A0A077Z6Q4_TRITR Loading...

DUF383 and DUF384 domain containing protein

AlphaFold DB , UniProt , Accession A0A077Z6Q4, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 341 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
1M45.5Very low67.2Low233 Ų23379.2 Ų79.2100%1.14843%0.432SS*.  0118.40-142.5173.578.400105D3M1-D3 PolarHBondContact O-N 2.73Å
2N59.1Low67.5Low117 Ų11773 Ų7363%0.62640%0.398SS*.  trans-65.5135.4179.1-69.9-12.7000108.5P4 E7N2-P4 VanDerWaalsContact O-CD 3.31Å; N2-P4 WeakPolarHBondContact O-CD 3.1Å; N2-E7 HydrophobicContact CB-CG 3.83Å; N2-E7 WeakPolarHBondContact CB-OE1 3.44Å; N2-E7 VanDerWaalsContact CG-OE1 3.26Å; N2-E7 PolarHBondContact ND2-OE1 2.83Å
3D68.8Low67.7Low51 Ų5172.9 Ų72.927%0.27339%0.392SS..  trans-67.1118.2174.2171.912.2000108.5M1 V5 A6 E7 H45M1-D3 PolarHBondContact O-N 2.73Å; D3-V5 PolarHBondContact O-N 3.11Å; D3-V5 VanDerWaalsContact O-N 3.15Å; D3-V5 PolarHBondContact OD1-N 3.18Å; D3-A6 HydrophobicContact CB-CB 3.86Å; D3-A6 PolarHBondContact O-N 3.12Å; D3-E7 PolarHBondContact O-N 3.36Å; D3-H45 IonicContact OD2-CD2 3.56Å; D3-H45 PolarHBondContact OD2-CD2 2.92Å; D3-H45 VanDerWaalsContact OD2-CD2 3.22Å; D3-H45 IonicContact OD2-NE2 2.67Å; D3-H45 PolarHBondContact OD2-NE2 3.22Å
4P67.6Low68.1Low92 Ų9278.1 Ų78.160%0.59742%0.417SS*.Hα-helixtrans-54.6-32.3179.2-25.234.6000113.2N2 L8N2-P4 VanDerWaalsContact O-CD 3.31Å; N2-P4 WeakPolarHBondContact O-CD 3.1Å; P4-L8 WeakPolarHBondContact O-CB 3.26Å; P4-L8 PolarHBondContact O-N 3.34Å
5V68.1Low68.2Low47 Ų4779.3 Ų79.329%0.28542%0.422SS..Hα-helixtrans-70.5-45.7177.8-179.70000110.3D3 E7 L8 L9 A46 L49D3-V5 PolarHBondContact O-N 3.11Å; D3-V5 VanDerWaalsContact O-N 3.15Å; D3-V5 PolarHBondContact OD1-N 3.18Å; V5-E7 VanDerWaalsContact C-N 3.34Å; V5-E7 PolarHBondContact O-N 2.88Å; V5-L8 PolarHBondContact O-N 3.38Å; V5-L9 HydrophobicContact CG1-CD1 3.73Å; V5-L9 HydrophobicContact CG1-CG 4.31Å; V5-L9 WeakPolarHBondContact O-CB 3.38Å; V5-L9 WeakPolarHBondContact O-CG 3.29Å; V5-L9 PolarHBondContact O-N 3.28Å; V5-A46 HydrophobicContact CG1-CB 3.83Å; V5-A46 HydrophobicContact CG2-CB 4.38Å; V5-L49 HydrophobicContact CB-CD1 4.47Å; V5-L49 HydrophobicContact CG1-CD1 4.14Å
6A70.3Confident68.4Low22 Ų2280.8 Ų80.818%0.18243%0.426CS..Hα-helixtrans-61.7-39.9175.600000112.5D3 L9 N10 L49D3-A6 HydrophobicContact CB-CB 3.86Å; D3-A6 PolarHBondContact O-N 3.12Å; A6-L9 PolarHBondContact O-N 3.36Å; A6-N10 VanDerWaalsContact O-CB 3.3Å; A6-N10 WeakPolarHBondContact O-CB 3.43Å; A6-N10 VanDerWaalsContact O-CG 3.24Å; A6-N10 PolarHBondContact O-N 3.4Å; A6-N10 PolarHBondContact O-ND2 2.99Å; A6-L49 HydrophobicContact CB-CD1 3.87Å
7E74Confident69.2Low102 Ų10278.8 Ų78.848%0.47742%0.415SS..Hα-helixtrans-63.5-46.6174.8-72.8-170157.600112N2 D3 V5 L9 N10 S11N2-E7 HydrophobicContact CB-CG 3.83Å; N2-E7 WeakPolarHBondContact CB-OE1 3.44Å; N2-E7 VanDerWaalsContact CG-OE1 3.26Å; N2-E7 PolarHBondContact ND2-OE1 2.83Å; D3-E7 PolarHBondContact O-N 3.36Å; V5-E7 VanDerWaalsContact C-N 3.34Å; V5-E7 PolarHBondContact O-N 2.88Å; E7-L9 PolarHBondContact O-N 3.35Å; E7-N10 PolarHBondContact O-N 3.31Å; E7-S11 WeakPolarHBondContact O-CB 3.27Å; E7-S11 PolarHBondContact O-N 3.1Å
8L71.1Confident69.9Low71 Ų7174.9 Ų74.937%0.37240%0.396SS..Hα-helixtrans-57.2-50.6175.6177.562.4000110.7P4 V5 N10 S11 L12 A24P4-L8 WeakPolarHBondContact O-CB 3.26Å; P4-L8 PolarHBondContact O-N 3.34Å; V5-L8 PolarHBondContact O-N 3.38Å; L8-N10 VanDerWaalsContact C-N 3.34Å; L8-N10 PolarHBondContact O-N 3.31Å; L8-S11 WeakPolarHBondContact O-CB 3.25Å; L8-S11 PolarHBondContact O-N 3.04Å; L8-S11 VanDerWaalsContact O-N 3.13Å; L8-S11 PolarHBondContact O-OG 2.65Å; L8-L12 HydrophobicContact CD1-CD1 4.18Å; L8-L12 HydrophobicContact CD1-CG 4.36Å; L8-L12 HydrophobicContact CG-CD1 4Å; L8-L12 VanDerWaalsContact O-CG 3.29Å; L8-L12 WeakPolarHBondContact O-CG 3.47Å; L8-L12 PolarHBondContact O-N 3.11Å; L8-A24 HydrophobicContact CD2-CB 3.92Å
9L70.4Confident70.7Confident8 Ų873.6 Ų73.64%0.04240%0.397CS..Hα-helixtrans-65.9-36.8-178.3-65.2169.5000112.1V5 A6 E7 L12 K13 L49 I50 L53V5-L9 HydrophobicContact CG1-CD1 3.73Å; V5-L9 HydrophobicContact CG1-CG 4.31Å; V5-L9 WeakPolarHBondContact O-CB 3.38Å; V5-L9 WeakPolarHBondContact O-CG 3.29Å; V5-L9 PolarHBondContact O-N 3.28Å; A6-L9 PolarHBondContact O-N 3.36Å; E7-L9 PolarHBondContact O-N 3.35Å; L9-L12 HydrophobicContact CD2-CD1 4.42Å; L9-L12 PolarHBondContact O-N 3.35Å; L9-K13 WeakPolarHBondContact O-CG 3.4Å; L9-K13 PolarHBondContact O-N 2.79Å; L9-L49 HydrophobicContact CD1-CB 3.19Å; L9-L49 HydrophobicContact CD1-CD1 4.19Å; L9-L49 HydrophobicContact CD1-CG 4.32Å; L9-I50 HydrophobicContact CD1-CG1 4.2Å; L9-I50 HydrophobicContact CD2-CG1 4.05Å; L9-L53 HydrophobicContact CB-CD2 4.5Å; L9-L53 HydrophobicContact CD2-CB 4.49Å; L9-L53 HydrophobicContact CD2-CD2 3.44Å; L9-L53 VanDerWaalsContact CD2-CD2 3.44Å
10N72.9Confident71.2Confident88 Ų8874.8 Ų74.847%0.47140%0.399SS..Hα-helixtrans-65.4-39.2172.3-76.5-28.9000112.3A6 E7 L8 L12 K13 I14A6-N10 VanDerWaalsContact O-CB 3.3Å; A6-N10 WeakPolarHBondContact O-CB 3.43Å; A6-N10 VanDerWaalsContact O-CG 3.24Å; A6-N10 PolarHBondContact O-N 3.4Å; A6-N10 PolarHBondContact O-ND2 2.99Å; E7-N10 PolarHBondContact O-N 3.31Å; L8-N10 VanDerWaalsContact C-N 3.34Å; L8-N10 PolarHBondContact O-N 3.31Å; N10-L12 VanDerWaalsContact C-N 3.32Å; N10-L12 PolarHBondContact O-N 3.34Å; N10-K13 PolarHBondContact O-N 3.37Å; N10-I14 WeakPolarHBondContact O-CG1 3.45Å; N10-I14 PolarHBondContact O-N 3.44Å
11S71.8Confident71.9Confident40 Ų4071.4 Ų71.428%0.2838%0.381SS..Hα-helixtrans-64.5-38.4174.880.30000111.7E7 L8 I14 I15E7-S11 WeakPolarHBondContact O-CB 3.27Å; E7-S11 PolarHBondContact O-N 3.1Å; L8-S11 WeakPolarHBondContact O-CB 3.25Å; L8-S11 PolarHBondContact O-N 3.04Å; L8-S11 VanDerWaalsContact O-N 3.13Å; L8-S11 PolarHBondContact O-OG 2.65Å; S11-I14 PolarHBondContact O-N 3.22Å; S11-I15 WeakPolarHBondContact O-CB 3.4Å; S11-I15 VanDerWaalsContact O-CG1 3.3Å; S11-I15 WeakPolarHBondContact O-CG1 3.37Å; S11-I15 PolarHBondContact O-N 3.18Å
12L70.5Confident73.8Confident5 Ų564 Ų643%0.02634%0.343CS..Hα-helixtrans-67.9-34.7177.7-69.7170.3000112.1L8 L9 N10 I14 E16 K20 L21L8-L12 HydrophobicContact CD1-CD1 4.18Å; L8-L12 HydrophobicContact CD1-CG 4.36Å; L8-L12 HydrophobicContact CG-CD1 4Å; L8-L12 VanDerWaalsContact O-CG 3.29Å; L8-L12 WeakPolarHBondContact O-CG 3.47Å; L8-L12 PolarHBondContact O-N 3.11Å; L9-L12 HydrophobicContact CD2-CD1 4.42Å; L9-L12 PolarHBondContact O-N 3.35Å; N10-L12 VanDerWaalsContact C-N 3.32Å; N10-L12 PolarHBondContact O-N 3.34Å; L12-I14 VanDerWaalsContact C-N 3.25Å; L12-I14 PolarHBondContact O-N 3.24Å; L12-E16 WeakPolarHBondContact O-CA 3.26Å; L12-E16 PolarHBondContact O-N 3.17Å; L12-K20 HydrophobicContact CD2-CB 3.64Å; L12-L21 HydrophobicContact CD1-CB 4.38Å; L12-L21 HydrophobicContact CD1-CD1 3.86Å; L12-L21 HydrophobicContact CD2-CB 4.19Å
13K69.8Low75Confident72 Ų7263.6 Ų63.631%0.31334%0.341SS..Hα-helixtrans-59.8-35.1172.1-73176.3-177.4176.10113L9 N10 L53 T56L9-K13 WeakPolarHBondContact O-CG 3.4Å; L9-K13 PolarHBondContact O-N 2.79Å; N10-K13 PolarHBondContact O-N 3.37Å; K13-L53 HydrophobicContact CB-CD1 4.41Å; K13-L53 HydrophobicContact CD-CD1 4.02Å; K13-L53 HydrophobicContact CG-CD1 3.21Å; K13-T56 WeakPolarHBondContact CE-OG1 3.47Å
