152 F179I144-R148 WeakPolarHBondContact O-CB 3.47Å; I144-R148 PolarHBondContact O-N 3.03Å; D145-R148 PolarHBondContact O-N 3.13Å; D145-R148 IonicContact OD1-NH1 3.22Å; R148-A150 PolarHBondContact O-N 2.88Å; R148-Y151 PolarHBondContact O-N 3.37Å; R148-Q152 VanDerWaalsContact O-CB 3.31Å; R148-Q152 WeakPolarHBondContact O-CB 3.14Å; R148-Q152 PolarHBondContact O-N 3.08Å; R148-F179 HydrophobicContact CB-CE1 3.89Å; R148-F179 HydrophobicContact CB-CZ 3.89Å; R148-F179 HydrophobicContact CG-CE1 4.37Å
149S98.7Very high97.4Very high73 Ų7357.5 Ų57.551%0.5128%0.275SS..Hα-helixtrans-59.7-46.3178.7-172.40000111.8D145 S146 A147 Q152 E153D145-S149 WeakPolarHBondContact O-CB 3.39Å; D145-S149 PolarHBondContact O-N 3.16Å; S146-S149 PolarHBondContact O-N 2.84Å; A147-S149 VanDerWaalsContact C-N 3.34Å; A147-S149 PolarHBondContact O-N 3.04Å; S149-Q152 PolarHBondContact O-N 2.96Å; S149-E153 WeakPolarHBondContact O-CB 3.25Å; S149-E153 PolarHBondContact O-N 3.4Å
150A98.8Very high97.8Very high4 Ų462.4 Ų62.43%0.03329%0.293CS..Hα-helixtrans-65.1-42.9-179.500000112.2K124 S146 A147 R148 A154K124-A150 HydrophobicContact CB-CB 4.06Å; K124-A150 HydrophobicContact CD-CB 4.21Å; K124-A150 HydrophobicContact CG-CB 3.95Å; S146-A150 PolarHBondContact O-N 2.69Å; S146-A150 VanDerWaalsContact O-N 3.08Å; A147-A150 PolarHBondContact O-N 3.25Å; R148-A150 PolarHBondContact O-N 2.88Å; A150-A154 WeakPolarHBondContact O-CB 3.45Å; A150-A154 PolarHBondContact O-N 3.08Å; A150-A154 VanDerWaalsContact O-N 3.11Å
151Y98.8Very high97.9Very high0 Ų062.9 Ų62.90%030%0.297CS..Hα-helixtrans-66.1-42.6175.7-74.2-55.2000112.6D126 R129 A147 R148 A154 M155 L172 N175 F176 F179D126-Y151 VanDerWaalsContact CA-OH 3.27Å; D126-Y151 WeakPolarHBondContact CA-OH 3Å; D126-Y151 PolarHBondContact N-OH 2.95Å; D126-Y151 PolarHBondContact OD1-OH 3.4Å; R129-Y151 PolarHBondContact NE-OH 2.64Å; A147-Y151 WeakPolarHBondContact O-CD2 3.16Å; A147-Y151 PolarHBondContact O-N 2.91Å; R148-Y151 PolarHBondContact O-N 3.37Å; Y151-A154 WeakPolarHBondContact O-CB 3.29Å; Y151-A154 PolarHBondContact O-N 3.28Å; Y151-M155 WeakPolarHBondContact O-CG 3.18Å; Y151-M155 PolarHBondContact O-N 3.46Å; Y151-L172 HydrophobicContact CD1-CD1 3.67Å; Y151-L172 HydrophobicContact CE1-CD1 4.38Å; Y151-N175 HydrophobicContact CE1-CB 4.17Å; Y151-F176 VanDerWaalsContact CB-CE2 3.42Å; Y151-F176 HydrophobicContact CD1-CB 4.02Å; Y151-F176 HydrophobicContact CD1-CD2 4.35Å; Y151-F176 HydrophobicContact CD1-CG 4.29Å; Y151-F176 AromaticContact CD2-CD2 3.47Å; Y151-F176 HydrophobicContact CD2-CD2 3.47Å; Y151-F176 VanDerWaalsContact CD2-CD2 3.47Å; Y151-F176 AromaticContact CD2-CE2 3.91Å; Y151-F176 HydrophobicContact CD2-CE2 3.91Å; Y151-F176 HydrophobicContact CD2-CG 4.22Å; Y151-F176 HydrophobicContact CE2-CD2 4.31Å; Y151-F176 HydrophobicContact CG-CB 4.02Å; Y151-F176 AromaticContact CG-CD2 3.48Å; Y151-F176 HydrophobicContact CG-CD2 3.48Å; Y151-F176 VanDerWaalsContact CG-CD2 3.48Å; Y151-F176 AromaticContact CG-CE2 3.99Å; Y151-F176 HydrophobicContact CG-CE2 3.99Å; Y151-F176 AromaticContact CG-CG 3.79Å; Y151-F176 HydrophobicContact CG-CG 3.79Å; Y151-F179 HydrophobicContact CD2-CB 4.19Å; Y151-F179 HydrophobicContact CD2-CD1 4.35Å; Y151-F179 HydrophobicContact CD2-CG 4.09Å; Y151-F179 HydrophobicContact CE2-CB 3.71Å; Y151-F179 HydrophobicContact CE2-CD2 4.14Å; Y151-F179 AromaticContact CE2-CG 3.9Å; Y151-F179 HydrophobicContact CE2-CG 3.9Å
152Q98.6Very high98Very high82 Ų8256.4 Ų56.438%0.38327%0.269SS..Hα-helixtrans-63.7-43.9179.4-172.960.75400111.5R148 S149 A154 M155 D156R148-Q152 VanDerWaalsContact O-CB 3.31Å; R148-Q152 WeakPolarHBondContact O-CB 3.14Å; R148-Q152 PolarHBondContact O-N 3.08Å; S149-Q152 PolarHBondContact O-N 2.96Å; Q152-A154 VanDerWaalsContact C-N 3.31Å; Q152-A154 PolarHBondContact O-N 3.21Å; Q152-M155 WeakPolarHBondContact O-CB 3.35Å; Q152-M155 PolarHBondContact O-N 3.45Å; Q152-M155 VanDerWaalsContact O-N 3.09Å; Q152-D156 PolarHBondContact NE2-OD1 3.28Å; Q152-D156 VanDerWaalsContact O-CG 3.24Å; Q152-D156 PolarHBondContact O-N 3.28Å
153E98.5Very high98Very high93 Ų9352 Ų5244%0.43526%0.261SS..Hα-helixtrans-59.5-43175.2-170-178.1169.100111.3L121 S149 M155 D156 I157L121-E153 HydrophobicContact CD1-CB 4.26Å; L121-E153 HydrophobicContact CD1-CG 3.79Å; L121-E153 HydrophobicContact CD2-CB 4.5Å; L121-E153 HydrophobicContact CD2-CG 4.36Å; S149-E153 WeakPolarHBondContact O-CB 3.25Å; S149-E153 PolarHBondContact O-N 3.4Å; E153-M155 VanDerWaalsContact C-N 3.34Å; E153-M155 PolarHBondContact O-N 2.9Å; E153-D156 PolarHBondContact O-N 3.48Å; E153-I157 HydrophobicContact CG-CD1 4.43Å; E153-I157 WeakPolarHBondContact O-CG1 3.45Å; E153-I157 PolarHBondContact O-N 2.94Å
154A98.7Very high98Very high0 Ų051.9 Ų51.90%026%0.262CS..Hα-helixtrans-63.2-38.6174.100000112.4V118 L121 A150 Y151 Q152 S158 L172V118-A154 HydrophobicContact CG1-CB 4.42Å; L121-A154 HydrophobicContact CB-CB 3.7Å; A150-A154 WeakPolarHBondContact O-CB 3.45Å; A150-A154 PolarHBondContact O-N 3.08Å; A150-A154 VanDerWaalsContact O-N 3.11Å; Y151-A154 WeakPolarHBondContact O-CB 3.29Å; Y151-A154 PolarHBondContact O-N 3.28Å; Q152-A154 VanDerWaalsContact C-N 3.31Å; Q152-A154 PolarHBondContact O-N 3.21Å; A154-S158 VanDerWaalsContact O-CB 3.24Å; A154-S158 WeakPolarHBondContact O-CB 3.46Å; A154-S158 PolarHBondContact O-N 2.8Å; A154-S158 PolarHBondContact O-OG 2.82Å; A154-L172 VanDerWaalsContact C-CD2 3.41Å; A154-L172 HydrophobicContact CB-CD1 3.71Å; A154-L172 HydrophobicContact CB-CD2 3.55Å; A154-L172 HydrophobicContact CB-CG 4.29Å; A154-L172 WeakPolarHBondContact O-CD2 3.34Å
155M98.5Very high97.9Very high5 Ų550.8 Ų50.83%0.02526%0.257CS..Hα-helixtrans-66.6-40.7178.9-76.6-59.8-57.400111.3Y151 Q152 E153 S158 K159 L172 F176 L193Y151-M155 WeakPolarHBondContact O-CG 3.18Å; Y151-M155 PolarHBondContact O-N 3.46Å; Q152-M155 WeakPolarHBondContact O-CB 3.35Å; Q152-M155 PolarHBondContact O-N 3.45Å; Q152-M155 VanDerWaalsContact O-N 3.09Å; E153-M155 VanDerWaalsContact C-N 3.34Å; E153-M155 PolarHBondContact O-N 2.9Å; M155-S158 WeakPolarHBondContact CA-OG 3.31Å; M155-S158 PolarHBondContact O-N 2.85Å; M155-S158 PolarHBondContact O-OG 3.46Å; M155-S158 VanDerWaalsContact O-OG 3.12Å; M155-K159 HydrophobicContact CE-CD 4.31Å; M155-K159 HydrophobicContact CE-CG 4.37Å; M155-K159 WeakPolarHBondContact O-CB 3.44Å; M155-K159 WeakPolarHBondContact O-CG 3.25Å; M155-K159 PolarHBondContact O-N 2.93Å; M155-L172 HydrophobicContact CB-CD2 4.48Å; M155-L172 HydrophobicContact CG-CD2 3.96Å; M155-L172 HydrophobicContact CG-CG 4.27Å; M155-L172 HydrophobicContact SD-CD1 4.5Å; M155-L172 HydrophobicContact SD-CD2 3.47Å; M155-L172 WeakPolarHBondContact SD-CD2 3.38Å; M155-L172 HydrophobicContact SD-CG 3.6Å; M155-F176 HydrophobicContact CG-CD1 3.6Å; M155-F176 HydrophobicContact CG-CE1 3.87Å; M155-F176 HydrophobicContact SD-CD1 4.34Å; M155-L193 HydrophobicContact CE-CD1 3.85Å
156D98.3Very high97.8Very high93 Ų9348.7 Ų48.750%0.49725%0.246SC..Hα-helixtrans-65.3-43.2180-66.9-15.2000111.5Q152 E153 K160Q152-D156 PolarHBondContact NE2-OD1 3.28Å; Q152-D156 VanDerWaalsContact O-CG 3.24Å; Q152-D156 PolarHBondContact O-N 3.28Å; E153-D156 PolarHBondContact O-N 3.48Å; D156-K160 WeakPolarHBondContact O-CB 3.11Å; D156-K160 PolarHBondContact O-N 2.93Å
157I98.4Very high97.7Very high25 Ų2547.9 Ų47.913%0.12824%0.24CC..Hα-helixtrans-67-49.2175.7-61.5167.2000110.4A114 R117 V118 L121 E153 K159 K160 E161A114-I157 HydrophobicContact CB-CG2 4.24Å; R117-I157 HydrophobicContact CB-CD1 4.47Å; V118-I157 HydrophobicContact CG2-CB 3.82Å; V118-I157 HydrophobicContact CG2-CG2 3.6Å; L121-I157 HydrophobicContact CD1-CD1 3.71Å; E153-I157 HydrophobicContact CG-CD1 4.43Å; E153-I157 WeakPolarHBondContact O-CG1 3.45Å; E153-I157 PolarHBondContact O-N 2.94Å; I157-K159 PolarHBondContact O-N 3.24Å; I157-K160 PolarHBondContact O-N 3.01Å; I157-E161 PolarHBondContact O-N 3.27Å