14I73.6Confident75.6Confident145 Ų14561.8 Ų61.874%0.74433%0.333SS*.Hα-helixtrans-88.3-42.9-173.2-63.4168000111.2N10 S11 L12N10-I14 WeakPolarHBondContact O-CG1 3.45Å; N10-I14 PolarHBondContact O-N 3.44Å; S11-I14 PolarHBondContact O-N 3.22Å; L12-I14 VanDerWaalsContact C-N 3.25Å; L12-I14 PolarHBondContact O-N 3.24Å
15I70Confident76.4Confident97 Ų9757.8 Ų57.850%0.49731%0.307SS..Hα-helixtrans-86.3-26.1-171.9-56.7169.4000111.3S11 D17S11-I15 WeakPolarHBondContact O-CB 3.4Å; S11-I15 VanDerWaalsContact O-CG1 3.3Å; S11-I15 WeakPolarHBondContact O-CG1 3.37Å; S11-I15 PolarHBondContact O-N 3.18Å; I15-D17 HydrophobicContact CB-CB 4.41Å; I15-D17 HydrophobicContact CG2-CB 3.83Å; I15-D17 PolarHBondContact O-N 2.81Å
16E71.9Confident77.1Confident103 Ų10359.1 Ų59.148%0.48132%0.319SS..  trans5434.7-172-63.1-165.4160.100113.2L12 A18 L62L12-E16 WeakPolarHBondContact O-CA 3.26Å; L12-E16 PolarHBondContact O-N 3.17Å; E16-A18 PolarHBondContact O-N 2.9Å; E16-A18 VanDerWaalsContact O-N 3.16Å; E16-L62 HydrophobicContact CB-CD1 3.78Å; E16-L62 HydrophobicContact CG-CD1 4.03Å
17D81.7Confident77.6Confident46 Ų4663 Ų6325%0.24634%0.336CS..  trans-77.1100.2-179.3-168.5-26.8000111.2I15 A19 K20 L21I15-D17 HydrophobicContact CB-CB 4.41Å; I15-D17 HydrophobicContact CG2-CB 3.83Å; I15-D17 PolarHBondContact O-N 2.81Å; D17-A19 VanDerWaalsContact C-N 3.32Å; D17-A19 PolarHBondContact O-N 3.17Å; D17-A19 PolarHBondContact OD1-N 3.01Å; D17-A19 VanDerWaalsContact OD1-N 3.1Å; D17-K20 HydrophobicContact CB-CB 4.14Å; D17-K20 HydrophobicContact CB-CD 4.08Å; D17-K20 HydrophobicContact CB-CG 4.26Å; D17-K20 PolarHBondContact O-N 3.36Å; D17-K20 PolarHBondContact OD1-N 2.97Å; D17-K20 WeakPolarHBondContact OD2-CD 3.16Å; D17-K20 WeakPolarHBondContact OD2-CE 3.46Å; D17-K20 WeakPolarHBondContact OD2-CG 3.49Å; D17-K20 IonicContact OD2-NZ 3.84Å; D17-K20 PolarHBondContact OD2-NZ 2.74Å; D17-L21 PolarHBondContact O-N 3.03Å; D17-L21 VanDerWaalsContact O-N 3.07Å
18A81.7Confident77.9Confident9 Ų959.6 Ų59.67%0.07432%0.321CS..Hα-helixtrans-63-35.4-179.500000113.4E16 L21 E22 R61 L62 I65E16-A18 PolarHBondContact O-N 2.9Å; E16-A18 VanDerWaalsContact O-N 3.16Å; A18-L21 PolarHBondContact O-N 2.93Å; A18-E22 WeakPolarHBondContact O-CB 3.38Å; A18-E22 WeakPolarHBondContact O-CG 3.38Å; A18-E22 PolarHBondContact O-N 3.5Å; A18-R61 HydrophobicContact CB-CG 4.39Å; A18-R61 VanDerWaalsContact CB-NE 3.34Å; A18-L62 VanDerWaalsContact CA-CD2 3.43Å; A18-L62 HydrophobicContact CB-CD2 3.67Å; A18-I65 HydrophobicContact CB-CD1 4.3Å
19A84.3Confident78.5Confident50 Ų5057.6 Ų57.641%0.41331%0.31SS..Hα-helixtrans-67.8-44.8-178.800000110.7D17 L21 E22 D23D17-A19 VanDerWaalsContact C-N 3.32Å; D17-A19 PolarHBondContact O-N 3.17Å; D17-A19 PolarHBondContact OD1-N 3.01Å; D17-A19 VanDerWaalsContact OD1-N 3.1Å; A19-L21 VanDerWaalsContact C-N 3.31Å; A19-L21 PolarHBondContact O-N 3Å; A19-E22 WeakPolarHBondContact O-CB 3.45Å; A19-E22 PolarHBondContact O-N 2.98Å; A19-D23 PolarHBondContact O-N 3.2Å
20K82.1Confident79Confident98 Ų9865 Ų6543%0.42634%0.337SS..Hα-helixtrans-64.2-35.8174.8-69.9179.5-172.8163.30112.9L12 D17 A24L12-K20 HydrophobicContact CD2-CB 3.64Å; D17-K20 HydrophobicContact CB-CB 4.14Å; D17-K20 HydrophobicContact CB-CD 4.08Å; D17-K20 HydrophobicContact CB-CG 4.26Å; D17-K20 PolarHBondContact O-N 3.36Å; D17-K20 PolarHBondContact OD1-N 2.97Å; D17-K20 WeakPolarHBondContact OD2-CD 3.16Å; D17-K20 WeakPolarHBondContact OD2-CE 3.46Å; D17-K20 WeakPolarHBondContact OD2-CG 3.49Å; D17-K20 IonicContact OD2-NZ 3.84Å; D17-K20 PolarHBondContact OD2-NZ 2.74Å; K20-A24 WeakPolarHBondContact O-CB 3.41Å; K20-A24 PolarHBondContact O-N 3.44Å
21L85.1Confident79.3Confident4 Ų462.7 Ų62.72%0.02133%0.327CS..Hα-helixtrans-68.6-40.9174.8-177.864.7000111.2L12 D17 A18 A19 D23 A24 C25 L53 L62 I65 I66L12-L21 HydrophobicContact CD1-CB 4.38Å; L12-L21 HydrophobicContact CD1-CD1 3.86Å; L12-L21 HydrophobicContact CD2-CB 4.19Å; D17-L21 PolarHBondContact O-N 3.03Å; D17-L21 VanDerWaalsContact O-N 3.07Å; A18-L21 PolarHBondContact O-N 2.93Å; A19-L21 VanDerWaalsContact C-N 3.31Å; A19-L21 PolarHBondContact O-N 3Å; L21-D23 VanDerWaalsContact C-N 3.35Å; L21-A24 PolarHBondContact O-N 2.84Å; L21-C25 VanDerWaalsContact O-CB 3.27Å; L21-C25 WeakPolarHBondContact O-CB 3.33Å; L21-C25 PolarHBondContact O-N 2.99Å; L21-C25 PolarHBondContact O-SG 3.25Å; L21-L53 HydrophobicContact CD1-CD2 4.04Å; L21-L62 HydrophobicContact CB-CD2 4.32Å; L21-L62 HydrophobicContact CD2-CB 3.67Å; L21-L62 HydrophobicContact CD2-CD2 3.61Å; L21-L62 HydrophobicContact CD2-CG 4.16Å; L21-I65 HydrophobicContact CD2-CB 4.34Å; L21-I65 HydrophobicContact CD2-CD1 4.21Å; L21-I65 HydrophobicContact CD2-CG2 4.45Å; L21-I65 HydrophobicContact CG-CG2 4.13Å; L21-I66 HydrophobicContact CD1-CD1 4.33Å; L21-I66 HydrophobicContact CD1-CG1 4.25Å; L21-I66 HydrophobicContact CD2-CD1 4.26Å; L21-I66 HydrophobicContact CD2-CG1 4.19Å
22E85Confident79.7Confident76 Ų7660.9 Ų60.936%0.35531%0.314SS..Hα-helixtrans-59-45.6174.5-76.2164.2-157.600110.9A18 A19 C25 S26 R61 I65A18-E22 WeakPolarHBondContact O-CB 3.38Å; A18-E22 WeakPolarHBondContact O-CG 3.38Å; A18-E22 PolarHBondContact O-N 3.5Å; A19-E22 WeakPolarHBondContact O-CB 3.45Å; A19-E22 PolarHBondContact O-N 2.98Å; E22-C25 PolarHBondContact O-N 3.35Å; E22-S26 VanDerWaalsContact O-CB 3.32Å; E22-S26 WeakPolarHBondContact O-CB 3.37Å; E22-S26 PolarHBondContact O-N 3.44Å; E22-S26 PolarHBondContact O-OG 3.04Å; E22-R61 IonicContact OE1-NE 3.6Å; E22-R61 IonicContact OE1-NH2 3.59Å; E22-R61 PolarHBondContact OE1-NH2 3.37Å; E22-I65 HydrophobicContact CG-CD1 3.47Å; E22-I65 VanDerWaalsContact CG-CD1 3.47Å; E22-I65 HydrophobicContact CG-CG1 3.76Å; E22-I65 HydrophobicContact CG-CG2 4.19Å
23D84Confident79.7Confident109 Ų10961.1 Ų61.158%0.58332%0.317SS*.Hα-helixtrans-61.4-50.3175.9-70.4-22.2000111.3A19 L21 C25 S26 D27A19-D23 PolarHBondContact O-N 3.2Å; L21-D23 VanDerWaalsContact C-N 3.35Å; D23-C25 PolarHBondContact O-N 2.83Å; D23-S26 WeakPolarHBondContact O-CB 3.28Å; D23-S26 PolarHBondContact O-N 3.34Å; D23-D27 PolarHBondContact O-N 3.04Å
24A81Confident79.9Confident13 Ų1363.4 Ų63.411%0.10733%0.333CS..Hα-helixtrans-59.7-46.8178.600000111.9L8 K20 L21 S26 D27 L28L8-A24 HydrophobicContact CD2-CB 3.92Å; K20-A24 WeakPolarHBondContact O-CB 3.41Å; K20-A24 PolarHBondContact O-N 3.44Å; L21-A24 PolarHBondContact O-N 2.84Å; A24-S26 VanDerWaalsContact C-N 3.31Å; A24-S26 PolarHBondContact O-N 2.89Å; A24-D27 PolarHBondContact O-N 3.44Å; A24-L28 VanDerWaalsContact O-CD1 3.27Å; A24-L28 WeakPolarHBondContact O-CD1 3.42Å; A24-L28 VanDerWaalsContact O-CG 3.28Å; A24-L28 WeakPolarHBondContact O-CG 3.41Å; A24-L28 PolarHBondContact O-N 3.39Å; A24-L28 VanDerWaalsContact O-N 3.08Å
25C84.3Confident79.9Confident8 Ų858.4 Ų58.45%0.05431%0.311CS..Hα-helixtrans-66.1-32.1177.8-76.10000112.3L21 E22 D23 L28 Q29 I65 L69L21-C25 VanDerWaalsContact O-CB 3.27Å; L21-C25 WeakPolarHBondContact O-CB 3.33Å; L21-C25 PolarHBondContact O-N 2.99Å; L21-C25 PolarHBondContact O-SG 3.25Å; E22-C25 PolarHBondContact O-N 3.35Å; D23-C25 PolarHBondContact O-N 2.83Å; C25-L28 PolarHBondContact O-N 2.85Å; C25-Q29 VanDerWaalsContact O-CB 3.24Å; C25-Q29 WeakPolarHBondContact O-CB 3.49Å; C25-Q29 PolarHBondContact O-N 3.45Å; C25-I65 HydrophobicContact CB-CG2 3.73Å; C25-L69 HydrophobicContact CB-CD2 4.34Å
26S83.1Confident80.2Confident75 Ų7562.2 Ų62.252%0.52433%0.33SS..Hα-helixtrans-66.7-41.9175.2-61.80000111.7E22 D23 A24 L28 Q29 R30E22-S26 VanDerWaalsContact O-CB 3.32Å; E22-S26 WeakPolarHBondContact O-CB 3.37Å; E22-S26 PolarHBondContact O-N 3.44Å; E22-S26 PolarHBondContact O-OG 3.04Å; D23-S26 WeakPolarHBondContact O-CB 3.28Å; D23-S26 PolarHBondContact O-N 3.34Å; A24-S26 VanDerWaalsContact C-N 3.31Å; A24-S26 PolarHBondContact O-N 2.89Å; S26-L28 VanDerWaalsContact C-N 3.33Å; S26-L28 PolarHBondContact O-N 3.22Å; S26-Q29 WeakPolarHBondContact O-CB 3.23Å; S26-Q29 PolarHBondContact O-N 2.97Å; S26-R30 PolarHBondContact O-N 3.5Å
27D80.8Confident80.6Confident103 Ų10361.8 Ų61.855%0.55133%0.334SS*.Hα-helixtrans-61.8-42.9174-79.6-25.2000111.8D23 A24 R30 T31D23-D27 PolarHBondContact O-N 3.04Å; A24-D27 PolarHBondContact O-N 3.44Å; D27-R30 PolarHBondContact O-N 2.97Å; D27-T31 PolarHBondContact O-N 2.87Å; D27-T31 PolarHBondContact O-OG1 2.97Å
28L81.1Confident80.6Confident31 Ų3164.9 Ų64.916%0.16236%0.357CS..Hα-helixtrans-69.1-34.8177.2-69.3158.5000112.3A24 C25 S26 R30 T31 F32 A46 I50 L69A24-L28 VanDerWaalsContact O-CD1 3.27Å; A24-L28 WeakPolarHBondContact O-CD1 3.42Å; A24-L28 VanDerWaalsContact O-CG 3.28Å; A24-L28 WeakPolarHBondContact O-CG 3.41Å; A24-L28 PolarHBondContact O-N 3.39Å; A24-L28 VanDerWaalsContact O-N 3.08Å; C25-L28 PolarHBondContact O-N 2.85Å; S26-L28 VanDerWaalsContact C-N 3.33Å; S26-L28 PolarHBondContact O-N 3.22Å; L28-R30 VanDerWaalsContact C-N 3.29Å; L28-R30 PolarHBondContact O-N 2.99Å; L28-T31 WeakPolarHBondContact O-CB 3.29Å; L28-T31 PolarHBondContact O-N 3.19Å; L28-F32 HydrophobicContact CB-CD2 3.96Å; L28-F32 HydrophobicContact CB-CE2 3.78Å; L28-F32 HydrophobicContact CD2-CE2 3.66Å; L28-F32 HydrophobicContact CD2-CZ 3.98Å; L28-F32 HydrophobicContact CG-CE2 4.25Å; L28-F32 VanDerWaalsContact O-CD2 3.23Å; L28-F32 WeakPolarHBondContact O-CD2 3.44Å; L28-F32 WeakPolarHBondContact O-CG 3.41Å; L28-F32 PolarHBondContact O-N 3.44Å; L28-A46 HydrophobicContact CD2-CB 4.37Å; L28-I50 HydrophobicContact CD1-CD1 3.23Å; L28-I50 HydrophobicContact CD1-CG1 4.09Å; L28-I50 HydrophobicContact CD2-CD1 4.05Å; L28-I50 HydrophobicContact CG-CD1 4.15Å; L28-L69 HydrophobicContact CB-CD1 4.25Å; L28-L69 HydrophobicContact CB-CD2 4.08Å; L28-L69 HydrophobicContact CD1-CD2 4.43Å
29Q83.6Confident80.7Confident30 Ų3065.8 Ų65.814%0.1436%0.361CS..Hα-helixtrans-60.5-40.4176.2-178.461.263.300111.1C25 S26 T31 F32 G33 L69 N72C25-Q29 VanDerWaalsContact O-CB 3.24Å; C25-Q29 WeakPolarHBondContact O-CB 3.49Å; C25-Q29 PolarHBondContact O-N 3.45Å; S26-Q29 WeakPolarHBondContact O-CB 3.23Å; S26-Q29 PolarHBondContact O-N 2.97Å; Q29-T31 PolarHBondContact O-N 3.09Å; Q29-F32 PolarHBondContact O-N 3.41Å; Q29-G33 VanDerWaalsContact O-CA 3.31Å; Q29-G33 WeakPolarHBondContact O-CA 3.49Å; Q29-G33 PolarHBondContact O-N 3.44Å; Q29-L69 VanDerWaalsContact CA-CD1 3.49Å; Q29-L69 HydrophobicContact CB-CD1 3.79Å; Q29-N72 VanDerWaalsContact NE2-CB 3.28Å; Q29-N72 VanDerWaalsContact OE1-CB 3.24Å; Q29-N72 PolarHBondContact OE1-ND2 3.03Å
30R80.6Confident80.7Confident163 Ų16367.1 Ų67.162%0.61536%0.363SS*.Iπ-helixtrans-61.9-34.9174.6-171.8175.160.9120.80.1112S26 D27 L28 S35S26-R30 PolarHBondContact O-N 3.5Å; D27-R30 PolarHBondContact O-N 2.97Å; L28-R30 VanDerWaalsContact C-N 3.29Å; L28-R30 PolarHBondContact O-N 2.99Å; R30-S35 WeakPolarHBondContact O-CB 3.2Å; R30-S35 PolarHBondContact O-N 3.32Å
31T80.1Confident80.8Confident40 Ų4069.8 Ų69.825%0.24538%0.382CS..Iπ-helixtrans-77.4-45.2178.3-57.80000112.6D27 L28 Q29 L39 D43 K77D27-T31 PolarHBondContact O-N 2.87Å; D27-T31 PolarHBondContact O-OG1 2.97Å; L28-T31 WeakPolarHBondContact O-CB 3.29Å; L28-T31 PolarHBondContact O-N 3.19Å; Q29-T31 PolarHBondContact O-N 3.09Å; T31-L39 HydrophobicContact CG2-CD2 4.17Å; T31-D43 HydrophobicContact CG2-CB 4.4Å; T31-K77 PolarHBondContact O-NZ 3.35Å
32F78.8Confident80.7Confident2 Ų271.8 Ų71.81%0.00940%0.403CS..Iπ-helixtrans-87.6-28.5-174.7-60.3-45.7000114.1L28 Q29 L39 D43 F47 I50 L69 T76 K77 I80L28-F32 HydrophobicContact CB-CD2 3.96Å; L28-F32 HydrophobicContact CB-CE2 3.78Å; L28-F32 HydrophobicContact CD2-CE2 3.66Å; L28-F32 HydrophobicContact CD2-CZ 3.98Å; L28-F32 HydrophobicContact CG-CE2 4.25Å; L28-F32 VanDerWaalsContact O-CD2 3.23Å; L28-F32 WeakPolarHBondContact O-CD2 3.44Å; L28-F32 WeakPolarHBondContact O-CG 3.41Å; L28-F32 PolarHBondContact O-N 3.44Å; Q29-F32 PolarHBondContact O-N 3.41Å; F32-L39 HydrophobicContact CD1-CD1 4.2Å; F32-L39 HydrophobicContact CD1-CD2 3.71Å; F32-L39 HydrophobicContact CE1-CD2 4.16Å; F32-D43 HydrophobicContact CE1-CB 3.99Å; F32-D43 WeakPolarHBondContact CZ-O 3.4Å; F32-F47 HydrophobicContact CD2-CD2 4.15Å; F32-F47 HydrophobicContact CE1-CB 4.19Å; F32-F47 HydrophobicContact CE1-CD2 4.33Å; F32-F47 HydrophobicContact CE2-CB 4.37Å; F32-F47 AromaticContact CE2-CD2 3.77Å; F32-F47 HydrophobicContact CE2-CD2 3.77Å; F32-F47 HydrophobicContact CZ-CB 3.74Å; F32-F47 AromaticContact CZ-CD2 3.9Å; F32-F47 HydrophobicContact CZ-CD2 3.9Å; F32-F47 HydrophobicContact CZ-CG 4.31Å; F32-I50 HydrophobicContact CE2-CD1 4.22Å; F32-L69 HydrophobicContact CD2-CD1 4.14Å; F32-T76 PolarHBondContact O-OG1 2.88Å; F32-K77 WeakPolarHBondContact O-CD 3.43Å; F32-K77 VanDerWaalsContact O-CE 3.23Å; F32-K77 WeakPolarHBondContact O-CE 3.38Å; F32-K77 VanDerWaalsContact O-CG 3.24Å; F32-K77 WeakPolarHBondContact O-CG 3.45Å; F32-I80 HydrophobicContact CD1-CD1 3.76Å; F32-I80 HydrophobicContact CE1-CD1 4.23Å; F32-I80 HydrophobicContact CG-CD1 4.21Å
33G71.3Confident80.7Confident9 Ų970 Ų709%0.09340%0.396CS..Iπ-helixtrans-99.4-56.1-175.700000114.3Q29 T76Q29-G33 VanDerWaalsContact O-CA 3.31Å; Q29-G33 WeakPolarHBondContact O-CA 3.49Å; Q29-G33 PolarHBondContact O-N 3.44Å; G33-T76 WeakPolarHBondContact CA-OG1 3.29Å; G33-T76 WeakPolarHBondContact O-CB 3.31Å; G33-T76 PolarHBondContact O-OG1 3.28Å
34D73.6Confident80.8Confident121 Ų12167.1 Ų67.165%0.64738%0.379SS*.Iπ-helixtrans-97.7-18-161.2-55.4-26.4000113.5
35S73Confident81Confident40 Ų4070.9 Ų70.928%0.2839%0.394SS..  trans-85.3124.8-173.9-176.50000112.5R30 V37 K77R30-S35 WeakPolarHBondContact O-CB 3.2Å; R30-S35 PolarHBondContact O-N 3.32Å; S35-V37 PolarHBondContact O-N 2.99Å; S35-V37 VanDerWaalsContact OG-CB 3.24Å; S35-V37 WeakPolarHBondContact OG-CB 3.39Å; S35-V37 VanDerWaalsContact OG-CG2 3.32Å; S35-V37 WeakPolarHBondContact OG-CG2 3.4Å; S35-V37 PolarHBondContact OG-N 3.46Å; S35-V37 VanDerWaalsContact OG-N 3.14Å; S35-K77 WeakPolarHBondContact O-CE 3.46Å; S35-K77 PolarHBondContact O-NZ 2.92Å
36I76.2Confident81Confident176 Ų17671 Ų7190%0.90340%0.395SS*.  trans-67.3-14.7169.3-56.5169000111
37V80.6Confident81.2Confident94 Ų9467.4 Ų67.457%0.5737%0.37SS*.SBendtrans-66.6133.5-179-174.10000110.2S35 K77S35-V37 PolarHBondContact O-N 2.99Å; S35-V37 VanDerWaalsContact OG-CB 3.24Å; S35-V37 WeakPolarHBondContact OG-CB 3.39Å; S35-V37 VanDerWaalsContact OG-CG2 3.32Å; S35-V37 WeakPolarHBondContact OG-CG2 3.4Å; S35-V37 PolarHBondContact OG-N 3.46Å; S35-V37 VanDerWaalsContact OG-N 3.14Å; V37-K77 PolarHBondContact O-NZ 3.18Å
38P82.2Confident81.6Confident111 Ų11164.4 Ų64.472%0.72135%0.354SS*.PPolyproline II helixtrans-55.3140.2171.9-25.234.4000111.8