158S98.1Very high97.6Very high0 Ų049.1 Ų49.10%025%0.246CC..Hα-helixtrans-65.4-38.7-175.163.30000113.3A154 M155 K160 M162A154-S158 VanDerWaalsContact O-CB 3.24Å; A154-S158 WeakPolarHBondContact O-CB 3.46Å; A154-S158 PolarHBondContact O-N 2.8Å; A154-S158 PolarHBondContact O-OG 2.82Å; M155-S158 WeakPolarHBondContact CA-OG 3.31Å; M155-S158 PolarHBondContact O-N 2.85Å; M155-S158 PolarHBondContact O-OG 3.46Å; M155-S158 VanDerWaalsContact O-OG 3.12Å; S158-K160 VanDerWaalsContact C-N 3.26Å; S158-K160 PolarHBondContact O-N 2.76Å; S158-M162 WeakPolarHBondContact O-CA 3.34Å; S158-M162 VanDerWaalsContact O-CB 3.3Å; S158-M162 WeakPolarHBondContact O-CB 3.36Å; S158-M162 PolarHBondContact O-N 3.44Å
159K97.3Very high97.6Very high111 Ų11145.9 Ų45.948%0.48323%0.234SC..Hα-helixtrans-63.5-32.8175.3-78.6179.1170.8177.30112.8M155 I157M155-K159 HydrophobicContact CE-CD 4.31Å; M155-K159 HydrophobicContact CE-CG 4.37Å; M155-K159 WeakPolarHBondContact O-CB 3.44Å; M155-K159 WeakPolarHBondContact O-CG 3.25Å; M155-K159 PolarHBondContact O-N 2.93Å; I157-K159 PolarHBondContact O-N 3.24Å
160K97.3Very high97.6Very high172 Ų17242.4 Ų42.475%0.74821%0.209SC*.Hα-helixtrans-82.5-39-178.3-176.9-175.8175.4-169.90112.9D156 I157 S158D156-K160 WeakPolarHBondContact O-CB 3.11Å; D156-K160 PolarHBondContact O-N 2.93Å; I157-K160 PolarHBondContact O-N 3.01Å; S158-K160 VanDerWaalsContact C-N 3.26Å; S158-K160 PolarHBondContact O-N 2.76Å
161E97.6Very high97.5Very high96 Ų9642.7 Ų42.745%0.44921%0.213SC..Hα-helixtrans-115.5-5.7-164.9-60.4-172.9-134.900113.9A114 R117 I157A114-E161 HydrophobicContact CB-CB 3.83Å; A114-E161 HydrophobicContact CB-CG 4.46Å; A114-E161 VanDerWaalsContact CB-OE2 3.29Å; A114-E161 WeakPolarHBondContact CB-OE2 3.49Å; R117-E161 IonicContact NH2-OE1 3.69Å; R117-E161 PolarHBondContact NH2-OE1 3.49Å; R117-E161 IonicContact NH2-OE2 2.64Å; R117-E161 PolarHBondContact NH2-OE2 3.38Å; I157-E161 PolarHBondContact O-N 3.27Å
162M96.3Very high97.5Very high14 Ų1442.7 Ų42.77%0.06921%0.213CC..SBendtrans-130138.9-174.3-52.6171.667.800112E115 V118 S158 N166 I168 R169E115-M162 HydrophobicContact CG-CE 4.37Å; V118-M162 HydrophobicContact CB-SD 4.01Å; V118-M162 HydrophobicContact CG1-SD 4.07Å; V118-M162 HydrophobicContact CG2-SD 3.79Å; S158-M162 WeakPolarHBondContact O-CA 3.34Å; S158-M162 VanDerWaalsContact O-CB 3.3Å; S158-M162 WeakPolarHBondContact O-CB 3.36Å; S158-M162 PolarHBondContact O-N 3.44Å; M162-N166 HydrophobicContact CB-CB 4.32Å; M162-N166 HydrophobicContact CE-CB 4.14Å; M162-N166 WeakPolarHBondContact CE-OD1 3.48Å; M162-I168 HydrophobicContact CE-CB 3.87Å; M162-I168 HydrophobicContact CE-CG2 3.94Å; M162-R169 HydrophobicContact CB-CB 4.44Å; M162-R169 HydrophobicContact CE-CB 4.33Å; M162-R169 PolarHBondContact O-NH1 3.5Å
163P95.8Very high97.5Very high70 Ų7038.8 Ų38.846%0.45520%0.195SC..  trans-66152.5177.927.4-33.1000111.2T165 N166P163-T165 PolarHBondContact O-N 3.39Å; P163-T165 VanDerWaalsContact O-N 3.09Å; P163-N166 HydrophobicContact CG-CB 4.05Å; P163-N166 VanDerWaalsContact O-CB 3.31Å; P163-N166 WeakPolarHBondContact O-CB 3.24Å; P163-N166 PolarHBondContact O-N 2.77Å
164P96.7Very high97.6Very high22 Ų2235.2 Ų35.214%0.14318%0.179CC..THydrogen-bonded Turntrans-56.2-27.5-179.3-26.735.7000114.6L170 E200 D204P164-L170 WeakPolarHBondContact O-CD2 3.06Å; P164-E200 HydrophobicContact CB-CB 3.99Å; P164-E200 HydrophobicContact CG-CB 4.43Å; P164-D204 WeakPolarHBondContact CD-OD2 3.26Å; P164-D204 WeakPolarHBondContact CG-OD2 3.24Å
165T96.2Very high97.6Very high5 Ų536.7 Ų36.73%0.03119%0.186CC..THydrogen-bonded Turntrans-87.3-0.8-179.856.70000114P163 A201 D204 S216P163-T165 PolarHBondContact O-N 3.39Å; P163-T165 VanDerWaalsContact O-N 3.09Å; T165-A201 WeakPolarHBondContact CG2-O 3.33Å; T165-D204 HydrophobicContact CG2-CB 3.8Å; T165-D204 WeakPolarHBondContact CG2-O 3.2Å; T165-S216 WeakPolarHBondContact O-CB 3.33Å; T165-S216 PolarHBondContact O-OG 2.82Å
166N95.6Very high97.6Very high28 Ų2836.6 Ų36.615%0.1519%0.186CC..  trans-65.6129.3178.7-179.7-70000110.7M162 P163 I168 R169 L170M162-N166 HydrophobicContact CB-CB 4.32Å; M162-N166 HydrophobicContact CE-CB 4.14Å; M162-N166 WeakPolarHBondContact CE-OD1 3.48Å; P163-N166 HydrophobicContact CG-CB 4.05Å; P163-N166 VanDerWaalsContact O-CB 3.31Å; P163-N166 WeakPolarHBondContact O-CB 3.24Å; P163-N166 PolarHBondContact O-N 2.77Å; N166-I168 VanDerWaalsContact C-N 3.29Å; N166-I168 PolarHBondContact O-N 3.26Å; N166-I168 WeakPolarHBondContact OD1-CA 3.4Å; N166-I168 WeakPolarHBondContact OD1-CB 3.44Å; N166-I168 PolarHBondContact OD1-N 3Å; N166-R169 HydrophobicContact CB-CB 4.23Å; N166-R169 PolarHBondContact O-N 3.37Å; N166-R169 VanDerWaalsContact O-N 3.17Å; N166-R169 PolarHBondContact OD1-N 2.97Å; N166-L170 WeakPolarHBondContact O-CG 3.21Å; N166-L170 PolarHBondContact O-N 2.84Å
167P96.3Very high97.6Very high27 Ų2732.2 Ų32.218%0.17516%0.162CC..Hα-helixtrans-63.1-30.3-174.723.6-33.6000113.7G171 D215 S216 I219P167-G171 PolarHBondContact O-N 3.12Å; P167-D215 HydrophobicContact CB-CB 4.07Å; P167-S216 WeakPolarHBondContact CD-OG 3.49Å; P167-I219 HydrophobicContact CB-CD1 4.09Å; P167-I219 VanDerWaalsContact O-CD1 3.24Å; P167-I219 WeakPolarHBondContact O-CD1 3.46Å
168I96.9Very high97.6Very high25 Ų2531.9 Ų31.913%0.12816%0.162CC..Hα-helixtrans-73.5-40.3177.3-70.8165.1000110.9E115 V118 F119 M162 N166 G171 L172E115-I168 VanDerWaalsContact CD-CD1 3.45Å; E115-I168 HydrophobicContact CG-CD1 3.2Å; E115-I168 HydrophobicContact CG-CG1 4.46Å; E115-I168 WeakPolarHBondContact OE1-CD1 3.34Å; V118-I168 HydrophobicContact CB-CG2 4.32Å; V118-I168 HydrophobicContact CG1-CG2 3.74Å; F119-I168 HydrophobicContact CB-CG2 4.5Å; F119-I168 HydrophobicContact CD2-CD1 4.18Å; F119-I168 HydrophobicContact CD2-CG1 4.37Å; M162-I168 HydrophobicContact CE-CB 3.87Å; M162-I168 HydrophobicContact CE-CG2 3.94Å; N166-I168 VanDerWaalsContact C-N 3.29Å; N166-I168 PolarHBondContact O-N 3.26Å; N166-I168 WeakPolarHBondContact OD1-CA 3.4Å; N166-I168 WeakPolarHBondContact OD1-CB 3.44Å; N166-I168 PolarHBondContact OD1-N 3Å; I168-G171 PolarHBondContact O-N 3.49Å; I168-L172 WeakPolarHBondContact O-CB 3.45Å; I168-L172 PolarHBondContact O-N 2.94Å
169R97.8Very high97.6Very high18 Ų1831.9 Ų31.97%0.06816%0.162CC..Hα-helixtrans-63.4-45.9173.1177177.4168.1171.7-4.9111.2M162 N166 L172 A173 E200M162-R169 HydrophobicContact CB-CB 4.44Å; M162-R169 HydrophobicContact CE-CB 4.33Å; M162-R169 PolarHBondContact O-NH1 3.5Å; N166-R169 HydrophobicContact CB-CB 4.23Å; N166-R169 PolarHBondContact O-N 3.37Å; N166-R169 VanDerWaalsContact O-N 3.17Å; N166-R169 PolarHBondContact OD1-N 2.97Å; R169-L172 WeakPolarHBondContact O-CB 3.33Å; R169-L172 PolarHBondContact O-N 2.89Å; R169-A173 PolarHBondContact O-N 2.88Å; R169-A173 VanDerWaalsContact O-N 3.08Å; R169-E200 IonicContact CZ-OE2 3.51Å; R169-E200 IonicContact NH2-OE2 2.81Å; R169-E200 PolarHBondContact NH2-OE2 3.5Å
170L98.4Very high97.7Very high0 Ų027.3 Ų27.30%014%0.142CC..Hα-helixtrans-60.6-46.8175.9-71.1172.4000111.5P164 N166 L172 A173 L174 T197 A201 I219 M220 L223P164-L170 WeakPolarHBondContact O-CD2 3.06Å; N166-L170 WeakPolarHBondContact O-CG 3.21Å; N166-L170 PolarHBondContact O-N 2.84Å; L170-L172 VanDerWaalsContact C-N 3.29Å; L170-L172 PolarHBondContact O-N 3.5Å; L170-A173 PolarHBondContact O-N 3.27Å; L170-L174 PolarHBondContact O-N 3.49Å; L170-T197 HydrophobicContact CD2-CG2 3.72Å; L170-A201 HydrophobicContact CD2-CB 3.71Å; L170-I219 HydrophobicContact CB-CB 4.17Å; L170-I219 HydrophobicContact CB-CD1 4.39Å; L170-I219 HydrophobicContact CB-CG2 3.62Å; L170-M220 HydrophobicContact CD1-CG 4.01Å; L170-M220 HydrophobicContact CD1-SD 4.41Å; L170-M220 HydrophobicContact CD2-CG 4.17Å; L170-L223 HydrophobicContact CD2-CD1 4.29Å
171G98.3Very high97.7Very high10 Ų1021.9 Ų21.910%0.10312%0.117CC..Hα-helixtrans-64.7-33179.100000112.9K122 P167 I168 N175K122-G171 WeakPolarHBondContact CE-O 3.44Å; P167-G171 PolarHBondContact O-N 3.12Å; I168-G171 PolarHBondContact O-N 3.49Å; G171-N175 PolarHBondContact O-N 3.18Å; G171-N175 VanDerWaalsContact O-N 3.12Å
172L98.8Very high97.6Very high0 Ų022.3 Ų22.30%012%0.119CC..Hα-helixtrans-62.4-52.3171.1166.865000111.1V118 K122 Y151 A154 M155 I168 R169 L170 L174 N175 F176V118-L172 HydrophobicContact CG1-CD2 3.99Å; K122-L172 HydrophobicContact CB-CB 4.49Å; K122-L172 HydrophobicContact CB-CD1 3.91Å; K122-L172 HydrophobicContact CD-CB 4.05Å; K122-L172 HydrophobicContact CG-CB 4.23Å; K122-L172 HydrophobicContact CG-CD1 3.95Å; Y151-L172 HydrophobicContact CD1-CD1 3.67Å; Y151-L172 HydrophobicContact CE1-CD1 4.38Å; A154-L172 VanDerWaalsContact C-CD2 3.41Å; A154-L172 HydrophobicContact CB-CD1 3.71Å; A154-L172 HydrophobicContact CB-CD2 3.55Å; A154-L172 HydrophobicContact CB-CG 4.29Å; A154-L172 WeakPolarHBondContact O-CD2 3.34Å; M155-L172 HydrophobicContact CB-CD2 4.48Å; M155-L172 HydrophobicContact CG-CD2 3.96Å; M155-L172 HydrophobicContact CG-CG 4.27Å; M155-L172 HydrophobicContact SD-CD1 4.5Å; M155-L172 HydrophobicContact SD-CD2 3.47Å; M155-L172 WeakPolarHBondContact SD-CD2 3.38Å; M155-L172 HydrophobicContact SD-CG 3.6Å; I168-L172 WeakPolarHBondContact O-CB 3.45Å; I168-L172 PolarHBondContact O-N 2.94Å; R169-L172 WeakPolarHBondContact O-CB 3.33Å; R169-L172 PolarHBondContact O-N 2.89Å; L170-L172 VanDerWaalsContact C-N 3.29Å; L170-L172 PolarHBondContact O-N 3.5Å; L172-L174 VanDerWaalsContact C-N 3.31Å; L172-L174 PolarHBondContact O-N 2.89Å; L172-N175 PolarHBondContact O-N 3.33Å; L172-F176 WeakPolarHBondContact O-CB 3.31Å; L172-F176 PolarHBondContact O-N 3.24Å
173A98.7Very high97.7Very high0 Ų023 Ų230%012%0.122CC..Hα-helixtrans-62.5-37.8-179.700000112.6R169 L170 F176 S177 T197R169-A173 PolarHBondContact O-N 2.88Å; R169-A173 VanDerWaalsContact O-N 3.08Å; L170-A173 PolarHBondContact O-N 3.27Å; A173-F176 PolarHBondContact O-N 3.33Å; A173-S177 WeakPolarHBondContact O-CB 3.4Å; A173-S177 PolarHBondContact O-N 3.12Å; A173-S177 PolarHBondContact O-OG 3.1Å; A173-T197 HydrophobicContact CB-CG2 3.58Å; A173-T197 WeakPolarHBondContact CB-OG1 3.33Å
174L98.7Very high97.7Very high19 Ų1920.5 Ų20.510%0.09911%0.108CC..Hα-helixtrans-58.3-51.1172.4176.164.1000111L170 L172 F176 S177 V178 I219 L222 L223 N226L170-L174 PolarHBondContact O-N 3.49Å; L172-L174 VanDerWaalsContact C-N 3.31Å; L172-L174 PolarHBondContact O-N 2.89Å; L174-F176 PolarHBondContact O-N 2.91Å; L174-S177 PolarHBondContact O-OG 3.22Å; L174-V178 WeakPolarHBondContact O-CG2 3.47Å; L174-V178 PolarHBondContact O-N 3.19Å; L174-V178 VanDerWaalsContact O-N 3.17Å; L174-I219 HydrophobicContact CB-CG2 4.22Å; L174-I219 HydrophobicContact CD2-CG2 4.11Å; L174-L222 HydrophobicContact CD1-CB 4.1Å; L174-L222 HydrophobicContact CD2-CB 3.89Å; L174-L222 HydrophobicContact CD2-CD1 3.85Å; L174-L223 HydrophobicContact CB-CD2 3.97Å; L174-L223 HydrophobicContact CB-CG 4.25Å; L174-L223 HydrophobicContact CD1-CD2 3.95Å; L174-L223 HydrophobicContact CD1-CG 4.16Å; L174-N226 VanDerWaalsContact CD1-ND2 3.34Å; L174-N226 WeakPolarHBondContact CD1-ND2 3.47Å
175N98.6Very high97.7Very high30 Ų3026.1 Ų26.116%0.1614%0.137CC..Hα-helixtrans-70.6-34.8-177.4-76.813.9000112.8K122 D126 Y151 G171 L172 V178 F179K122-N175 WeakPolarHBondContact CE-ND2 3.22Å; K122-N175 PolarHBondContact NZ-ND2 3.33Å; D126-N175 WeakPolarHBondContact OD1-CB 3.46Å; D126-N175 PolarHBondContact OD1-ND2 3.43Å; D126-N175 PolarHBondContact OD2-ND2 2.93Å; Y151-N175 HydrophobicContact CE1-CB 4.17Å; G171-N175 PolarHBondContact O-N 3.18Å; G171-N175 VanDerWaalsContact O-N 3.12Å; L172-N175 PolarHBondContact O-N 3.33Å; N175-V178 PolarHBondContact O-N 2.94Å; N175-F179 PolarHBondContact O-N 2.86Å
176F98.8Very high97.7Very high4 Ų427 Ų272%0.01814%0.143CC..Hα-helixtrans-73-36178.6-168.2-160.8000111.9Y151 M155 L172 A173 L174 V178 F179 H180 L193Y151-F176 VanDerWaalsContact CB-CE2 3.42Å; Y151-F176 HydrophobicContact CD1-CB 4.02Å; Y151-F176 HydrophobicContact CD1-CD2 4.35Å; Y151-F176 HydrophobicContact CD1-CG 4.29Å; Y151-F176 AromaticContact CD2-CD2 3.47Å; Y151-F176 HydrophobicContact CD2-CD2 3.47Å; Y151-F176 VanDerWaalsContact CD2-CD2 3.47Å; Y151-F176 AromaticContact CD2-CE2 3.91Å; Y151-F176 HydrophobicContact CD2-CE2 3.91Å; Y151-F176 HydrophobicContact CD2-CG 4.22Å; Y151-F176 HydrophobicContact CE2-CD2 4.31Å; Y151-F176 HydrophobicContact CG-CB 4.02Å; Y151-F176 AromaticContact CG-CD2 3.48Å; Y151-F176 HydrophobicContact CG-CD2 3.48Å; Y151-F176 VanDerWaalsContact CG-CD2 3.48Å; Y151-F176 AromaticContact CG-CE2 3.99Å; Y151-F176 HydrophobicContact CG-CE2 3.99Å; Y151-F176 AromaticContact CG-CG 3.79Å; Y151-F176 HydrophobicContact CG-CG 3.79Å; M155-F176 HydrophobicContact CG-CD1 3.6Å; M155-F176 HydrophobicContact CG-CE1 3.87Å; M155-F176 HydrophobicContact SD-CD1 4.34Å; L172-F176 WeakPolarHBondContact O-CB 3.31Å; L172-F176 PolarHBondContact O-N 3.24Å; A173-F176 PolarHBondContact O-N 3.33Å; L174-F176 PolarHBondContact O-N 2.91Å; F176-V178 VanDerWaalsContact C-N 3.35Å; F176-V178 PolarHBondContact O-N 3.4Å; F176-F179 HydrophobicContact CD2-CB 4.18Å; F176-F179 AromaticContact CD2-CD1 3.68Å; F176-F179 HydrophobicContact CD2-CD1 3.68Å; F176-F179 HydrophobicContact CD2-CG 4.26Å; F176-F179 AromaticContact CE2-CD1 3.59Å; F176-F179 HydrophobicContact CE2-CD1 3.59Å; F176-F179 AromaticContact CE2-CE1 3.99Å; F176-F179 HydrophobicContact CE2-CE1 3.99Å; F176-F179 VanDerWaalsContact O-CB 3.3Å; F176-F179 WeakPolarHBondContact O-CB 3.47Å; F176-F179 PolarHBondContact O-N 2.86Å; F176-H180 AromaticContact CD2-CD2 3.67Å; F176-H180 AromaticContact CD2-NE2 3.6Å; F176-H180 AromaticContact CE1-NE2 3.65Å; F176-H180 AromaticContact CE2-CD2 3.72Å; F176-H180 AromaticContact CE2-CE1 3.9Å; F176-H180 AromaticContact CE2-NE2 3.18Å; F176-H180 WeakPolarHBondContact CE2-NE2 3.31Å; F176-H180 AromaticContact CZ-CE1 3.95Å; F176-H180 AromaticContact CZ-NE2 3.22Å; F176-H180 WeakPolarHBondContact CZ-NE2 3.41Å; F176-H180 PolarHBondContact O-CD2 3.46Å; F176-H180 PolarHBondContact O-N 2.95Å; F176-L193 HydrophobicContact CB-CD2 3.88Å; F176-L193 HydrophobicContact CD1-CD2 3.61Å; F176-L193 HydrophobicContact CE1-CD2 4.45Å; F176-L193 HydrophobicContact CG-CD2 3.87Å
177S98.6Very high97.8Very high0 Ų026.6 Ų26.60%014%0.142CC..Hα-helixtrans-64-40.6172.159.10000111.8A173 L174 F179 H180 Y181 A190A173-S177 WeakPolarHBondContact O-CB 3.4Å; A173-S177 PolarHBondContact O-N 3.12Å; A173-S177 PolarHBondContact O-OG 3.1Å; L174-S177 PolarHBondContact O-OG 3.22Å; S177-F179 VanDerWaalsContact C-N 3.31Å; S177-F179 PolarHBondContact O-N 3.41Å; S177-H180 PolarHBondContact O-N 2.98Å; S177-Y181 PolarHBondContact O-N 2.94Å; S177-A190 WeakPolarHBondContact CB-O 3.37Å; S177-A190 VanDerWaalsContact O-CB 3.25Å; S177-A190 WeakPolarHBondContact O-CB 3.44Å
178V98.4Very high97.8Very high19 Ų1931.2 Ų31.212%0.11516%0.162CC..Hα-helixtrans-60.5-39.9171.51730000111.6L174 N175 F176 Y181 E182 W230L174-V178 WeakPolarHBondContact O-CG2 3.47Å; L174-V178 PolarHBondContact O-N 3.19Å; L174-V178 VanDerWaalsContact O-N 3.17Å; N175-V178 PolarHBondContact O-N 2.94Å; F176-V178 VanDerWaalsContact C-N 3.35Å; F176-V178 PolarHBondContact O-N 3.4Å; V178-Y181 PolarHBondContact O-N 3.49Å; V178-E182 VanDerWaalsContact CG1-CD 3.49Å; V178-E182 HydrophobicContact CG1-CG 4.05Å; V178-E182 WeakPolarHBondContact CG1-OE2 3.29Å; V178-E182 WeakPolarHBondContact O-CB 3.32Å; V178-E182 PolarHBondContact O-N 2.96Å; V178-W230 HydrophobicContact CG2-CH2 3.99Å; V178-W230 HydrophobicContact CG2-CZ2 4.04Å