39L83.5Confident82Confident29 Ų2964.7 Ų64.715%0.15236%0.355CS..PPolyproline II helixtrans-68.6134.8175.9-62.1176.8000110.2T31 F32 D43 F44 K77 A79 I80T31-L39 HydrophobicContact CG2-CD2 4.17Å; F32-L39 HydrophobicContact CD1-CD1 4.2Å; F32-L39 HydrophobicContact CD1-CD2 3.71Å; F32-L39 HydrophobicContact CE1-CD2 4.16Å; L39-D43 HydrophobicContact CB-CB 4.29Å; L39-D43 HydrophobicContact CD2-CB 4.19Å; L39-F44 HydrophobicContact CB-CD2 4.38Å; L39-F44 HydrophobicContact CB-CE1 4.21Å; L39-F44 HydrophobicContact CB-CE2 3.76Å; L39-F44 HydrophobicContact CB-CZ 3.66Å; L39-F44 HydrophobicContact CD1-CD1 4.48Å; L39-F44 HydrophobicContact CD1-CE1 3.73Å; L39-F44 HydrophobicContact CD1-CZ 3.87Å; L39-F44 HydrophobicContact CG-CZ 4.4Å; L39-K77 HydrophobicContact CD1-CD 3.96Å; L39-K77 HydrophobicContact CD2-CD 4.13Å; L39-K77 HydrophobicContact CG-CD 4.01Å; L39-A79 HydrophobicContact CD1-CB 4.48Å; L39-I80 HydrophobicContact CD1-CD1 3.65Å; L39-I80 HydrophobicContact CD1-CG1 4.08Å
40T85.2Confident82.3Confident77 Ų7763.3 Ų63.347%0.47235%0.349SS..PPolyproline II helixtrans-85.7166.7175.870.40000111.2G42 D43 F44T40-G42 PolarHBondContact O-N 3.1Å; T40-G42 PolarHBondContact OG1-N 3.18Å; T40-D43 WeakPolarHBondContact CB-OD2 3.36Å; T40-D43 WeakPolarHBondContact CG2-OD2 3.22Å; T40-D43 PolarHBondContact N-OD2 3.2Å; T40-D43 WeakPolarHBondContact O-CB 3.47Å; T40-D43 PolarHBondContact O-N 3.03Å; T40-D43 VanDerWaalsContact O-N 3.12Å; T40-D43 PolarHBondContact OG1-N 3.27Å; T40-D43 PolarHBondContact OG1-OD2 2.88Å; T40-F44 WeakPolarHBondContact O-CD2 3.26Å; T40-F44 PolarHBondContact O-N 2.72Å; T40-F44 VanDerWaalsContact O-N 3.13Å
41L82.8Confident83Confident155 Ų15555.6 Ų55.681%0.81232%0.32SS*.Hα-helixtrans-58.1-35.1172.5-175.565.6000112.1F44 H45L41-F44 PolarHBondContact O-N 2.76Å; L41-H45 PolarHBondContact O-N 3.26Å
42G83.8Confident83.5Confident46 Ų4656.7 Ų56.747%0.47432%0.324SS..Hα-helixtrans-65.5-39.9175.700000112.3T40 F44 H45 A46T40-G42 PolarHBondContact O-N 3.1Å; T40-G42 PolarHBondContact OG1-N 3.18Å; G42-F44 VanDerWaalsContact C-N 3.33Å; G42-F44 PolarHBondContact O-N 3.38Å; G42-H45 PolarHBondContact O-N 2.91Å; G42-A46 WeakPolarHBondContact O-CB 3.41Å; G42-A46 PolarHBondContact O-N 3.18Å
43D84.2Confident84.1Confident39 Ų3956.7 Ų56.721%0.20932%0.324CS..Hα-helixtrans-63.9-40.6176.6-58.2-45.2000111.3T31 F32 L39 T40 A46 F47T31-D43 HydrophobicContact CG2-CB 4.4Å; F32-D43 HydrophobicContact CE1-CB 3.99Å; F32-D43 WeakPolarHBondContact CZ-O 3.4Å; L39-D43 HydrophobicContact CB-CB 4.29Å; L39-D43 HydrophobicContact CD2-CB 4.19Å; T40-D43 WeakPolarHBondContact CB-OD2 3.36Å; T40-D43 WeakPolarHBondContact CG2-OD2 3.22Å; T40-D43 PolarHBondContact N-OD2 3.2Å; T40-D43 WeakPolarHBondContact O-CB 3.47Å; T40-D43 PolarHBondContact O-N 3.03Å; T40-D43 VanDerWaalsContact O-N 3.12Å; T40-D43 PolarHBondContact OG1-N 3.27Å; T40-D43 PolarHBondContact OG1-OD2 2.88Å; D43-A46 PolarHBondContact O-N 3.23Å; D43-F47 WeakPolarHBondContact O-CB 3.41Å; D43-F47 PolarHBondContact O-N 3.35Å
44F86Confident85.2Confident48 Ų4856.2 Ų56.221%0.21132%0.32CS..Hα-helixtrans-66.4-39.9174.5-72.9-57.5000112.5L39 T40 L41 G42 F47 D48 A79 R83L39-F44 HydrophobicContact CB-CD2 4.38Å; L39-F44 HydrophobicContact CB-CE1 4.21Å; L39-F44 HydrophobicContact CB-CE2 3.76Å; L39-F44 HydrophobicContact CB-CZ 3.66Å; L39-F44 HydrophobicContact CD1-CD1 4.48Å; L39-F44 HydrophobicContact CD1-CE1 3.73Å; L39-F44 HydrophobicContact CD1-CZ 3.87Å; L39-F44 HydrophobicContact CG-CZ 4.4Å; T40-F44 WeakPolarHBondContact O-CD2 3.26Å; T40-F44 PolarHBondContact O-N 2.72Å; T40-F44 VanDerWaalsContact O-N 3.13Å; L41-F44 PolarHBondContact O-N 2.76Å; G42-F44 VanDerWaalsContact C-N 3.33Å; G42-F44 PolarHBondContact O-N 3.38Å; F44-F47 WeakPolarHBondContact O-CB 3.48Å; F44-F47 PolarHBondContact O-N 2.91Å; F44-D48 PolarHBondContact O-N 2.87Å; F44-A79 HydrophobicContact CE1-CB 4.08Å; F44-A79 HydrophobicContact CZ-CB 3.96Å; F44-R83 PolarHBondContact O-NH1 3.3Å
45H86.3Confident86.2Confident92 Ų9251.7 Ų51.743%0.42630%0.295SS..Hα-helixtrans-62-47.3175-174.254.3000111.7D3 L41 G42 F47 D48 L49D3-H45 IonicContact OD2-CD2 3.56Å; D3-H45 PolarHBondContact OD2-CD2 2.92Å; D3-H45 VanDerWaalsContact OD2-CD2 3.22Å; D3-H45 IonicContact OD2-NE2 2.67Å; D3-H45 PolarHBondContact OD2-NE2 3.22Å; L41-H45 PolarHBondContact O-N 3.26Å; G42-H45 PolarHBondContact O-N 2.91Å; H45-F47 VanDerWaalsContact C-N 3.27Å; H45-F47 PolarHBondContact O-N 3.39Å; H45-D48 PolarHBondContact O-N 2.72Å; H45-L49 WeakPolarHBondContact O-CG 3.29Å; H45-L49 PolarHBondContact O-N 3.48Å; H45-L49 VanDerWaalsContact O-N 3.1Å
46A84.2Confident87.1Confident9 Ų953 Ų537%0.07430%0.302CS..Hα-helixtrans-56.7-43.1173.900000111.4V5 L28 G42 D43 L49 I50V5-A46 HydrophobicContact CG1-CB 3.83Å; V5-A46 HydrophobicContact CG2-CB 4.38Å; L28-A46 HydrophobicContact CD2-CB 4.37Å; G42-A46 WeakPolarHBondContact O-CB 3.41Å; G42-A46 PolarHBondContact O-N 3.18Å; D43-A46 PolarHBondContact O-N 3.23Å; A46-L49 PolarHBondContact O-N 3.4Å; A46-I50 VanDerWaalsContact O-CD1 3.27Å; A46-I50 WeakPolarHBondContact O-CD1 3.4Å; A46-I50 VanDerWaalsContact O-CG1 3.27Å; A46-I50 WeakPolarHBondContact O-CG1 3.42Å; A46-I50 PolarHBondContact O-N 2.73Å; A46-I50 VanDerWaalsContact O-N 3.09Å
47F87.3Confident87.8Confident1 Ų145 Ų450%0.00426%0.26CS..Hα-helixtrans-59.5-46.4176.3-170.2-96.2000113F32 D43 F44 H45 L49 I50 V51 F70 I80 R83 L84F32-F47 HydrophobicContact CD2-CD2 4.15Å; F32-F47 HydrophobicContact CE1-CB 4.19Å; F32-F47 HydrophobicContact CE1-CD2 4.33Å; F32-F47 HydrophobicContact CE2-CB 4.37Å; F32-F47 AromaticContact CE2-CD2 3.77Å; F32-F47 HydrophobicContact CE2-CD2 3.77Å; F32-F47 HydrophobicContact CZ-CB 3.74Å; F32-F47 AromaticContact CZ-CD2 3.9Å; F32-F47 HydrophobicContact CZ-CD2 3.9Å; F32-F47 HydrophobicContact CZ-CG 4.31Å; D43-F47 WeakPolarHBondContact O-CB 3.41Å; D43-F47 PolarHBondContact O-N 3.35Å; F44-F47 WeakPolarHBondContact O-CB 3.48Å; F44-F47 PolarHBondContact O-N 2.91Å; H45-F47 VanDerWaalsContact C-N 3.27Å; H45-F47 PolarHBondContact O-N 3.39Å; F47-L49 VanDerWaalsContact C-N 3.32Å; F47-L49 PolarHBondContact O-N 3.25Å; F47-I50 WeakPolarHBondContact O-CB 3.16Å; F47-I50 PolarHBondContact O-N 3.27Å; F47-I50 VanDerWaalsContact O-N 3.14Å; F47-V51 HydrophobicContact CD1-CG2 3.99Å; F47-V51 HydrophobicContact CE1-CG2 3.59Å; F47-V51 HydrophobicContact CZ-CG2 4.07Å; F47-V51 WeakPolarHBondContact O-CG2 3.37Å; F47-V51 PolarHBondContact O-N 3.32Å; F47-F70 HydrophobicContact CD2-CE1 4.44Å; F47-F70 AromaticContact CE2-CD1 3.67Å; F47-F70 HydrophobicContact CE2-CD1 3.67Å; F47-F70 AromaticContact CE2-CE1 3.61Å; F47-F70 HydrophobicContact CE2-CE1 3.61Å; F47-F70 AromaticContact CZ-CD1 3.8Å; F47-F70 HydrophobicContact CZ-CD1 3.8Å; F47-F70 AromaticContact CZ-CE1 3.72Å; F47-F70 HydrophobicContact CZ-CE1 3.72Å; F47-I80 HydrophobicContact CD2-CD1 3.9Å; F47-I80 HydrophobicContact CE1-CG2 4.37Å; F47-I80 HydrophobicContact CE2-CD1 4.02Å; F47-I80 HydrophobicContact CE2-CG2 3.68Å; F47-I80 HydrophobicContact CG-CD1 4.21Å; F47-I80 HydrophobicContact CZ-CD1 4.43Å; F47-I80 HydrophobicContact CZ-CG2 3.55Å; F47-R83 HydrophobicContact CD1-CB 4.32Å; F47-R83 HydrophobicContact CD1-CG 4.05Å; F47-R83 HydrophobicContact CE1-CB 4.11Å; F47-R83 HydrophobicContact CE1-CG 4.24Å; F47-L84 HydrophobicContact CE1-CD2 3.69Å; F47-L84 HydrophobicContact CE1-CG 3.89Å; F47-L84 HydrophobicContact CZ-CD1 4.07Å; F47-L84 HydrophobicContact CZ-CD2 3.67Å; F47-L84 HydrophobicContact CZ-CG 3.74Å
48D89.5Confident88.1Confident40 Ų4047.7 Ų47.721%0.21427%0.267CS..Hα-helixtrans-60.2-44177.1-71.5-35.1000112F44 H45 I50 V51 D52 R83F44-D48 PolarHBondContact O-N 2.87Å; H45-D48 PolarHBondContact O-N 2.72Å; D48-I50 PolarHBondContact O-N 3.04Å; D48-V51 WeakPolarHBondContact O-CB 3.45Å; D48-V51 PolarHBondContact O-N 2.94Å; D48-V51 VanDerWaalsContact O-N 3.07Å; D48-D52 PolarHBondContact O-N 3.18Å; D48-R83 VanDerWaalsContact CG-NH2 3.32Å; D48-R83 IonicContact OD1-CZ 3.7Å; D48-R83 IonicContact OD1-NE 2.94Å; D48-R83 IonicContact OD1-NH1 2.62Å; D48-R83 PolarHBondContact OD1-NH1 3.48Å; D48-R83 IonicContact OD1-NH2 3.88Å; D48-R83 PolarHBondContact OD1-NH2 3.43Å; D48-R83 IonicContact OD2-CZ 2.78Å; D48-R83 IonicContact OD2-NH1 3.95Å; D48-R83 PolarHBondContact OD2-NH1 3.28Å; D48-R83 IonicContact OD2-NH2 3.37Å; D48-R83 PolarHBondContact OD2-NH2 2.96Å
49L89.3Confident88.4Confident36 Ų3644 Ų4419%0.18824%0.244CC..Hα-helixtrans-62.5-32.4179.3-64.7170.9000111.4V5 A6 L9 H45 A46 F47 L53V5-L49 HydrophobicContact CB-CD1 4.47Å; V5-L49 HydrophobicContact CG1-CD1 4.14Å; A6-L49 HydrophobicContact CB-CD1 3.87Å; L9-L49 HydrophobicContact CD1-CB 3.19Å; L9-L49 HydrophobicContact CD1-CD1 4.19Å; L9-L49 HydrophobicContact CD1-CG 4.32Å; H45-L49 WeakPolarHBondContact O-CG 3.29Å; H45-L49 PolarHBondContact O-N 3.48Å; H45-L49 VanDerWaalsContact O-N 3.1Å; A46-L49 PolarHBondContact O-N 3.4Å; F47-L49 VanDerWaalsContact C-N 3.32Å; F47-L49 PolarHBondContact O-N 3.25Å; L49-L53 VanDerWaalsContact O-CB 3.29Å; L49-L53 WeakPolarHBondContact O-CB 3.37Å; L49-L53 PolarHBondContact O-N 2.8Å
50I90.4Very high88.9Confident2 Ų246.2 Ų46.21%0.0125%0.254CS..Hα-helixtrans-71.1-38.7173.6-63.9152.7000111.4L9 L28 F32 A46 F47 D48 L53 F54 I66 L69 F70L9-I50 HydrophobicContact CD1-CG1 4.2Å; L9-I50 HydrophobicContact CD2-CG1 4.05Å; L28-I50 HydrophobicContact CD1-CD1 3.23Å; L28-I50 HydrophobicContact CD1-CG1 4.09Å; L28-I50 HydrophobicContact CD2-CD1 4.05Å; L28-I50 HydrophobicContact CG-CD1 4.15Å; F32-I50 HydrophobicContact CE2-CD1 4.22Å; A46-I50 VanDerWaalsContact O-CD1 3.27Å; A46-I50 WeakPolarHBondContact O-CD1 3.4Å; A46-I50 VanDerWaalsContact O-CG1 3.27Å; A46-I50 WeakPolarHBondContact O-CG1 3.42Å; A46-I50 PolarHBondContact O-N 2.73Å; A46-I50 VanDerWaalsContact O-N 3.09Å; F47-I50 WeakPolarHBondContact O-CB 3.16Å; F47-I50 PolarHBondContact O-N 3.27Å; F47-I50 VanDerWaalsContact O-N 3.14Å; D48-I50 PolarHBondContact O-N 3.04Å; I50-L53 WeakPolarHBondContact O-CB 3.37Å; I50-L53 PolarHBondContact O-N 3.38Å; I50-F54 WeakPolarHBondContact O-CB 3.46Å; I50-F54 PolarHBondContact O-N 3.27Å; I50-I66 HydrophobicContact CG2-CD1 4.42Å; I50-I66 HydrophobicContact CG2-CG1 4.3Å; I50-I66 HydrophobicContact CG2-CG2 3.49Å; I50-I66 VanDerWaalsContact CG2-CG2 3.49Å; I50-L69 HydrophobicContact CD1-CD2 4.33Å; I50-L69 HydrophobicContact CG2-CD2 4.34Å; I50-F70 HydrophobicContact CG2-CE1 3.83Å; I50-F70 HydrophobicContact CG2-CZ 3.94Å
51V93.8Very high89.1Confident1 Ų149.6 Ų49.61%0.00626%0.258CS..Hα-helixtrans-62.5-45173.21760000110.3F47 D48 F54 L55 F70 L84 F90F47-V51 HydrophobicContact CD1-CG2 3.99Å; F47-V51 HydrophobicContact CE1-CG2 3.59Å; F47-V51 HydrophobicContact CZ-CG2 4.07Å; F47-V51 WeakPolarHBondContact O-CG2 3.37Å; F47-V51 PolarHBondContact O-N 3.32Å; D48-V51 WeakPolarHBondContact O-CB 3.45Å; D48-V51 PolarHBondContact O-N 2.94Å; D48-V51 VanDerWaalsContact O-N 3.07Å; V51-F54 WeakPolarHBondContact O-CB 3.47Å; V51-F54 PolarHBondContact O-N 2.96Å; V51-L55 HydrophobicContact CG1-CD1 4.19Å; V51-L55 VanDerWaalsContact O-CG 3.31Å; V51-L55 WeakPolarHBondContact O-CG 3.16Å; V51-L55 PolarHBondContact O-N 3.26Å; V51-F70 HydrophobicContact CB-CZ 4.38Å; V51-F70 HydrophobicContact CG2-CE1 4.09Å; V51-F70 HydrophobicContact CG2-CE2 4.43Å; V51-F70 HydrophobicContact CG2-CZ 3.66Å; V51-L84 HydrophobicContact CG2-CD2 3.63Å; V51-F90 HydrophobicContact CG1-CB 4.1Å; V51-F90 HydrophobicContact CG1-CD2 4.12Å; V51-F90 HydrophobicContact CG1-CG 4.34Å
52D92.1Very high89.5Confident63 Ų6342.4 Ų42.434%0.33722%0.22SC..Hα-helixtrans-64.1-41175.5-78-24.5000111.9D48 L55 T56D48-D52 PolarHBondContact O-N 3.18Å; D52-L55 PolarHBondContact O-N 2.86Å; D52-T56 WeakPolarHBondContact O-CG2 3.47Å; D52-T56 PolarHBondContact O-N 3.31Å; D52-T56 PolarHBondContact O-OG1 3.23Å
53L91Very high90Very high1 Ų140.7 Ų40.71%0.00520%0.199CC..Hα-helixtrans-56.5-53.5172.2173.162.5000110.4L9 K13 L21 L49 I50 L55 T56 L57 I66L9-L53 HydrophobicContact CB-CD2 4.5Å; L9-L53 HydrophobicContact CD2-CB 4.49Å; L9-L53 HydrophobicContact CD2-CD2 3.44Å; L9-L53 VanDerWaalsContact CD2-CD2 3.44Å; K13-L53 HydrophobicContact CB-CD1 4.41Å; K13-L53 HydrophobicContact CD-CD1 4.02Å; K13-L53 HydrophobicContact CG-CD1 3.21Å; L21-L53 HydrophobicContact CD1-CD2 4.04Å; L49-L53 VanDerWaalsContact O-CB 3.29Å; L49-L53 WeakPolarHBondContact O-CB 3.37Å; L49-L53 PolarHBondContact O-N 2.8Å; I50-L53 WeakPolarHBondContact O-CB 3.37Å; I50-L53 PolarHBondContact O-N 3.38Å; L53-L55 VanDerWaalsContact C-N 3.28Å; L53-L55 PolarHBondContact O-N 3.08Å; L53-T56 PolarHBondContact O-N 2.75Å; L53-T56 PolarHBondContact O-OG1 3.27Å; L53-L57 HydrophobicContact CD1-CD1 3.88Å; L53-L57 HydrophobicContact CD1-CD2 4.02Å; L53-L57 HydrophobicContact CD1-CG 3.77Å; L53-L57 HydrophobicContact CD2-CD1 4.31Å; L53-L57 HydrophobicContact CG-CD1 3.7Å; L53-L57 HydrophobicContact CG-CG 4.09Å; L53-L57 WeakPolarHBondContact O-CG 3.34Å; L53-L57 PolarHBondContact O-N 3.25Å; L53-I66 HydrophobicContact CD2-CD1 3.89Å; L53-I66 HydrophobicContact CG-CD1 3.96Å
54F94.1Very high90.5Very high0 Ų040.2 Ų40.20%020%0.199CC..Hα-helixtrans-52.1-46.5179.1174.3-101.9000112.6I50 V51 T56 L57 R63 I66 L67 F70 F90 E93 Y109I50-F54 WeakPolarHBondContact O-CB 3.46Å; I50-F54 PolarHBondContact O-N 3.27Å; V51-F54 WeakPolarHBondContact O-CB 3.47Å; V51-F54 PolarHBondContact O-N 2.96Å; F54-T56 PolarHBondContact O-N 3.47Å; F54-L57 PolarHBondContact O-N 3.03Å; F54-R63 HydrophobicContact CD2-CB 4.26Å; F54-R63 HydrophobicContact CD2-CG 4.17Å; F54-R63 HydrophobicContact CE2-CB 3.83Å; F54-R63 HydrophobicContact CE2-CG 3.99Å; F54-R63 PolarHBondContact O-NH1 3.36Å; F54-I66 HydrophobicContact CB-CD1 4.22Å; F54-I66 HydrophobicContact CB-CG2 3.92Å; F54-I66 HydrophobicContact CD2-CB 4.11Å; F54-I66 HydrophobicContact CD2-CG2 4.03Å; F54-I66 HydrophobicContact CG-CG2 4.27Å; F54-L67 HydrophobicContact CE2-CD1 4.07Å; F54-L67 HydrophobicContact CE2-CD2 3.89Å; F54-L67 HydrophobicContact CE2-CG 3.58Å; F54-L67 HydrophobicContact CZ-CD1 4.25Å; F54-L67 HydrophobicContact CZ-CD2 3.72Å; F54-L67 HydrophobicContact CZ-CG 3.9Å; F54-F70 HydrophobicContact CB-CE2 4.17Å; F54-F70 HydrophobicContact CB-CZ 4.38Å; F54-F70 HydrophobicContact CD1-CE2 4.23Å; F54-F70 HydrophobicContact CD2-CE2 4.47Å; F54-F70 HydrophobicContact CG-CE2 4.02Å; F54-F90 HydrophobicContact CD1-CD2 4.11Å; F54-F90 HydrophobicContact CD1-CE2 4.01Å; F54-F90 HydrophobicContact CE1-CD2 4.2Å; F54-F90 AromaticContact CE1-CE2 3.87Å; F54-F90 HydrophobicContact CE1-CE2 3.87Å; F54-E93 HydrophobicContact CE1-CG 4.44Å; F54-Y109 HydrophobicContact CE1-CE1 4.38Å; F54-Y109 AromaticContact CZ-CE1 3.62Å; F54-Y109 HydrophobicContact CZ-CE1 3.62Å