179F98.7Very high97.8Very high0 Ų034.8 Ų34.80%018%0.178CC..Hα-helixtrans-58.7-49.1172.4167.5-96.9000112.1R129 I144 A147 R148 Y151 N175 F176 S177 Y181 I183 A184R129-F179 HydrophobicContact CB-CD2 4.39Å; R129-F179 HydrophobicContact CG-CD2 4.19Å; I144-F179 HydrophobicContact CG2-CE2 4.25Å; I144-F179 HydrophobicContact CG2-CZ 3.85Å; A147-F179 HydrophobicContact CB-CD2 3.96Å; A147-F179 HydrophobicContact CB-CE2 3.48Å; A147-F179 VanDerWaalsContact CB-CE2 3.48Å; A147-F179 HydrophobicContact CB-CZ 4.09Å; R148-F179 HydrophobicContact CB-CE1 3.89Å; R148-F179 HydrophobicContact CB-CZ 3.89Å; R148-F179 HydrophobicContact CG-CE1 4.37Å; Y151-F179 HydrophobicContact CD2-CB 4.19Å; Y151-F179 HydrophobicContact CD2-CD1 4.35Å; Y151-F179 HydrophobicContact CD2-CG 4.09Å; Y151-F179 HydrophobicContact CE2-CB 3.71Å; Y151-F179 HydrophobicContact CE2-CD2 4.14Å; Y151-F179 AromaticContact CE2-CG 3.9Å; Y151-F179 HydrophobicContact CE2-CG 3.9Å; N175-F179 PolarHBondContact O-N 2.86Å; F176-F179 HydrophobicContact CD2-CB 4.18Å; F176-F179 AromaticContact CD2-CD1 3.68Å; F176-F179 HydrophobicContact CD2-CD1 3.68Å; F176-F179 HydrophobicContact CD2-CG 4.26Å; F176-F179 AromaticContact CE2-CD1 3.59Å; F176-F179 HydrophobicContact CE2-CD1 3.59Å; F176-F179 AromaticContact CE2-CE1 3.99Å; F176-F179 HydrophobicContact CE2-CE1 3.99Å; F176-F179 VanDerWaalsContact O-CB 3.3Å; F176-F179 WeakPolarHBondContact O-CB 3.47Å; F176-F179 PolarHBondContact O-N 2.86Å; S177-F179 VanDerWaalsContact C-N 3.31Å; S177-F179 PolarHBondContact O-N 3.41Å; F179-Y181 VanDerWaalsContact C-N 3.27Å; F179-Y181 PolarHBondContact O-N 2.93Å; F179-I183 HydrophobicContact CD2-CB 3.83Å; F179-I183 HydrophobicContact CD2-CG1 4.42Å; F179-I183 HydrophobicContact CD2-CG2 3.93Å; F179-I183 HydrophobicContact CE2-CB 4.04Å; F179-I183 HydrophobicContact CE2-CG2 3.64Å; F179-I183 WeakPolarHBondContact O-CA 3.17Å; F179-I183 WeakPolarHBondContact O-CB 3.44Å; F179-I183 PolarHBondContact O-N 2.67Å; F179-A184 HydrophobicContact CD1-CB 4.41Å; F179-A184 HydrophobicContact CE1-CB 3.93Å; F179-A184 HydrophobicContact CZ-CB 4.21Å; F179-A184 PolarHBondContact O-N 3.35Å
180H98.5Very high97.8Very high15 Ų1534 Ų347%0.06917%0.174CC..Hα-helixtrans-58.9-42.5179.9-78.8-76.7000111.3F176 S177 A184 N185 S186 E189 A190F176-H180 AromaticContact CD2-CD2 3.67Å; F176-H180 AromaticContact CD2-NE2 3.6Å; F176-H180 AromaticContact CE1-NE2 3.65Å; F176-H180 AromaticContact CE2-CD2 3.72Å; F176-H180 AromaticContact CE2-CE1 3.9Å; F176-H180 AromaticContact CE2-NE2 3.18Å; F176-H180 WeakPolarHBondContact CE2-NE2 3.31Å; F176-H180 AromaticContact CZ-CE1 3.95Å; F176-H180 AromaticContact CZ-NE2 3.22Å; F176-H180 WeakPolarHBondContact CZ-NE2 3.41Å; F176-H180 PolarHBondContact O-CD2 3.46Å; F176-H180 PolarHBondContact O-N 2.95Å; S177-H180 PolarHBondContact O-N 2.98Å; H180-A184 CarbonylContact O-C 3.59Å; H180-N185 PolarHBondContact O-N 3.05Å; H180-N185 VanDerWaalsContact O-N 3.16Å; H180-S186 PolarHBondContact O-N 3.46Å; H180-E189 HydrophobicContact CB-CB 4.34Å; H180-E189 IonicContact CE1-OE2 2.73Å; H180-E189 PolarHBondContact CE1-OE2 3.37Å; H180-E189 IonicContact CG-OE2 2.76Å; H180-E189 IonicContact ND1-OE2 3.08Å; H180-E189 PolarHBondContact ND1-OE2 2.86Å; H180-A190 HydrophobicContact CB-CB 3.73Å
181Y98.1Very high97.8Very high58 Ų5835.4 Ų35.423%0.22718%0.182CC..Hα-helixtrans-71.5-60.3-179.4-167.8-91.1000112.3S177 V178 F179 P187 A190 W230 D233S177-Y181 PolarHBondContact O-N 2.94Å; V178-Y181 PolarHBondContact O-N 3.49Å; F179-Y181 VanDerWaalsContact C-N 3.27Å; F179-Y181 PolarHBondContact O-N 2.93Å; Y181-P187 HydrophobicContact CD2-CB 3.86Å; Y181-P187 HydrophobicContact CE2-CB 3.91Å; Y181-A190 HydrophobicContact CD2-CB 4.37Å; Y181-W230 AromaticContact CD1-CD1 3.87Å; Y181-W230 AromaticContact CD1-CE2 3.95Å; Y181-W230 HydrophobicContact CD1-CZ2 4.46Å; Y181-W230 AromaticContact CD1-NE1 3.44Å; Y181-W230 HydrophobicContact CD2-CB 4.04Å; Y181-W230 AromaticContact CD2-CD1 3.57Å; Y181-W230 AromaticContact CD2-CD2 3.73Å; Y181-W230 HydrophobicContact CD2-CD2 3.73Å; Y181-W230 AromaticContact CD2-CE2 3.88Å; Y181-W230 HydrophobicContact CD2-CE3 4.44Å; Y181-W230 AromaticContact CD2-CG 3.53Å; Y181-W230 HydrophobicContact CD2-CG 3.53Å; Y181-W230 AromaticContact CD2-NE1 3.76Å; Y181-W230 AromaticContact CE1-CD1 3.56Å; Y181-W230 HydrophobicContact CE1-CG 4.46Å; Y181-W230 AromaticContact CE1-NE1 3.52Å; Y181-W230 HydrophobicContact CE2-CB 3.67Å; Y181-W230 AromaticContact CE2-CD1 3.25Å; Y181-W230 HydrophobicContact CE2-CD2 4.14Å; Y181-W230 AromaticContact CE2-CG 3.42Å; Y181-W230 HydrophobicContact CE2-CG 3.42Å; Y181-W230 VanDerWaalsContact CE2-CG 3.42Å; Y181-W230 AromaticContact CE2-NE1 3.86Å; Y181-W230 AromaticContact CG-CD1 3.87Å; Y181-W230 HydrophobicContact CG-CD2 4.01Å; Y181-W230 AromaticContact CG-CE2 3.66Å; Y181-W230 HydrophobicContact CG-CG 4.12Å; Y181-W230 HydrophobicContact CG-CZ2 4.13Å; Y181-W230 AromaticContact CG-NE1 3.56Å; Y181-W230 AromaticContact CZ-CD1 3.25Å; Y181-W230 AromaticContact CZ-CG 3.93Å; Y181-W230 AromaticContact CZ-NE1 3.73Å; Y181-D233 PolarHBondContact OH-OD2 3.09Å; Y181-D233 VanDerWaalsContact OH-OD2 3.07Å
182E96.2Very high97.8Very high104 Ų10438.3 Ų38.349%0.48620%0.2SC..Hα-helixtrans-80.4-30.7-168.8-63.2-177.7170.800113.8V178V178-E182 VanDerWaalsContact CG1-CD 3.49Å; V178-E182 HydrophobicContact CG1-CG 4.05Å; V178-E182 WeakPolarHBondContact CG1-OE2 3.29Å; V178-E182 WeakPolarHBondContact O-CB 3.32Å; V178-E182 PolarHBondContact O-N 2.96Å
183I97.3Very high97.8Very high28 Ų2839.5 Ų39.514%0.14421%0.207CC..THydrogen-bonded Turntrans-113.1-44.3-170.2-61.6-50.2000112.5R129 A132 E133 I144 F179 N185R129-I183 HydrophobicContact CG-CG1 3.67Å; A132-I183 HydrophobicContact CB-CG2 3.6Å; E133-I183 HydrophobicContact CB-CD1 4.31Å; I144-I183 HydrophobicContact CD1-CG2 4.11Å; I144-I183 HydrophobicContact CG1-CG2 3.72Å; F179-I183 HydrophobicContact CD2-CB 3.83Å; F179-I183 HydrophobicContact CD2-CG1 4.42Å; F179-I183 HydrophobicContact CD2-CG2 3.93Å; F179-I183 HydrophobicContact CE2-CB 4.04Å; F179-I183 HydrophobicContact CE2-CG2 3.64Å; F179-I183 WeakPolarHBondContact O-CA 3.17Å; F179-I183 WeakPolarHBondContact O-CB 3.44Å; F179-I183 PolarHBondContact O-N 2.67Å; I183-N185 VanDerWaalsContact C-N 3.31Å
184A96.4Very high97.8Very high18 Ų1839.5 Ų39.515%0.14921%0.207CC..SBendtrans-83.9-7.718000000113.3F179 H180 S186F179-A184 HydrophobicContact CD1-CB 4.41Å; F179-A184 HydrophobicContact CE1-CB 3.93Å; F179-A184 HydrophobicContact CZ-CB 4.21Å; F179-A184 PolarHBondContact O-N 3.35Å; H180-A184 CarbonylContact O-C 3.59Å; A184-S186 PolarHBondContact O-N 3.33Å; A184-S186 PolarHBondContact O-OG 3.21Å
185N95.3Very high97.7Very high140 Ų14044.1 Ų44.175%0.74923%0.226SC*.  trans49.746.8-176.9-165.169000111.9H180 I183H180-N185 PolarHBondContact O-N 3.05Å; H180-N185 VanDerWaalsContact O-N 3.16Å; I183-N185 VanDerWaalsContact C-N 3.31Å
186S97.1Very high97.7Very high23 Ų2345.7 Ų45.716%0.16124%0.237CC..  trans-128.368.8-176.4-56.40000109.3H180 A184 E188 E189 A190H180-S186 PolarHBondContact O-N 3.46Å; A184-S186 PolarHBondContact O-N 3.33Å; A184-S186 PolarHBondContact O-OG 3.21Å; S186-E188 VanDerWaalsContact C-N 3.29Å; S186-E188 PolarHBondContact O-N 3.39Å; S186-E189 PolarHBondContact O-N 3.11Å; S186-A190 PolarHBondContact O-N 3.01Å; S186-A190 VanDerWaalsContact O-N 3.1Å
187P96.9Very high97.7Very high21 Ų2145.9 Ų45.914%0.13624%0.238CC..Hα-helixtrans-62.9-32.4-172.824.7-32.8000113Y181 E189 A190 I191Y181-P187 HydrophobicContact CD2-CB 3.86Å; Y181-P187 HydrophobicContact CE2-CB 3.91Å; P187-E189 PolarHBondContact O-N 3.06Å; P187-A190 WeakPolarHBondContact O-CB 3.44Å; P187-A190 PolarHBondContact O-N 3.44Å; P187-I191 WeakPolarHBondContact O-CB 3.16Å; P187-I191 VanDerWaalsContact O-CG1 3.29Å; P187-I191 WeakPolarHBondContact O-CG1 3.29Å; P187-I191 PolarHBondContact O-N 2.87Å
188E96.7Very high97.7Very high124 Ų12447.9 Ų47.958%0.57925%0.247SC*.Hα-helixtrans-64.2-42.4177-61.670-151.200111.4S186 S192S186-E188 VanDerWaalsContact C-N 3.29Å; S186-E188 PolarHBondContact O-N 3.39Å; E188-S192 WeakPolarHBondContact O-CB 3.37Å; E188-S192 PolarHBondContact O-N 3.05Å
189E97.7Very high97.6Very high100 Ų10051 Ų5147%0.46726%0.263SS..Hα-helixtrans-65.8-40.6175.7-66.8-175.8179.700110.9H180 S186 P187 S192 L193H180-E189 HydrophobicContact CB-CB 4.34Å; H180-E189 IonicContact CE1-OE2 2.73Å; H180-E189 PolarHBondContact CE1-OE2 3.37Å; H180-E189 IonicContact CG-OE2 2.76Å; H180-E189 IonicContact ND1-OE2 3.08Å; H180-E189 PolarHBondContact ND1-OE2 2.86Å; S186-E189 PolarHBondContact O-N 3.11Å; P187-E189 PolarHBondContact O-N 3.06Å; E189-S192 PolarHBondContact O-N 3.4Å; E189-L193 VanDerWaalsContact O-CB 3.29Å; E189-L193 WeakPolarHBondContact O-CB 3.46Å; E189-L193 PolarHBondContact O-N 2.94Å
190A98.1Very high97.6Very high0 Ų054.3 Ų54.30%028%0.278CS..Hα-helixtrans-61-50.8176.900000112S177 H180 Y181 S186 P187 L193 A194 W230S177-A190 WeakPolarHBondContact CB-O 3.37Å; S177-A190 VanDerWaalsContact O-CB 3.25Å; S177-A190 WeakPolarHBondContact O-CB 3.44Å; H180-A190 HydrophobicContact CB-CB 3.73Å; Y181-A190 HydrophobicContact CD2-CB 4.37Å; S186-A190 PolarHBondContact O-N 3.01Å; S186-A190 VanDerWaalsContact O-N 3.1Å; P187-A190 WeakPolarHBondContact O-CB 3.44Å; P187-A190 PolarHBondContact O-N 3.44Å; A190-L193 PolarHBondContact O-N 3.18Å; A190-A194 WeakPolarHBondContact O-CB 3.44Å; A190-A194 PolarHBondContact O-N 2.68Å; A190-W230 HydrophobicContact CB-CE3 4.25Å; A190-W230 HydrophobicContact CB-CZ3 4.11Å
191I98.3Very high97.5Very high31 Ų3153.6 Ų53.616%0.15928%0.275CS..Hα-helixtrans-63.9-45.2179.1-68.1166.7000110.2P187 L193 A194 K195 L227 W230P187-I191 WeakPolarHBondContact O-CB 3.16Å; P187-I191 VanDerWaalsContact O-CG1 3.29Å; P187-I191 WeakPolarHBondContact O-CG1 3.29Å; P187-I191 PolarHBondContact O-N 2.87Å; I191-L193 PolarHBondContact O-N 3.41Å; I191-A194 PolarHBondContact O-N 2.99Å; I191-K195 WeakPolarHBondContact O-CB 3.36Å; I191-K195 PolarHBondContact O-N 3.43Å; I191-L227 HydrophobicContact CB-CD2 4.45Å; I191-L227 HydrophobicContact CG2-CD2 3.96Å; I191-L227 WeakPolarHBondContact O-CD2 3.34Å; I191-W230 HydrophobicContact CD1-CB 4.06Å; I191-W230 HydrophobicContact CG1-CB 3.89Å; I191-W230 HydrophobicContact CG1-CE3 4.44Å
192S98.1Very high97.4Very high70 Ų7055 Ų5549%0.4929%0.285SS..Hα-helixtrans-58.7-49.3178.1179.80000111.5E188 E189 K195 T196E188-S192 WeakPolarHBondContact O-CB 3.37Å; E188-S192 PolarHBondContact O-N 3.05Å; E189-S192 PolarHBondContact O-N 3.4Å; S192-K195 PolarHBondContact O-N 3.21Å; S192-T196 WeakPolarHBondContact O-CB 3.41Å; S192-T196 PolarHBondContact O-N 3.09Å; S192-T196 PolarHBondContact O-OG1 3.11Å
193L98.4Very high97.4Very high25 Ų2553.3 Ų53.313%0.13129%0.288CS..Hα-helixtrans-62.7-47179.8177.161000112.2M155 F176 E189 A190 I191 T197M155-L193 HydrophobicContact CE-CD1 3.85Å; F176-L193 HydrophobicContact CB-CD2 3.88Å; F176-L193 HydrophobicContact CD1-CD2 3.61Å; F176-L193 HydrophobicContact CE1-CD2 4.45Å; F176-L193 HydrophobicContact CG-CD2 3.87Å; E189-L193 VanDerWaalsContact O-CB 3.29Å; E189-L193 WeakPolarHBondContact O-CB 3.46Å; E189-L193 PolarHBondContact O-N 2.94Å; A190-L193 PolarHBondContact O-N 3.18Å; I191-L193 PolarHBondContact O-N 3.41Å; L193-T197 WeakPolarHBondContact O-CB 3.17Å; L193-T197 PolarHBondContact O-N 3.27Å; L193-T197 PolarHBondContact O-OG1 2.97Å
194A98.3Very high97.3Very high0 Ų054.8 Ų54.80%030%0.297CS..Hα-helixtrans-64-42.8-179.900000111.5A190 I191 F198 L223 L227 W230A190-A194 WeakPolarHBondContact O-CB 3.44Å; A190-A194 PolarHBondContact O-N 2.68Å; I191-A194 PolarHBondContact O-N 2.99Å; A194-F198 WeakPolarHBondContact O-CB 3.48Å; A194-F198 PolarHBondContact O-N 2.84Å; A194-L223 HydrophobicContact CB-CD2 3.95Å; A194-L227 HydrophobicContact CB-CD1 4.34Å; A194-L227 HydrophobicContact CB-CD2 3.73Å; A194-L227 HydrophobicContact CB-CG 3.85Å; A194-W230 HydrophobicContact CB-CZ3 4.34Å
195K98.1Very high97.1Very high117 Ų11755.8 Ų55.851%0.50930%0.299SS..Hα-helixtrans-65.8-51.7179.5-177.4175.2-179.7-178.90111.8I191 S192 T197 F198 D199 L227I191-K195 WeakPolarHBondContact O-CB 3.36Å; I191-K195 PolarHBondContact O-N 3.43Å; S192-K195 PolarHBondContact O-N 3.21Å; K195-T197 VanDerWaalsContact C-N 3.28Å; K195-T197 PolarHBondContact O-N 3.42Å; K195-F198 PolarHBondContact O-N 3.43Å; K195-D199 WeakPolarHBondContact O-CB 3.39Å; K195-D199 VanDerWaalsContact O-CG 3.3Å; K195-D199 PolarHBondContact O-N 3.48Å; K195-L227 HydrophobicContact CB-CD1 4.27Å; K195-L227 HydrophobicContact CB-CD2 3.97Å
196T98.3Very high96.9Very high63 Ų6356.6 Ų56.639%0.38730%0.298SS..Hα-helixtrans-57.9-43.8178.2-65.50000111.2S192 D199 E200S192-T196 WeakPolarHBondContact O-CB 3.41Å; S192-T196 PolarHBondContact O-N 3.09Å; S192-T196 PolarHBondContact O-OG1 3.11Å; T196-D199 PolarHBondContact O-N 3.42Å; T196-E200 HydrophobicContact CG2-CG 4.33Å; T196-E200 WeakPolarHBondContact CG2-OE1 3.41Å; T196-E200 WeakPolarHBondContact O-CB 3.39Å; T196-E200 VanDerWaalsContact O-CG 3.25Å; T196-E200 WeakPolarHBondContact O-CG 3.34Å; T196-E200 PolarHBondContact O-N 3.47Å
197T98.2Very high96.5Very high7 Ų759.4 Ų59.44%0.04331%0.314CS..Hα-helixtrans-63.3-45.1177.9-56.70000111.8L170 A173 L193 K195 A201 L223L170-T197 HydrophobicContact CD2-CG2 3.72Å; A173-T197 HydrophobicContact CB-CG2 3.58Å; A173-T197 WeakPolarHBondContact CB-OG1 3.33Å; L193-T197 WeakPolarHBondContact O-CB 3.17Å; L193-T197 PolarHBondContact O-N 3.27Å; L193-T197 PolarHBondContact O-OG1 2.97Å; K195-T197 VanDerWaalsContact C-N 3.28Å; K195-T197 PolarHBondContact O-N 3.42Å; T197-A201 WeakPolarHBondContact O-CB 3.46Å; T197-A201 PolarHBondContact O-N 2.87Å; T197-L223 HydrophobicContact CG2-CD1 3.97Å
198F97.9Very high96.2Very high42 Ų4259.6 Ų59.618%0.18431%0.314CS..Hα-helixtrans-61.8-46.5178.9-177.3-92.2000111.3A194 K195 A201 M202 M220 L223 R224 L227A194-F198 WeakPolarHBondContact O-CB 3.48Å; A194-F198 PolarHBondContact O-N 2.84Å; K195-F198 PolarHBondContact O-N 3.43Å; F198-A201 PolarHBondContact O-N 3.14Å; F198-M202 HydrophobicContact CD1-CG 3.85Å; F198-M202 HydrophobicContact CE1-CG 3.46Å; F198-M202 VanDerWaalsContact CE1-CG 3.46Å; F198-M202 HydrophobicContact CE1-SD 4.27Å; F198-M202 HydrophobicContact CE2-CG 4.26Å; F198-M202 HydrophobicContact CE2-SD 4.46Å; F198-M202 HydrophobicContact CG-CG 4.4Å; F198-M202 HydrophobicContact CZ-CG 3.68Å; F198-M202 HydrophobicContact CZ-SD 3.92Å; F198-M202 VanDerWaalsContact O-CB 3.31Å; F198-M202 WeakPolarHBondContact O-CB 3.5Å; F198-M202 VanDerWaalsContact O-CG 3.26Å; F198-M202 WeakPolarHBondContact O-CG 3.31Å; F198-M202 PolarHBondContact O-N 3.34Å; F198-M220 HydrophobicContact CD2-CB 4.21Å; F198-M220 WeakPolarHBondContact CD2-O 3.44Å; F198-M220 HydrophobicContact CE2-CB 4.14Å; F198-M220 HydrophobicContact CE2-CE 4.47Å; F198-M220 WeakPolarHBondContact CE2-O 3.31Å; F198-L223 HydrophobicContact CD2-CB 4.48Å; F198-R224 HydrophobicContact CD2-CB 4.34Å; F198-R224 HydrophobicContact CE2-CB 3.92Å; F198-R224 HydrophobicContact CE2-CG 4.5Å; F198-R224 HydrophobicContact CZ-CB 4.4Å; F198-L227 HydrophobicContact CB-CD1 4.42Å
199D98Very high95.8Very high86 Ų8656.6 Ų56.646%0.4631%0.307SS..Hα-helixtrans-64.5-44-179.4-68.6-19.5000111.8K195 T196 M202 A203K195-D199 WeakPolarHBondContact O-CB 3.39Å; K195-D199 VanDerWaalsContact O-CG 3.3Å; K195-D199 PolarHBondContact O-N 3.48Å; T196-D199 PolarHBondContact O-N 3.42Å; D199-M202 PolarHBondContact O-N 2.85Å; D199-A203 PolarHBondContact O-N 3.49Å
200E97.4Very high95.4Very high68 Ų6860.6 Ų60.632%0.31833%0.326SS..Hα-helixtrans-60.2-46.2175.1-74.3176.4179.400111.6P164 R169 T196 A203 D204P164-E200 HydrophobicContact CB-CB 3.99Å; P164-E200 HydrophobicContact CG-CB 4.43Å; R169-E200 IonicContact CZ-OE2 3.51Å; R169-E200 IonicContact NH2-OE2 2.81Å; R169-E200 PolarHBondContact NH2-OE2 3.5Å; T196-E200 HydrophobicContact CG2-CG 4.33Å; T196-E200 WeakPolarHBondContact CG2-OE1 3.41Å; T196-E200 WeakPolarHBondContact O-CB 3.39Å; T196-E200 VanDerWaalsContact O-CG 3.25Å; T196-E200 WeakPolarHBondContact O-CG 3.34Å; T196-E200 PolarHBondContact O-N 3.47Å; E200-A203 PolarHBondContact O-N 2.92Å; E200-D204 PolarHBondContact O-N 2.86Å
201A96.9Very high95Very high0 Ų067.7 Ų67.70%036%0.364CS..Hα-helixtrans-70.1-35.3-179.900000112.7T165 L170 T197 F198 D204 L205 M220T165-A201 WeakPolarHBondContact CG2-O 3.33Å; L170-A201 HydrophobicContact CD2-CB 3.71Å; T197-A201 WeakPolarHBondContact O-CB 3.46Å; T197-A201 PolarHBondContact O-N 2.87Å; F198-A201 PolarHBondContact O-N 3.14Å; A201-D204 CarbonylContact O-C 3.43Å; A201-D204 PolarHBondContact O-N 2.93Å; A201-L205 WeakPolarHBondContact O-CA 3.26Å; A201-L205 PolarHBondContact O-N 3.43Å; A201-M220 HydrophobicContact CB-CE 3.8Å; A201-M220 HydrophobicContact CB-CG 4.28Å; A201-M220 HydrophobicContact CB-SD 3.91Å