55L94.7Very high90.8Very high26 Ų2639 Ų3914%0.13620%0.195CC..Hα-helixtrans-66.8-22.4179.9-69.8173.4000113.5V51 D52 L53 R89 E93V51-L55 HydrophobicContact CG1-CD1 4.19Å; V51-L55 VanDerWaalsContact O-CG 3.31Å; V51-L55 WeakPolarHBondContact O-CG 3.16Å; V51-L55 PolarHBondContact O-N 3.26Å; D52-L55 PolarHBondContact O-N 2.86Å; L53-L55 VanDerWaalsContact C-N 3.28Å; L53-L55 PolarHBondContact O-N 3.08Å; L55-R89 HydrophobicContact CD1-CB 3.86Å; L55-E93 HydrophobicContact CD2-CB 3.78Å; L55-E93 HydrophobicContact CD2-CG 3.92Å
56T91.4Very high91.2Very high67 Ų6734.7 Ų34.741%0.41117%0.174SC..Hα-helixtrans-92.5-27.4178.157.70000114K13 D52 L53 F54 Q58K13-T56 WeakPolarHBondContact CE-OG1 3.47Å; D52-T56 WeakPolarHBondContact O-CG2 3.47Å; D52-T56 PolarHBondContact O-N 3.31Å; D52-T56 PolarHBondContact O-OG1 3.23Å; L53-T56 PolarHBondContact O-N 2.75Å; L53-T56 PolarHBondContact O-OG1 3.27Å; F54-T56 PolarHBondContact O-N 3.47Å; T56-Q58 PolarHBondContact O-NE2 3.25Å
57L90.6Very high91.8Very high7 Ų734.2 Ų34.24%0.03717%0.171CC..  trans-67.9137-176.7-74.1169.4000112L53 F54 L62 R63 I66L53-L57 HydrophobicContact CD1-CD1 3.88Å; L53-L57 HydrophobicContact CD1-CD2 4.02Å; L53-L57 HydrophobicContact CD1-CG 3.77Å; L53-L57 HydrophobicContact CD2-CD1 4.31Å; L53-L57 HydrophobicContact CG-CD1 3.7Å; L53-L57 HydrophobicContact CG-CG 4.09Å; L53-L57 WeakPolarHBondContact O-CG 3.34Å; L53-L57 PolarHBondContact O-N 3.25Å; F54-L57 PolarHBondContact O-N 3.03Å; L57-L62 HydrophobicContact CD1-CB 3.84Å; L57-L62 HydrophobicContact CD2-CB 4.34Å; L57-L62 HydrophobicContact CD2-CD1 3.8Å; L57-R63 HydrophobicContact CB-CG 3.98Å; L57-R63 WeakPolarHBondContact O-CD 3.41Å; L57-R63 PolarHBondContact O-NH1 3.15Å; L57-I66 HydrophobicContact CD1-CD1 3.59Å
58Q87.5Confident92.1Very high151 Ų15137 Ų3771%0.70619%0.188SC*.  trans-97.1-29.8172.6-58.8-54.9-52.200112.3T56 H60T56-Q58 PolarHBondContact O-NE2 3.25Å; Q58-H60 PolarHBondContact O-N 3.3Å
59S89.6Confident92.3Very high35 Ų3535.3 Ų35.325%0.24518%0.179CC..  trans-64.6116.9-178.51760000112.3R61 L62 R63S59-R61 PolarHBondContact O-N 2.75Å; S59-R61 PolarHBondContact OG-N 2.94Å; S59-L62 PolarHBondContact O-N 2.68Å; S59-L62 PolarHBondContact OG-N 2.93Å; S59-R63 WeakPolarHBondContact O-CB 3.41Å; S59-R63 VanDerWaalsContact O-CG 3.3Å; S59-R63 WeakPolarHBondContact O-CG 3.47Å; S59-R63 PolarHBondContact O-N 3.23Å
60H92.2Very high92.6Very high75 Ų7533.6 Ų33.635%0.34717%0.17SC..Hα-helixtrans-57.1-36.1174.1-69.4-66.5000112.5Q58 R63 S64 D103 P104 I105Q58-H60 PolarHBondContact O-N 3.3Å; H60-R63 PolarHBondContact O-N 3.49Å; H60-S64 WeakPolarHBondContact O-CB 3.35Å; H60-S64 PolarHBondContact O-N 3.1Å; H60-S64 PolarHBondContact O-OG 2.85Å; H60-D103 IonicContact CE1-OD1 3.46Å; H60-D103 IonicContact CE1-OD2 2.68Å; H60-D103 IonicContact ND1-OD1 2.69Å; H60-P104 HydrophobicContact CB-CG 4.33Å; H60-I105 HydrophobicContact CB-CD1 4.34Å; H60-I105 HydrophobicContact CB-CG2 4.25Å
61R90.8Very high92.8Very high148 Ų14834.5 Ų34.556%0.55818%0.175SC*.Hα-helixtrans-63.7-46.1178-178.9178.9175.7-174.1-3.7111.7A18 E22 S59 S64 I65A18-R61 HydrophobicContact CB-CG 4.39Å; A18-R61 VanDerWaalsContact CB-NE 3.34Å; E22-R61 IonicContact OE1-NE 3.6Å; E22-R61 IonicContact OE1-NH2 3.59Å; E22-R61 PolarHBondContact OE1-NH2 3.37Å; S59-R61 PolarHBondContact O-N 2.75Å; S59-R61 PolarHBondContact OG-N 2.94Å; R61-S64 PolarHBondContact O-N 2.89Å; R61-S64 PolarHBondContact O-OG 3.26Å; R61-I65 WeakPolarHBondContact O-CD1 3.5Å; R61-I65 WeakPolarHBondContact O-CG1 3.49Å; R61-I65 PolarHBondContact O-N 3.21Å
62L90.8Very high92.7Very high4 Ų437.6 Ų37.62%0.02119%0.192CC..Hα-helixtrans-68.6-40.3179-60.1180000111.1E16 A18 L21 L57 S59 S64 I65 I66E16-L62 HydrophobicContact CB-CD1 3.78Å; E16-L62 HydrophobicContact CG-CD1 4.03Å; A18-L62 VanDerWaalsContact CA-CD2 3.43Å; A18-L62 HydrophobicContact CB-CD2 3.67Å; L21-L62 HydrophobicContact CB-CD2 4.32Å; L21-L62 HydrophobicContact CD2-CB 3.67Å; L21-L62 HydrophobicContact CD2-CD2 3.61Å; L21-L62 HydrophobicContact CD2-CG 4.16Å; L57-L62 HydrophobicContact CD1-CB 3.84Å; L57-L62 HydrophobicContact CD2-CB 4.34Å; L57-L62 HydrophobicContact CD2-CD1 3.8Å; S59-L62 PolarHBondContact O-N 2.68Å; S59-L62 PolarHBondContact OG-N 2.93Å; L62-S64 VanDerWaalsContact C-N 3.34Å; L62-S64 PolarHBondContact O-N 3.48Å; L62-I65 HydrophobicContact CD2-CD1 4.35Å; L62-I65 PolarHBondContact O-N 3.41Å; L62-I66 PolarHBondContact O-N 3.45Å
63R94.5Very high92.7Very high10 Ų1034.7 Ų34.74%0.03818%0.176CC..Hα-helixtrans-62.4-38174.8-70.6178.676.4110.8-4.4112.7F54 L57 S59 H60 I65 I66 L67 E93 I105 Y109F54-R63 HydrophobicContact CD2-CB 4.26Å; F54-R63 HydrophobicContact CD2-CG 4.17Å; F54-R63 HydrophobicContact CE2-CB 3.83Å; F54-R63 HydrophobicContact CE2-CG 3.99Å; F54-R63 PolarHBondContact O-NH1 3.36Å; L57-R63 HydrophobicContact CB-CG 3.98Å; L57-R63 WeakPolarHBondContact O-CD 3.41Å; L57-R63 PolarHBondContact O-NH1 3.15Å; S59-R63 WeakPolarHBondContact O-CB 3.41Å; S59-R63 VanDerWaalsContact O-CG 3.3Å; S59-R63 WeakPolarHBondContact O-CG 3.47Å; S59-R63 PolarHBondContact O-N 3.23Å; H60-R63 PolarHBondContact O-N 3.49Å; R63-I65 VanDerWaalsContact C-N 3.31Å; R63-I65 PolarHBondContact O-N 3Å; R63-I66 PolarHBondContact O-N 3.11Å; R63-L67 WeakPolarHBondContact O-CB 3.33Å; R63-L67 WeakPolarHBondContact O-CG 3.12Å; R63-L67 PolarHBondContact O-N 3.28Å; R63-E93 IonicContact CZ-OE1 3.31Å; R63-E93 IonicContact NH1-OE1 3.47Å; R63-E93 IonicContact NH2-OE1 3.22Å; R63-E93 PolarHBondContact NH2-OE1 3.29Å; R63-I105 HydrophobicContact CB-CD1 3.68Å; R63-Y109 VanDerWaalsContact CZ-OH 3.24Å; R63-Y109 PolarHBondContact NE-OH 2.96Å; R63-Y109 PolarHBondContact NH2-OH 3.36Å
64S95.2Very high92.8Very high29 Ų2934.6 Ų34.620%0.20318%0.176CC..Hα-helixtrans-65.8-34.5178.456.50000112.9H60 R61 L62 T68H60-S64 WeakPolarHBondContact O-CB 3.35Å; H60-S64 PolarHBondContact O-N 3.1Å; H60-S64 PolarHBondContact O-OG 2.85Å; R61-S64 PolarHBondContact O-N 2.89Å; R61-S64 PolarHBondContact O-OG 3.26Å; L62-S64 VanDerWaalsContact C-N 3.34Å; L62-S64 PolarHBondContact O-N 3.48Å; S64-T68 WeakPolarHBondContact O-CB 3.39Å; S64-T68 PolarHBondContact O-N 3.33Å; S64-T68 PolarHBondContact O-OG1 3.25Å
65I92.2Very high92.6Very high23 Ų2337.2 Ų37.212%0.11819%0.194CC..Hα-helixtrans-63.2-50.1175.7-64.8155.2000109.6A18 L21 E22 C25 R61 L62 R63 T68 L69A18-I65 HydrophobicContact CB-CD1 4.3Å; L21-I65 HydrophobicContact CD2-CB 4.34Å; L21-I65 HydrophobicContact CD2-CD1 4.21Å; L21-I65 HydrophobicContact CD2-CG2 4.45Å; L21-I65 HydrophobicContact CG-CG2 4.13Å; E22-I65 HydrophobicContact CG-CD1 3.47Å; E22-I65 VanDerWaalsContact CG-CD1 3.47Å; E22-I65 HydrophobicContact CG-CG1 3.76Å; E22-I65 HydrophobicContact CG-CG2 4.19Å; C25-I65 HydrophobicContact CB-CG2 3.73Å; R61-I65 WeakPolarHBondContact O-CD1 3.5Å; R61-I65 WeakPolarHBondContact O-CG1 3.49Å; R61-I65 PolarHBondContact O-N 3.21Å; L62-I65 HydrophobicContact CD2-CD1 4.35Å; L62-I65 PolarHBondContact O-N 3.41Å; R63-I65 VanDerWaalsContact C-N 3.31Å; R63-I65 PolarHBondContact O-N 3Å; I65-T68 WeakPolarHBondContact O-CB 3.38Å; I65-T68 PolarHBondContact O-N 3.03Å; I65-L69 PolarHBondContact O-N 3.34Å; I65-L69 VanDerWaalsContact O-N 3.17Å