202M96.1Very high94.6Very high89 Ų8967.9 Ų67.944%0.43837%0.368SS..Hα-helixtrans-63.7-39.8174.1-81.3-59.2-5100112.1F198 D199 D204 L205 M220F198-M202 HydrophobicContact CD1-CG 3.85Å; F198-M202 HydrophobicContact CE1-CG 3.46Å; F198-M202 VanDerWaalsContact CE1-CG 3.46Å; F198-M202 HydrophobicContact CE1-SD 4.27Å; F198-M202 HydrophobicContact CE2-CG 4.26Å; F198-M202 HydrophobicContact CE2-SD 4.46Å; F198-M202 HydrophobicContact CG-CG 4.4Å; F198-M202 HydrophobicContact CZ-CG 3.68Å; F198-M202 HydrophobicContact CZ-SD 3.92Å; F198-M202 VanDerWaalsContact O-CB 3.31Å; F198-M202 WeakPolarHBondContact O-CB 3.5Å; F198-M202 VanDerWaalsContact O-CG 3.26Å; F198-M202 WeakPolarHBondContact O-CG 3.31Å; F198-M202 PolarHBondContact O-N 3.34Å; D199-M202 PolarHBondContact O-N 2.85Å; M202-D204 VanDerWaalsContact C-N 3.32Å; M202-D204 PolarHBondContact O-N 2.88Å; M202-L205 HydrophobicContact CE-CD2 4.3Å; M202-L205 WeakPolarHBondContact O-CB 3.39Å; M202-L205 PolarHBondContact O-N 3.5Å; M202-L205 HydrophobicContact SD-CD2 4.27Å; M202-M220 HydrophobicContact CB-CE 4.33Å; M202-M220 HydrophobicContact CG-CE 3.59Å; M202-M220 HydrophobicContact SD-CE 3.34Å; M202-M220 WeakPolarHBondContact SD-CE 3.39Å
203A96.7Very high94.3Very high67 Ų6770.5 Ų70.555%0.55437%0.368SS*.Hα-helixtrans-63-39.6176.600000112.1D199 E200 H206D199-A203 PolarHBondContact O-N 3.49Å; E200-A203 PolarHBondContact O-N 2.92Å; A203-H206 PolarHBondContact O-CE1 3.48Å; A203-H206 PolarHBondContact O-ND1 2.76Å; A203-H206 VanDerWaalsContact O-ND1 3.12Å
204D95.2Very high94.1Very high59 Ų5976.9 Ų76.932%0.31639%0.394SS..Hα-helixtrans-94.23.8-177.1-79.13.5000114P164 T165 E200 A201 M202 H206 T207P164-D204 WeakPolarHBondContact CD-OD2 3.26Å; P164-D204 WeakPolarHBondContact CG-OD2 3.24Å; T165-D204 HydrophobicContact CG2-CB 3.8Å; T165-D204 WeakPolarHBondContact CG2-O 3.2Å; E200-D204 PolarHBondContact O-N 2.86Å; A201-D204 CarbonylContact O-C 3.43Å; A201-D204 PolarHBondContact O-N 2.93Å; M202-D204 VanDerWaalsContact C-N 3.32Å; M202-D204 PolarHBondContact O-N 2.88Å; D204-H206 PolarHBondContact O-N 2.82Å; D204-T207 WeakPolarHBondContact O-CB 3.45Å; D204-T207 PolarHBondContact O-N 2.72Å; D204-T207 PolarHBondContact O-OG1 3.08Å
205L92.5Very high93.9Very high39 Ų3981.1 Ų81.120%0.20442%0.417CS..G310 helixtrans-56.5-30.8-173-170.964.4000113.5A201 M202 T207 L208 T217 M220A201-L205 WeakPolarHBondContact O-CA 3.26Å; A201-L205 PolarHBondContact O-N 3.43Å; M202-L205 HydrophobicContact CE-CD2 4.3Å; M202-L205 WeakPolarHBondContact O-CB 3.39Å; M202-L205 PolarHBondContact O-N 3.5Å; M202-L205 HydrophobicContact SD-CD2 4.27Å; L205-T207 PolarHBondContact O-N 3.08Å; L205-L208 HydrophobicContact CD1-CD2 3.88Å; L205-L208 VanDerWaalsContact O-CB 3.24Å; L205-L208 WeakPolarHBondContact O-CB 3.46Å; L205-L208 PolarHBondContact O-N 3.17Å; L205-T217 HydrophobicContact CD1-CG2 4.21Å; L205-M220 HydrophobicContact CD1-CE 4.31Å; L205-M220 HydrophobicContact CD1-SD 3.99Å
206H91.1Very high93.9Very high157 Ų15775.5 Ų75.573%0.72739%0.393SS*.G310 helixtrans-66.6-16.3177.868.9-80.8000114.2A203 D204A203-H206 PolarHBondContact O-CE1 3.48Å; A203-H206 PolarHBondContact O-ND1 2.76Å; A203-H206 VanDerWaalsContact O-ND1 3.12Å; D204-H206 PolarHBondContact O-N 2.82Å
207T88.8Confident93.8Very high82 Ų8274.5 Ų74.550%0.50339%0.386SS..G310 helixtrans-88-9.1178.669.10000113.3D204 L205D204-T207 WeakPolarHBondContact O-CB 3.45Å; D204-T207 PolarHBondContact O-N 2.72Å; D204-T207 PolarHBondContact O-OG1 3.08Å; L205-T207 PolarHBondContact O-N 3.08Å
208L89.8Confident93.7Very high26 Ų2679 Ų7914%0.13641%0.409CS..  trans-71.5132.3-170.4-169.755.1000111.5L205 Y213L205-L208 HydrophobicContact CD1-CD2 3.88Å; L205-L208 VanDerWaalsContact O-CB 3.24Å; L205-L208 WeakPolarHBondContact O-CB 3.46Å; L205-L208 PolarHBondContact O-N 3.17Å; L208-Y213 HydrophobicContact CB-CD2 4.49Å; L208-Y213 HydrophobicContact CD2-CD2 3.89Å; L208-Y213 HydrophobicContact CD2-CG 4.42Å; L208-Y213 HydrophobicContact CG-CD2 4.27Å
209S89.2Confident93.7Very high60 Ų6078.2 Ų78.242%0.4241%0.407SS..  trans-71.7156.5175.165.20000111.6D211 S212 Y213S209-D211 VanDerWaalsContact C-N 3.25Å; S209-D211 PolarHBondContact O-N 3.33Å; S209-S212 PolarHBondContact O-N 3.44Å; S209-S212 PolarHBondContact OG-N 2.76Å; S209-Y213 WeakPolarHBondContact O-CB 3.24Å; S209-Y213 PolarHBondContact O-N 3.48Å
210E88.5Confident93.7Very high184 Ų18474.5 Ų74.586%0.8639%0.387SS*.Hα-helixtrans-57.4-39.6176.6-168.8172.6-179.800111.9S212 Y213E210-S212 VanDerWaalsContact C-N 3.35Å; E210-S212 PolarHBondContact O-N 3.24Å; E210-Y213 PolarHBondContact O-N 3.15Å
211D88.6Confident93.8Very high150 Ų15074.2 Ų74.280%0.80239%0.386SS*.Hα-helixtrans-64.1-34.5-179.2-64.7-28000113.5S209S209-D211 VanDerWaalsContact C-N 3.25Å; S209-D211 PolarHBondContact O-N 3.33Å
212S90.8Very high93.8Very high34 Ų3477.8 Ų77.824%0.23840%0.404CS..Hα-helixtrans-96.8-10.3179.8-63.20000113.4S209 E210 K214 D215 S216S209-S212 PolarHBondContact O-N 3.44Å; S209-S212 PolarHBondContact OG-N 2.76Å; E210-S212 VanDerWaalsContact C-N 3.35Å; E210-S212 PolarHBondContact O-N 3.24Å; S212-K214 PolarHBondContact O-N 3.45Å; S212-D215 PolarHBondContact O-N 2.95Å; S212-S216 WeakPolarHBondContact O-CB 3.32Å; S212-S216 PolarHBondContact O-N 3.45Å; S212-S216 PolarHBondContact O-OG 3.05Å
213Y91.9Very high93.9Very high125 Ų12573.5 Ų73.549%0.4938%0.383SS..Hα-helixtrans-55.8-48.6-171.6-170.4-92.7000112.7L208 S209 E210 T217L208-Y213 HydrophobicContact CB-CD2 4.49Å; L208-Y213 HydrophobicContact CD2-CD2 3.89Å; L208-Y213 HydrophobicContact CD2-CG 4.42Å; L208-Y213 HydrophobicContact CG-CD2 4.27Å; S209-Y213 WeakPolarHBondContact O-CB 3.24Å; S209-Y213 PolarHBondContact O-N 3.48Å; E210-Y213 PolarHBondContact O-N 3.15Å; Y213-T217 HydrophobicContact CD1-CG2 4.2Å; Y213-T217 HydrophobicContact CD2-CG2 4.48Å; Y213-T217 HydrophobicContact CE1-CG2 3.91Å; Y213-T217 HydrophobicContact CE2-CG2 4.21Å; Y213-T217 HydrophobicContact CG-CG2 4.48Å; Y213-T217 WeakPolarHBondContact O-CB 3.24Å; Y213-T217 WeakPolarHBondContact O-CG2 3.29Å; Y213-T217 PolarHBondContact O-N 3.24Å; Y213-T217 PolarHBondContact O-OG1 2.95Å
214K94.3Very high94Very high160 Ų16075.9 Ų75.970%0.69638%0.378SS*.Hα-helixtrans-64.5-45.6-176.9-175.4-176.7175.6-172.20112.3S212 T217 L218S212-K214 PolarHBondContact O-N 3.45Å; K214-T217 PolarHBondContact O-OG1 3.19Å; K214-L218 WeakPolarHBondContact O-CB 3Å; K214-L218 PolarHBondContact O-N 2.94Å; K214-L218 VanDerWaalsContact O-N 3.11Å
215D94.7Very high94.1Very high88 Ų8876.4 Ų76.447%0.47138%0.381SS..Hα-helixtrans-71.3-45.6-175.3-69.7-15.2000111P167 S212 L218 I219P167-D215 HydrophobicContact CB-CB 4.07Å; S212-D215 PolarHBondContact O-N 2.95Å; D215-L218 PolarHBondContact O-N 3.34Å; D215-I219 VanDerWaalsContact O-CG1 3.26Å; D215-I219 WeakPolarHBondContact O-CG1 3.3Å; D215-I219 PolarHBondContact O-N 3.28Å
216S96.3Very high94.3Very high0 Ų076.2 Ų76.20%038%0.38CS..Hα-helixtrans-64.9-43.4179.1-62.40000112.1T165 P167 S212 L218 I219 M220T165-S216 WeakPolarHBondContact O-CB 3.33Å; T165-S216 PolarHBondContact O-OG 2.82Å; P167-S216 WeakPolarHBondContact CD-OG 3.49Å; S212-S216 WeakPolarHBondContact O-CB 3.32Å; S212-S216 PolarHBondContact O-N 3.45Å; S212-S216 PolarHBondContact O-OG 3.05Å; S216-L218 VanDerWaalsContact C-N 3.35Å; S216-L218 PolarHBondContact O-N 2.89Å; S216-I219 PolarHBondContact O-N 2.65Å; S216-M220 WeakPolarHBondContact O-CB 3.33Å; S216-M220 VanDerWaalsContact O-CG 3.24Å; S216-M220 WeakPolarHBondContact O-CG 3.41Å; S216-M220 PolarHBondContact O-N 2.89Å
217T96.3Very high94.6Very high41 Ų4169.9 Ų69.925%0.25235%0.351SS..Hα-helixtrans-65.9-36.7178.553.50000112.5L205 Y213 K214 M220 Q221L205-T217 HydrophobicContact CD1-CG2 4.21Å; Y213-T217 HydrophobicContact CD1-CG2 4.2Å; Y213-T217 HydrophobicContact CD2-CG2 4.48Å; Y213-T217 HydrophobicContact CE1-CG2 3.91Å; Y213-T217 HydrophobicContact CE2-CG2 4.21Å; Y213-T217 HydrophobicContact CG-CG2 4.48Å; Y213-T217 WeakPolarHBondContact O-CB 3.24Å; Y213-T217 WeakPolarHBondContact O-CG2 3.29Å; Y213-T217 PolarHBondContact O-N 3.24Å; Y213-T217 PolarHBondContact O-OG1 2.95Å; K214-T217 PolarHBondContact O-OG1 3.19Å; T217-M220 PolarHBondContact O-N 2.85Å; T217-Q221 WeakPolarHBondContact O-CB 3.32Å; T217-Q221 PolarHBondContact O-N 3.32Å
218L97.4Very high95Very high101 Ų10170.4 Ų70.453%0.52936%0.355SS..Hα-helixtrans-61.8-43.1172.5178.462.4000111.6K214 D215 S216 Q221 L222K214-L218 WeakPolarHBondContact O-CB 3Å; K214-L218 PolarHBondContact O-N 2.94Å; K214-L218 VanDerWaalsContact O-N 3.11Å; D215-L218 PolarHBondContact O-N 3.34Å; S216-L218 VanDerWaalsContact C-N 3.35Å; S216-L218 PolarHBondContact O-N 2.89Å; L218-Q221 WeakPolarHBondContact O-CB 3.25Å; L218-Q221 PolarHBondContact O-N 3.32Å; L218-L222 WeakPolarHBondContact O-CG 3.47Å; L218-L222 PolarHBondContact O-N 3.38Å; L218-L222 VanDerWaalsContact O-N 3.13Å
219I98Very high95.3Very high27 Ų2773.8 Ų73.814%0.13837%0.372CS..Hα-helixtrans-69.2-40.5178.9-62.3164.1000111.2P167 L170 L174 D215 S216 Q221 L222 L223P167-I219 HydrophobicContact CB-CD1 4.09Å; P167-I219 VanDerWaalsContact O-CD1 3.24Å; P167-I219 WeakPolarHBondContact O-CD1 3.46Å; L170-I219 HydrophobicContact CB-CB 4.17Å; L170-I219 HydrophobicContact CB-CD1 4.39Å; L170-I219 HydrophobicContact CB-CG2 3.62Å; L174-I219 HydrophobicContact CB-CG2 4.22Å; L174-I219 HydrophobicContact CD2-CG2 4.11Å; D215-I219 VanDerWaalsContact O-CG1 3.26Å; D215-I219 WeakPolarHBondContact O-CG1 3.3Å; D215-I219 PolarHBondContact O-N 3.28Å; S216-I219 PolarHBondContact O-N 2.65Å; I219-Q221 VanDerWaalsContact C-N 3.27Å; I219-Q221 PolarHBondContact O-N 3.33Å; I219-L222 WeakPolarHBondContact O-CB 3.45Å; I219-L222 PolarHBondContact O-N 3.25Å; I219-L222 VanDerWaalsContact O-N 3.16Å; I219-L223 PolarHBondContact O-N 3.41Å
220M97.9Very high95.6Very high7 Ų771.2 Ų71.23%0.03435%0.353CS..Hα-helixtrans-61.2-37.7174.5-70.4171.171.200111.9L170 F198 A201 M202 L205 S216 T217 L223 R224L170-M220 HydrophobicContact CD1-CG 4.01Å; L170-M220 HydrophobicContact CD1-SD 4.41Å; L170-M220 HydrophobicContact CD2-CG 4.17Å; F198-M220 HydrophobicContact CD2-CB 4.21Å; F198-M220 WeakPolarHBondContact CD2-O 3.44Å; F198-M220 HydrophobicContact CE2-CB 4.14Å; F198-M220 HydrophobicContact CE2-CE 4.47Å; F198-M220 WeakPolarHBondContact CE2-O 3.31Å; A201-M220 HydrophobicContact CB-CE 3.8Å; A201-M220 HydrophobicContact CB-CG 4.28Å; A201-M220 HydrophobicContact CB-SD 3.91Å; M202-M220 HydrophobicContact CB-CE 4.33Å; M202-M220 HydrophobicContact CG-CE 3.59Å; M202-M220 HydrophobicContact SD-CE 3.34Å; M202-M220 WeakPolarHBondContact SD-CE 3.39Å; L205-M220 HydrophobicContact CD1-CE 4.31Å; L205-M220 HydrophobicContact CD1-SD 3.99Å; S216-M220 WeakPolarHBondContact O-CB 3.33Å; S216-M220 VanDerWaalsContact O-CG 3.24Å; S216-M220 WeakPolarHBondContact O-CG 3.41Å; S216-M220 PolarHBondContact O-N 2.89Å; T217-M220 PolarHBondContact O-N 2.85Å; M220-L223 PolarHBondContact O-N 3.47Å; M220-R224 PolarHBondContact O-N 3.37Å
221Q98.1Very high95.9Very high63 Ų6366.1 Ų66.129%0.29434%0.335SS..Hα-helixtrans-60.7-45.9173.3176.755.14200111.3T217 L218 I219 L223 R224 D225T217-Q221 WeakPolarHBondContact O-CB 3.32Å; T217-Q221 PolarHBondContact O-N 3.32Å; L218-Q221 WeakPolarHBondContact O-CB 3.25Å; L218-Q221 PolarHBondContact O-N 3.32Å; I219-Q221 VanDerWaalsContact C-N 3.27Å; I219-Q221 PolarHBondContact O-N 3.33Å; Q221-L223 PolarHBondContact O-N 2.91Å; Q221-R224 WeakPolarHBondContact O-CB 3.48Å; Q221-R224 PolarHBondContact O-N 2.99Å; Q221-D225 PolarHBondContact NE2-OD1 3.22Å; Q221-D225 PolarHBondContact NE2-OD2 3.29Å; Q221-D225 PolarHBondContact O-N 2.84Å
222L98.3Very high96Very high74 Ų7462 Ų6239%0.38732%0.321SS..Hα-helixtrans-63.1-40.4176.3-65.8171.7000112.6L174 L218 I219 R224 D225 N226L174-L222 HydrophobicContact CD1-CB 4.1Å; L174-L222 HydrophobicContact CD2-CB 3.89Å; L174-L222 HydrophobicContact CD2-CD1 3.85Å; L218-L222 WeakPolarHBondContact O-CG 3.47Å; L218-L222 PolarHBondContact O-N 3.38Å; L218-L222 VanDerWaalsContact O-N 3.13Å; I219-L222 WeakPolarHBondContact O-CB 3.45Å; I219-L222 PolarHBondContact O-N 3.25Å; I219-L222 VanDerWaalsContact O-N 3.16Å; L222-R224 VanDerWaalsContact C-N 3.34Å; L222-R224 PolarHBondContact O-N 3.49Å; L222-D225 PolarHBondContact O-N 3.2Å; L222-N226 PolarHBondContact O-N 3.25Å
223L98.2Very high95.8Very high0 Ų063.5 Ų63.50%033%0.327CS..Hα-helixtrans-59.2-44.8173.9-78.2168.5000111.6L170 L174 A194 T197 F198 I219 M220 Q221 D225 N226 L227L170-L223 HydrophobicContact CD2-CD1 4.29Å; L174-L223 HydrophobicContact CB-CD2 3.97Å; L174-L223 HydrophobicContact CB-CG 4.25Å; L174-L223 HydrophobicContact CD1-CD2 3.95Å; L174-L223 HydrophobicContact CD1-CG 4.16Å; A194-L223 HydrophobicContact CB-CD2 3.95Å; T197-L223 HydrophobicContact CG2-CD1 3.97Å; F198-L223 HydrophobicContact CD2-CB 4.48Å; I219-L223 PolarHBondContact O-N 3.41Å; M220-L223 PolarHBondContact O-N 3.47Å; Q221-L223 PolarHBondContact O-N 2.91Å; L223-D225 VanDerWaalsContact C-N 3.34Å; L223-N226 PolarHBondContact O-N 3.5Å; L223-L227 WeakPolarHBondContact O-CG 3.24Å; L223-L227 PolarHBondContact O-N 3.09Å
224R97.8Very high95.2Very high117 Ų11759 Ų5944%0.44231%0.312SS..Hα-helixtrans-63-41177.2-171.5-171.374.5-170.84.9112.3F198 M220 Q221 L222 L227 T228F198-R224 HydrophobicContact CD2-CB 4.34Å; F198-R224 HydrophobicContact CE2-CB 3.92Å; F198-R224 HydrophobicContact CE2-CG 4.5Å; F198-R224 HydrophobicContact CZ-CB 4.4Å; M220-R224 PolarHBondContact O-N 3.37Å; Q221-R224 WeakPolarHBondContact O-CB 3.48Å; Q221-R224 PolarHBondContact O-N 2.99Å; L222-R224 VanDerWaalsContact C-N 3.34Å; L222-R224 PolarHBondContact O-N 3.49Å; R224-L227 PolarHBondContact O-N 2.94Å; R224-T228 PolarHBondContact O-N 3.45Å; R224-T228 PolarHBondContact O-OG1 2.94Å
225D98.1Very high94.4Very high70 Ų7054.5 Ų54.537%0.37430%0.304SS..Hα-helixtrans-66.7-42.5-179.3-64.9-14.2000110.5Q221 L222 L223 T228 L229Q221-D225 PolarHBondContact NE2-OD1 3.22Å; Q221-D225 PolarHBondContact NE2-OD2 3.29Å; Q221-D225 PolarHBondContact O-N 2.84Å; L222-D225 PolarHBondContact O-N 3.2Å; L223-D225 VanDerWaalsContact C-N 3.34Å; D225-T228 PolarHBondContact O-N 3.47Å; D225-L229 PolarHBondContact O-N 3.12Å
226N97.1Very high93.2Very high35 Ų3553.1 Ų53.119%0.18731%0.31CS..Hα-helixtrans-60.5-45.6171.9-76.30.6000112.4L174 L222 L223 T228 L229 W230L174-N226 VanDerWaalsContact CD1-ND2 3.34Å; L174-N226 WeakPolarHBondContact CD1-ND2 3.47Å; L222-N226 PolarHBondContact O-N 3.25Å; L223-N226 PolarHBondContact O-N 3.5Å; N226-T228 VanDerWaalsContact C-N 3.27Å; N226-T228 PolarHBondContact O-N 2.93Å; N226-L229 PolarHBondContact O-N 2.9Å; N226-W230 HydrophobicContact CB-CD2 4.15Å; N226-W230 HydrophobicContact CB-CE3 3.98Å; N226-W230 HydrophobicContact CB-CH2 3.66Å; N226-W230 HydrophobicContact CB-CZ2 3.82Å; N226-W230 HydrophobicContact CB-CZ3 3.73Å; N226-W230 WeakPolarHBondContact ND2-CH2 3.49Å; N226-W230 WeakPolarHBondContact O-CB 3.48Å; N226-W230 VanDerWaalsContact O-CD2 3.3Å; N226-W230 PolarHBondContact O-N 2.81Å
227L97.1Very high91.3Very high23 Ų2360.9 Ų60.912%0.1235%0.347CS..Hα-helixtrans-58.1-41.2176.6-77.9169.2000112.1I191 A194 K195 F198 L223 R224 T231I191-L227 HydrophobicContact CB-CD2 4.45Å; I191-L227 HydrophobicContact CG2-CD2 3.96Å; I191-L227 WeakPolarHBondContact O-CD2 3.34Å; A194-L227 HydrophobicContact CB-CD1 4.34Å; A194-L227 HydrophobicContact CB-CD2 3.73Å; A194-L227 HydrophobicContact CB-CG 3.85Å; K195-L227 HydrophobicContact CB-CD1 4.27Å; K195-L227 HydrophobicContact CB-CD2 3.97Å; F198-L227 HydrophobicContact CB-CD1 4.42Å; L223-L227 WeakPolarHBondContact O-CG 3.24Å; L223-L227 PolarHBondContact O-N 3.09Å; R224-L227 PolarHBondContact O-N 2.94Å; L227-T231 WeakPolarHBondContact O-CB 3.38Å; L227-T231 PolarHBondContact O-N 2.8Å; L227-T231 PolarHBondContact O-OG1 3.18Å