66I94Very high92.2Very high0 Ų039.7 Ų39.70%021%0.211CC..Hα-helixtrans-68-38.8-179.9-60.7171.2000111.9L21 I50 L53 F54 L57 L62 R63 T68 L69 F70L21-I66 HydrophobicContact CD1-CD1 4.33Å; L21-I66 HydrophobicContact CD1-CG1 4.25Å; L21-I66 HydrophobicContact CD2-CD1 4.26Å; L21-I66 HydrophobicContact CD2-CG1 4.19Å; I50-I66 HydrophobicContact CG2-CD1 4.42Å; I50-I66 HydrophobicContact CG2-CG1 4.3Å; I50-I66 HydrophobicContact CG2-CG2 3.49Å; I50-I66 VanDerWaalsContact CG2-CG2 3.49Å; L53-I66 HydrophobicContact CD2-CD1 3.89Å; L53-I66 HydrophobicContact CG-CD1 3.96Å; F54-I66 HydrophobicContact CB-CD1 4.22Å; F54-I66 HydrophobicContact CB-CG2 3.92Å; F54-I66 HydrophobicContact CD2-CB 4.11Å; F54-I66 HydrophobicContact CD2-CG2 4.03Å; F54-I66 HydrophobicContact CG-CG2 4.27Å; L57-I66 HydrophobicContact CD1-CD1 3.59Å; L62-I66 PolarHBondContact O-N 3.45Å; R63-I66 PolarHBondContact O-N 3.11Å; I66-T68 VanDerWaalsContact C-N 3.28Å; I66-T68 PolarHBondContact O-N 3.43Å; I66-L69 WeakPolarHBondContact O-CB 3.23Å; I66-L69 PolarHBondContact O-N 2.87Å; I66-F70 HydrophobicContact CG2-CD1 4.29Å; I66-F70 HydrophobicContact CG2-CD2 4.1Å; I66-F70 HydrophobicContact CG2-CE1 3.73Å; I66-F70 HydrophobicContact CG2-CE2 3.52Å; I66-F70 HydrophobicContact CG2-CG 4.46Å; I66-F70 HydrophobicContact CG2-CZ 3.31Å; I66-F70 WeakPolarHBondContact O-CG 3.31Å; I66-F70 PolarHBondContact O-N 3.16Å
67L95.9Very high92.1Very high0 Ų037.9 Ų37.90%020%0.197CC..Hα-helixtrans-61.6-38.4174.9-79.4170.1000112F54 R63 L69 F70 V71 I105 L108 Y109 L112F54-L67 HydrophobicContact CE2-CD1 4.07Å; F54-L67 HydrophobicContact CE2-CD2 3.89Å; F54-L67 HydrophobicContact CE2-CG 3.58Å; F54-L67 HydrophobicContact CZ-CD1 4.25Å; F54-L67 HydrophobicContact CZ-CD2 3.72Å; F54-L67 HydrophobicContact CZ-CG 3.9Å; R63-L67 WeakPolarHBondContact O-CB 3.33Å; R63-L67 WeakPolarHBondContact O-CG 3.12Å; R63-L67 PolarHBondContact O-N 3.28Å; L67-L69 VanDerWaalsContact C-N 3.33Å; L67-F70 HydrophobicContact CD2-CD2 4.47Å; L67-F70 PolarHBondContact O-N 2.91Å; L67-V71 VanDerWaalsContact O-CG2 3.28Å; L67-V71 WeakPolarHBondContact O-CG2 3.25Å; L67-V71 PolarHBondContact O-N 3.35Å; L67-I105 HydrophobicContact CD1-CD1 3.96Å; L67-L108 HydrophobicContact CB-CB 4.14Å; L67-L108 HydrophobicContact CB-CD1 4.4Å; L67-L108 HydrophobicContact CD1-CB 3.96Å; L67-Y109 HydrophobicContact CD1-CD1 4.03Å; L67-Y109 HydrophobicContact CD1-CD2 4.12Å; L67-Y109 HydrophobicContact CD1-CE1 3.84Å; L67-Y109 HydrophobicContact CD1-CE2 3.96Å; L67-Y109 HydrophobicContact CD1-CG 4.17Å; L67-Y109 HydrophobicContact CD2-CD1 4Å; L67-Y109 HydrophobicContact CD2-CE1 4.07Å; L67-L112 HydrophobicContact CD2-CD2 3.65Å
68T94.5Very high92.2Very high60 Ų6041.4 Ų41.437%0.36822%0.216SC..Hα-helixtrans-62.7-43.6176.6-57.10000110.7S64 I65 I66 F70 V71 N72S64-T68 WeakPolarHBondContact O-CB 3.39Å; S64-T68 PolarHBondContact O-N 3.33Å; S64-T68 PolarHBondContact O-OG1 3.25Å; I65-T68 WeakPolarHBondContact O-CB 3.38Å; I65-T68 PolarHBondContact O-N 3.03Å; I66-T68 VanDerWaalsContact C-N 3.28Å; I66-T68 PolarHBondContact O-N 3.43Å; T68-F70 VanDerWaalsContact C-N 3.33Å; T68-F70 PolarHBondContact O-N 3.39Å; T68-V71 PolarHBondContact O-N 3.49Å; T68-N72 VanDerWaalsContact O-CG 3.3Å; T68-N72 PolarHBondContact O-N 2.91Å; T68-N72 PolarHBondContact O-ND2 3.16Å
69L92.7Very high92.3Very high4 Ų436 Ų362%0.02120%0.197CC..Hα-helixtrans-56.6-45.8172.117765.4000111.7C25 L28 Q29 F32 I50 I65 I66 L67 G73C25-L69 HydrophobicContact CB-CD2 4.34Å; L28-L69 HydrophobicContact CB-CD1 4.25Å; L28-L69 HydrophobicContact CB-CD2 4.08Å; L28-L69 HydrophobicContact CD1-CD2 4.43Å; Q29-L69 VanDerWaalsContact CA-CD1 3.49Å; Q29-L69 HydrophobicContact CB-CD1 3.79Å; F32-L69 HydrophobicContact CD2-CD1 4.14Å; I50-L69 HydrophobicContact CD1-CD2 4.33Å; I50-L69 HydrophobicContact CG2-CD2 4.34Å; I65-L69 PolarHBondContact O-N 3.34Å; I65-L69 VanDerWaalsContact O-N 3.17Å; I66-L69 WeakPolarHBondContact O-CB 3.23Å; I66-L69 PolarHBondContact O-N 2.87Å; L67-L69 VanDerWaalsContact C-N 3.33Å; L69-G73 PolarHBondContact O-N 3.38Å
70F95.4Very high92.4Very high0 Ų034.3 Ų34.30%019%0.186CC..Hα-helixtrans-65.2-44.5177.9-64.5-17.4000112.5F47 I50 V51 F54 I66 L67 T68 N72 G73 V74 L84 F90 L112F47-F70 HydrophobicContact CD2-CE1 4.44Å; F47-F70 AromaticContact CE2-CD1 3.67Å; F47-F70 HydrophobicContact CE2-CD1 3.67Å; F47-F70 AromaticContact CE2-CE1 3.61Å; F47-F70 HydrophobicContact CE2-CE1 3.61Å; F47-F70 AromaticContact CZ-CD1 3.8Å; F47-F70 HydrophobicContact CZ-CD1 3.8Å; F47-F70 AromaticContact CZ-CE1 3.72Å; F47-F70 HydrophobicContact CZ-CE1 3.72Å; I50-F70 HydrophobicContact CG2-CE1 3.83Å; I50-F70 HydrophobicContact CG2-CZ 3.94Å; V51-F70 HydrophobicContact CB-CZ 4.38Å; V51-F70 HydrophobicContact CG2-CE1 4.09Å; V51-F70 HydrophobicContact CG2-CE2 4.43Å; V51-F70 HydrophobicContact CG2-CZ 3.66Å; F54-F70 HydrophobicContact CB-CE2 4.17Å; F54-F70 HydrophobicContact CB-CZ 4.38Å; F54-F70 HydrophobicContact CD1-CE2 4.23Å; F54-F70 HydrophobicContact CD2-CE2 4.47Å; F54-F70 HydrophobicContact CG-CE2 4.02Å; I66-F70 HydrophobicContact CG2-CD1 4.29Å; I66-F70 HydrophobicContact CG2-CD2 4.1Å; I66-F70 HydrophobicContact CG2-CE1 3.73Å; I66-F70 HydrophobicContact CG2-CE2 3.52Å; I66-F70 HydrophobicContact CG2-CG 4.46Å; I66-F70 HydrophobicContact CG2-CZ 3.31Å; I66-F70 WeakPolarHBondContact O-CG 3.31Å; I66-F70 PolarHBondContact O-N 3.16Å; L67-F70 HydrophobicContact CD2-CD2 4.47Å; L67-F70 PolarHBondContact O-N 2.91Å; T68-F70 VanDerWaalsContact C-N 3.33Å; T68-F70 PolarHBondContact O-N 3.39Å; F70-N72 VanDerWaalsContact C-N 3.34Å; F70-N72 PolarHBondContact O-N 3.33Å; F70-G73 PolarHBondContact O-N 3.35Å; F70-V74 WeakPolarHBondContact O-CB 3.25Å; F70-V74 VanDerWaalsContact O-CG2 3.24Å; F70-V74 WeakPolarHBondContact O-CG2 3.27Å; F70-V74 PolarHBondContact O-N 2.92Å; F70-L84 HydrophobicContact CB-CD1 4.13Å; F70-L84 HydrophobicContact CE2-CD2 4.48Å; F70-L84 HydrophobicContact CG-CD1 4.2Å; F70-F90 AromaticContact CD2-CE2 3.9Å; F70-F90 HydrophobicContact CD2-CE2 3.9Å; F70-F90 HydrophobicContact CD2-CZ 4.18Å; F70-F90 HydrophobicContact CE2-CD2 4.48Å; F70-F90 AromaticContact CE2-CE2 3.79Å; F70-F90 HydrophobicContact CE2-CE2 3.79Å; F70-F90 HydrophobicContact CE2-CZ 4.48Å; F70-L112 HydrophobicContact CB-CD1 3.98Å; F70-L112 HydrophobicContact CB-CD2 3.66Å; F70-L112 HydrophobicContact CD2-CD2 4.07Å; F70-L112 HydrophobicContact CG-CD2 4.37Å
71V95.3Very high92.5Very high21 Ų2130.8 Ų30.813%0.12717%0.169CC..Hα-helixtrans-57.5-48.7178.5167.90000110.6L67 T68 S75 L112 N115L67-V71 VanDerWaalsContact O-CG2 3.28Å; L67-V71 WeakPolarHBondContact O-CG2 3.25Å; L67-V71 PolarHBondContact O-N 3.35Å; T68-V71 PolarHBondContact O-N 3.49Å; V71-S75 WeakPolarHBondContact O-CB 3.45Å; V71-S75 PolarHBondContact O-N 3.45Å; V71-S75 VanDerWaalsContact O-N 3.12Å; V71-S75 PolarHBondContact O-OG 3.05Å; V71-L112 HydrophobicContact CG2-CB 3.77Å; V71-L112 HydrophobicContact CG2-CD1 4.35Å; V71-N115 PolarHBondContact O-ND2 3.27Å
72N92.6Very high92.6Very high66 Ų6627.6 Ų27.635%0.35316%0.16SC..Hα-helixtrans-69.9-40.9-179.6-64.9-23.5000112Q29 T68 F70 S75 T76Q29-N72 VanDerWaalsContact NE2-CB 3.28Å; Q29-N72 VanDerWaalsContact OE1-CB 3.24Å; Q29-N72 PolarHBondContact OE1-ND2 3.03Å; T68-N72 VanDerWaalsContact O-CG 3.3Å; T68-N72 PolarHBondContact O-N 2.91Å; T68-N72 PolarHBondContact O-ND2 3.16Å; F70-N72 VanDerWaalsContact C-N 3.34Å; F70-N72 PolarHBondContact O-N 3.33Å; N72-S75 WeakPolarHBondContact O-CB 3.41Å; N72-S75 PolarHBondContact O-N 3.45Å; N72-T76 PolarHBondContact O-N 2.83Å; N72-T76 PolarHBondContact O-OG1 2.85Å