228T96.6Very high89.2Confident94 Ų9467 Ų6758%0.57737%0.372SS*.Hα-helixtrans-64.5-45.8178.8-56.90000110.8R224 D225 N226 A232R224-T228 PolarHBondContact O-N 3.45Å; R224-T228 PolarHBondContact O-OG1 2.94Å; D225-T228 PolarHBondContact O-N 3.47Å; N226-T228 VanDerWaalsContact C-N 3.27Å; N226-T228 PolarHBondContact O-N 2.93Å; T228-A232 PolarHBondContact O-N 2.99Å
229L95.9Very high86.7Confident96 Ų9665.1 Ų65.150%0.50338%0.378SS..Hα-helixtrans-61.6-57178.2-178.864.9000111.1D225 N226 T231 A232 D233D225-L229 PolarHBondContact O-N 3.12Å; N226-L229 PolarHBondContact O-N 2.9Å; L229-T231 VanDerWaalsContact C-N 3.34Å; L229-T231 PolarHBondContact O-N 3.38Å; L229-A232 WeakPolarHBondContact O-CB 3.47Å; L229-A232 PolarHBondContact O-N 2.76Å; L229-A232 VanDerWaalsContact O-N 3.12Å; L229-D233 PolarHBondContact O-N 2.99Å; L229-D233 VanDerWaalsContact O-N 3.07Å
230W96.8Very high83.9Confident6 Ų667.2 Ų67.22%0.02341%0.406CS..Hα-helixtrans-68.6-31.1-172.7-57.2-27.7000113.4V178 Y181 A190 I191 A194 N226 A232 N234V178-W230 HydrophobicContact CG2-CH2 3.99Å; V178-W230 HydrophobicContact CG2-CZ2 4.04Å; Y181-W230 AromaticContact CD1-CD1 3.87Å; Y181-W230 AromaticContact CD1-CE2 3.95Å; Y181-W230 HydrophobicContact CD1-CZ2 4.46Å; Y181-W230 AromaticContact CD1-NE1 3.44Å; Y181-W230 HydrophobicContact CD2-CB 4.04Å; Y181-W230 AromaticContact CD2-CD1 3.57Å; Y181-W230 AromaticContact CD2-CD2 3.73Å; Y181-W230 HydrophobicContact CD2-CD2 3.73Å; Y181-W230 AromaticContact CD2-CE2 3.88Å; Y181-W230 HydrophobicContact CD2-CE3 4.44Å; Y181-W230 AromaticContact CD2-CG 3.53Å; Y181-W230 HydrophobicContact CD2-CG 3.53Å; Y181-W230 AromaticContact CD2-NE1 3.76Å; Y181-W230 AromaticContact CE1-CD1 3.56Å; Y181-W230 HydrophobicContact CE1-CG 4.46Å; Y181-W230 AromaticContact CE1-NE1 3.52Å; Y181-W230 HydrophobicContact CE2-CB 3.67Å; Y181-W230 AromaticContact CE2-CD1 3.25Å; Y181-W230 HydrophobicContact CE2-CD2 4.14Å; Y181-W230 AromaticContact CE2-CG 3.42Å; Y181-W230 HydrophobicContact CE2-CG 3.42Å; Y181-W230 VanDerWaalsContact CE2-CG 3.42Å; Y181-W230 AromaticContact CE2-NE1 3.86Å; Y181-W230 AromaticContact CG-CD1 3.87Å; Y181-W230 HydrophobicContact CG-CD2 4.01Å; Y181-W230 AromaticContact CG-CE2 3.66Å; Y181-W230 HydrophobicContact CG-CG 4.12Å; Y181-W230 HydrophobicContact CG-CZ2 4.13Å; Y181-W230 AromaticContact CG-NE1 3.56Å; Y181-W230 AromaticContact CZ-CD1 3.25Å; Y181-W230 AromaticContact CZ-CG 3.93Å; Y181-W230 AromaticContact CZ-NE1 3.73Å; A190-W230 HydrophobicContact CB-CE3 4.25Å; A190-W230 HydrophobicContact CB-CZ3 4.11Å; I191-W230 HydrophobicContact CD1-CB 4.06Å; I191-W230 HydrophobicContact CG1-CB 3.89Å; I191-W230 HydrophobicContact CG1-CE3 4.44Å; A194-W230 HydrophobicContact CB-CZ3 4.34Å; N226-W230 HydrophobicContact CB-CD2 4.15Å; N226-W230 HydrophobicContact CB-CE3 3.98Å; N226-W230 HydrophobicContact CB-CH2 3.66Å; N226-W230 HydrophobicContact CB-CZ2 3.82Å; N226-W230 HydrophobicContact CB-CZ3 3.73Å; N226-W230 WeakPolarHBondContact ND2-CH2 3.49Å; N226-W230 WeakPolarHBondContact O-CB 3.48Å; N226-W230 VanDerWaalsContact O-CD2 3.3Å; N226-W230 PolarHBondContact O-N 2.81Å; W230-A232 VanDerWaalsContact C-N 3.34Å; W230-N234 PolarHBondContact O-N 3.01Å; W230-N234 VanDerWaalsContact O-N 3.08Å; W230-N234 PolarHBondContact O-OD1 3.46Å
231T93.2Very high81.1Confident77 Ų7775.6 Ų75.647%0.47245%0.445SS..Hα-helixtrans-70-34.3174.7-53.80000111.5L227 L229 A235L227-T231 WeakPolarHBondContact O-CB 3.38Å; L227-T231 PolarHBondContact O-N 2.8Å; L227-T231 PolarHBondContact O-OG1 3.18Å; L229-T231 VanDerWaalsContact C-N 3.34Å; L229-T231 PolarHBondContact O-N 3.38Å; T231-A235 WeakPolarHBondContact O-CB 3.44Å; T231-A235 PolarHBondContact O-N 3.41Å; T231-A235 VanDerWaalsContact O-N 3.15Å
232A91.8Very high78.5Confident63 Ų6376.7 Ų76.752%0.52147%0.465SS..Hα-helixtrans-69.2-41175.600000111.5T228 L229 W230 A235 G236T228-A232 PolarHBondContact O-N 2.99Å; L229-A232 WeakPolarHBondContact O-CB 3.47Å; L229-A232 PolarHBondContact O-N 2.76Å; L229-A232 VanDerWaalsContact O-N 3.12Å; W230-A232 VanDerWaalsContact C-N 3.34Å; A232-A235 PolarHBondContact O-N 3.05Å; A232-G236 PolarHBondContact O-N 3.38Å; A232-G236 VanDerWaalsContact O-N 3.16Å
233D85.9Confident75.9Confident67 Ų6779 Ų7936%0.35848%0.484SS..Hα-helixtrans-62.9-47.8177.8-64.4-23.7000111.2Y181 L229 A235 G236 E237Y181-D233 PolarHBondContact OH-OD2 3.09Å; Y181-D233 VanDerWaalsContact OH-OD2 3.07Å; L229-D233 PolarHBondContact O-N 2.99Å; L229-D233 VanDerWaalsContact O-N 3.07Å; D233-A235 PolarHBondContact O-N 3.42Å; D233-G236 PolarHBondContact O-N 2.96Å; D233-G236 VanDerWaalsContact O-N 3.14Å; D233-E237 PolarHBondContact O-N 3.26Å
234N80Confident73.3Confident31 Ų3188.1 Ų88.117%0.16653%0.527CS..Hα-helixtrans-63.9-36.4178-81.331.3000113W230 G236 E237 E238W230-N234 PolarHBondContact O-N 3.01Å; W230-N234 VanDerWaalsContact O-N 3.08Å; W230-N234 PolarHBondContact O-OD1 3.46Å; N234-G236 VanDerWaalsContact C-N 3.28Å; N234-G236 PolarHBondContact O-N 3.28Å; N234-E237 PolarHBondContact O-N 3.03Å; N234-E238 PolarHBondContact O-N 2.97Å
235A77.8Confident70.8Confident64 Ų6491.1 Ų91.153%0.52955%0.546SS..Hα-helixtrans-68.6-27.6176.500000112.7T231 A232 D233T231-A235 WeakPolarHBondContact O-CB 3.44Å; T231-A235 PolarHBondContact O-N 3.41Å; T231-A235 VanDerWaalsContact O-N 3.15Å; A232-A235 PolarHBondContact O-N 3.05Å; D233-A235 PolarHBondContact O-N 3.42Å
236G68Low68.4Low59 Ų5993.9 Ų93.961%0.60857%0.567SS**Hα-helixtrans-70.7-31.7174.500000113.4A232 D233 N234A232-G236 PolarHBondContact O-N 3.38Å; A232-G236 VanDerWaalsContact O-N 3.16Å; D233-G236 PolarHBondContact O-N 2.96Å; D233-G236 VanDerWaalsContact O-N 3.14Å; N234-G236 VanDerWaalsContact C-N 3.28Å; N234-G236 PolarHBondContact O-N 3.28Å
237E58.1Low66.2Low163 Ų163101.7 Ų101.776%0.76260%0.603SS**Hα-helixtrans-76-32.9178.4-66.4-172.2171.600112.8D233 N234 G239D233-E237 PolarHBondContact O-N 3.26Å; N234-E237 PolarHBondContact O-N 3.03Å; E237-G239 VanDerWaalsContact C-N 3.28Å; E237-G239 PolarHBondContact O-N 3.26Å
238E51.9Low64.4Low170 Ų170109.6 Ų109.679%0.79466%0.66SS**Hα-helixtrans-74.3-15.3175.5-68.8-171.6167.700113.5N234 G240N234-E238 PolarHBondContact O-N 2.97Å; E238-G240 PolarHBondContact O-N 2.9Å; E238-G240 VanDerWaalsContact O-N 3.16Å
239G44.2Very low62.7Low62 Ų62110.4 Ų110.464%0.63966%0.664SS**THydrogen-bonded Turntrans-76.27.3-177.400000116.2E237 E241E237-G239 VanDerWaalsContact C-N 3.28Å; E237-G239 PolarHBondContact O-N 3.26Å; G239-E241 PolarHBondContact O-N 3.47Å
240G38.6Very low61Low71 Ų71111.1 Ų111.173%0.73267%0.673SS**  trans-81.633.3178.200000115E238 A242E238-G240 PolarHBondContact O-N 2.9Å; E238-G240 VanDerWaalsContact O-N 3.16Å; G240-A242 PolarHBondContact O-N 3.47Å; G240-A242 VanDerWaalsContact O-N 3.1Å
241E39.4Very low59Low182 Ų182116.9 Ų116.985%0.8571%0.709SS**  trans-73.199.9165-77-171.7166.700108.3G239G239-E241 PolarHBondContact O-N 3.47Å
242A43Very low57Low87 Ų87119.3 Ų119.372%0.71972%0.723SS**  trans-53.4129171.400000109.1G240 E244G240-A242 PolarHBondContact O-N 3.47Å; G240-A242 VanDerWaalsContact O-N 3.1Å; A242-E244 PolarHBondContact O-N 2.65Å
243P44.5Very low54.8Low121 Ų121122.8 Ų122.879%0.78674%0.735SS**  trans-60.7126.4-178.922.2-30.1000109.6E245P243-E245 PolarHBondContact O-N 3.49Å
244E44Very low52.8Low192 Ų192126.5 Ų126.590%0.89776%0.76SS**  trans-51.1115.3169.6-75.4-172148.800108.8A242A242-E244 PolarHBondContact O-N 2.65Å
245E44.2Very low50.8Low180 Ų180133.4 Ų133.484%0.84180%0.803SS**PPolyproline II helixtrans-61.4130.4176.3-75.5-172.5158.300109.6P243 Q247P243-E245 PolarHBondContact O-N 3.49Å; E245-Q247 PolarHBondContact O-N 3.41Å
246P48.2Very low48.7Very low128 Ų128138.7 Ų138.783%0.83182%0.824SS**PPolyproline II helixtrans-68.2125.2178.825.6-30.2000109.9S248P246-S248 PolarHBondContact O-N 3.12Å
247Q50.9Low47.1Very low199 Ų199145.3 Ų145.393%0.9384%0.842SS**PPolyproline II helixtrans-58.5126.8172-68.7-178.6-6.700110E245E245-Q247 PolarHBondContact O-N 3.41Å
248S58.5Low46.1Very low189 Ų189143.7 Ų143.7100%1.32285%0.849SS**  trans-61.70179.860.30000114.3P246P246-S248 PolarHBondContact O-N 3.12Å

Retrieved 248 of 248 residues in 271.1 ms (Link to these results)