73G91.2Very high92.8Very high1 Ų131.2 Ų31.21%0.0117%0.174CC..Hα-helixtrans-62.6-45.5177.700000112.8L69 F70 S75 T76 K77L69-G73 PolarHBondContact O-N 3.38Å; F70-G73 PolarHBondContact O-N 3.35Å; G73-S75 VanDerWaalsContact C-N 3.26Å; G73-S75 PolarHBondContact O-N 3.33Å; G73-T76 PolarHBondContact O-N 2.87Å; G73-T76 PolarHBondContact O-OG1 3.04Å; G73-T76 VanDerWaalsContact O-OG1 3.1Å; G73-K77 PolarHBondContact O-N 2.72Å
74V93.1Very high92.9Very high0 Ų030.8 Ų30.80%017%0.172CC..Hα-helixtrans-65.8-30.3175.5173.70000111.8F70 T76 I80 A81 L84 L112 N115 L116 R118F70-V74 WeakPolarHBondContact O-CB 3.25Å; F70-V74 VanDerWaalsContact O-CG2 3.24Å; F70-V74 WeakPolarHBondContact O-CG2 3.27Å; F70-V74 PolarHBondContact O-N 2.92Å; V74-T76 PolarHBondContact O-N 2.9Å; V74-I80 HydrophobicContact CG2-CG2 3.99Å; V74-A81 HydrophobicContact CB-CB 4.47Å; V74-A81 HydrophobicContact CG1-CB 3.8Å; V74-A81 HydrophobicContact CG2-CB 4.32Å; V74-L84 HydrophobicContact CG2-CD1 3.67Å; V74-L112 HydrophobicContact CB-CD1 4.3Å; V74-L112 HydrophobicContact CG2-CD1 3.83Å; V74-N115 HydrophobicContact CB-CB 4.43Å; V74-N115 HydrophobicContact CG1-CB 3.69Å; V74-L116 HydrophobicContact CG1-CD2 3.85Å; V74-L116 HydrophobicContact CG1-CG 4.16Å; V74-L116 HydrophobicContact CG2-CD2 3.88Å; V74-L116 HydrophobicContact CG2-CG 4.38Å; V74-R118 PolarHBondContact O-NH2 2.88Å
75S89.8Confident92.9Very high55 Ų5529.4 Ų29.439%0.38516%0.163SC..Hα-helixtrans-68-24.1178.7-60.70000112.9V71 N72 G73 N115V71-S75 WeakPolarHBondContact O-CB 3.45Å; V71-S75 PolarHBondContact O-N 3.45Å; V71-S75 VanDerWaalsContact O-N 3.12Å; V71-S75 PolarHBondContact O-OG 3.05Å; N72-S75 WeakPolarHBondContact O-CB 3.41Å; N72-S75 PolarHBondContact O-N 3.45Å; G73-S75 VanDerWaalsContact C-N 3.26Å; G73-S75 PolarHBondContact O-N 3.33Å; S75-N115 PolarHBondContact OG-ND2 3.39Å
76T87.2Confident93.1Very high78 Ų7832 Ų3248%0.47918%0.177SC..Hα-helixtrans-117-31.8-16949.30000113.6F32 G33 N72 G73 V74F32-T76 PolarHBondContact O-OG1 2.88Å; G33-T76 WeakPolarHBondContact CA-OG1 3.29Å; G33-T76 WeakPolarHBondContact O-CB 3.31Å; G33-T76 PolarHBondContact O-OG1 3.28Å; N72-T76 PolarHBondContact O-N 2.83Å; N72-T76 PolarHBondContact O-OG1 2.85Å; G73-T76 PolarHBondContact O-N 2.87Å; G73-T76 PolarHBondContact O-OG1 3.04Å; G73-T76 VanDerWaalsContact O-OG1 3.1Å; V74-T76 PolarHBondContact O-N 2.9Å
77K88.6Confident93.2Very high28 Ų2833.7 Ų33.712%0.12219%0.186CC..  trans-128.6112.9-177.2-65.5-166.6-174.8-170.30112.3T31 F32 S35 V37 L39 G73 A79 I80 A81T31-K77 PolarHBondContact O-NZ 3.35Å; F32-K77 WeakPolarHBondContact O-CD 3.43Å; F32-K77 VanDerWaalsContact O-CE 3.23Å; F32-K77 WeakPolarHBondContact O-CE 3.38Å; F32-K77 VanDerWaalsContact O-CG 3.24Å; F32-K77 WeakPolarHBondContact O-CG 3.45Å; S35-K77 WeakPolarHBondContact O-CE 3.46Å; S35-K77 PolarHBondContact O-NZ 2.92Å; V37-K77 PolarHBondContact O-NZ 3.18Å; L39-K77 HydrophobicContact CD1-CD 3.96Å; L39-K77 HydrophobicContact CD2-CD 4.13Å; L39-K77 HydrophobicContact CG-CD 4.01Å; G73-K77 PolarHBondContact O-N 2.72Å; K77-A79 PolarHBondContact O-N 3.27Å; K77-I80 HydrophobicContact CB-CB 4.48Å; K77-I80 HydrophobicContact CB-CG1 3.95Å; K77-I80 WeakPolarHBondContact O-CB 3.43Å; K77-I80 PolarHBondContact O-N 2.94Å; K77-A81 PolarHBondContact O-N 2.65Å
78D92.1Very high93.2Very high81 Ų8139.1 Ų39.143%0.43321%0.211SC..Hα-helixtrans-56-34.4175.1-73.8-21000113.1I80 A81 E82 K119 W122D78-I80 PolarHBondContact O-N 2.78Å; D78-A81 WeakPolarHBondContact O-CB 3.26Å; D78-A81 PolarHBondContact O-N 3.15Å; D78-A81 VanDerWaalsContact O-N 3.13Å; D78-E82 WeakPolarHBondContact O-CB 3.35Å; D78-E82 PolarHBondContact O-N 3.29Å; D78-K119 WeakPolarHBondContact OD1-CE 3.48Å; D78-K119 IonicContact OD1-NZ 2.65Å; D78-K119 PolarHBondContact OD1-NZ 3.3Å; D78-K119 VanDerWaalsContact OD1-NZ 3.15Å; D78-K119 IonicContact OD2-NZ 3.76Å; D78-K119 PolarHBondContact OD2-NZ 2.91Å; D78-W122 HydrophobicContact CB-CZ2 3.94Å; D78-W122 VanDerWaalsContact OD1-CH2 3.22Å; D78-W122 WeakPolarHBondContact OD1-CH2 3.46Å; D78-W122 VanDerWaalsContact OD1-CZ2 3.27Å; D78-W122 WeakPolarHBondContact OD1-CZ2 3.32Å
79A90.9Very high93.3Very high38 Ų3843.6 Ų43.631%0.31422%0.221SC..Hα-helixtrans-61.4-31.717800000112.9L39 F44 K77 R83L39-A79 HydrophobicContact CD1-CB 4.48Å; F44-A79 HydrophobicContact CE1-CB 4.08Å; F44-A79 HydrophobicContact CZ-CB 3.96Å; K77-A79 PolarHBondContact O-N 3.27Å; A79-R83 WeakPolarHBondContact O-CB 3.2Å; A79-R83 PolarHBondContact O-N 2.96Å
80I91.7Very high93.5Very high0 Ų043.4 Ų43.40%022%0.221CC..Hα-helixtrans-72.3-43.7175.1-62.2-60000110.2F32 L39 F47 V74 K77 D78 E82 R83 L84F32-I80 HydrophobicContact CD1-CD1 3.76Å; F32-I80 HydrophobicContact CE1-CD1 4.23Å; F32-I80 HydrophobicContact CG-CD1 4.21Å; L39-I80 HydrophobicContact CD1-CD1 3.65Å; L39-I80 HydrophobicContact CD1-CG1 4.08Å; F47-I80 HydrophobicContact CD2-CD1 3.9Å; F47-I80 HydrophobicContact CE1-CG2 4.37Å; F47-I80 HydrophobicContact CE2-CD1 4.02Å; F47-I80 HydrophobicContact CE2-CG2 3.68Å; F47-I80 HydrophobicContact CG-CD1 4.21Å; F47-I80 HydrophobicContact CZ-CD1 4.43Å; F47-I80 HydrophobicContact CZ-CG2 3.55Å; V74-I80 HydrophobicContact CG2-CG2 3.99Å; K77-I80 HydrophobicContact CB-CB 4.48Å; K77-I80 HydrophobicContact CB-CG1 3.95Å; K77-I80 WeakPolarHBondContact O-CB 3.43Å; K77-I80 PolarHBondContact O-N 2.94Å; D78-I80 PolarHBondContact O-N 2.78Å; I80-E82 VanDerWaalsContact C-N 3.33Å; I80-E82 PolarHBondContact O-N 3.19Å; I80-R83 PolarHBondContact O-N 3.36Å; I80-L84 HydrophobicContact CG2-CD1 4.39Å; I80-L84 PolarHBondContact O-N 3.37Å
81A93.9Very high93.7Very high0 Ų043.4 Ų43.40%022%0.221CC..Hα-helixtrans-57.7-47.4175.200000111.4V74 K77 D78 R83 L84 A85 L116 W122V74-A81 HydrophobicContact CB-CB 4.47Å; V74-A81 HydrophobicContact CG1-CB 3.8Å; V74-A81 HydrophobicContact CG2-CB 4.32Å; K77-A81 PolarHBondContact O-N 2.65Å; D78-A81 WeakPolarHBondContact O-CB 3.26Å; D78-A81 PolarHBondContact O-N 3.15Å; D78-A81 VanDerWaalsContact O-N 3.13Å; A81-R83 PolarHBondContact O-N 2.81Å; A81-L84 PolarHBondContact O-N 3.27Å; A81-A85 VanDerWaalsContact O-CB 3.26Å; A81-A85 WeakPolarHBondContact O-CB 3.08Å; A81-A85 PolarHBondContact O-N 3.03Å; A81-L116 HydrophobicContact CB-CD2 3.99Å; A81-W122 HydrophobicContact CB-CD2 3.96Å; A81-W122 HydrophobicContact CB-CE3 4.02Å; A81-W122 HydrophobicContact CB-CH2 3.55Å; A81-W122 HydrophobicContact CB-CZ2 3.48Å; A81-W122 VanDerWaalsContact CB-CZ2 3.48Å; A81-W122 HydrophobicContact CB-CZ3 3.83Å
82E93.9Very high93.8Very high81 Ų8144.5 Ų44.538%0.37923%0.227SC..Hα-helixtrans-62.7-40.9178.1179.9168.8-15600112.2D78 I80 A85 N86 K125D78-E82 WeakPolarHBondContact O-CB 3.35Å; D78-E82 PolarHBondContact O-N 3.29Å; I80-E82 VanDerWaalsContact C-N 3.33Å; I80-E82 PolarHBondContact O-N 3.19Å; E82-A85 PolarHBondContact O-N 3.46Å; E82-N86 WeakPolarHBondContact CG-ND2 3.38Å; E82-N86 WeakPolarHBondContact O-CB 3.49Å; E82-N86 PolarHBondContact O-N 3.37Å; E82-N86 VanDerWaalsContact O-N 3.09Å; E82-N86 PolarHBondContact O-ND2 3.22Å; E82-K125 IonicContact OE1-NZ 2.7Å; E82-K125 PolarHBondContact OE1-NZ 3.02Å
83R93.6Very high94Very high81 Ų8143.2 Ų43.231%0.30622%0.219SC..Hα-helixtrans-60.5-47.9176.9-152.4100.3-157.7-81.2-1.3111.8F44 F47 D48 A79 I80 A81 N86 N87F44-R83 PolarHBondContact O-NH1 3.3Å; F47-R83 HydrophobicContact CD1-CB 4.32Å; F47-R83 HydrophobicContact CD1-CG 4.05Å; F47-R83 HydrophobicContact CE1-CB 4.11Å; F47-R83 HydrophobicContact CE1-CG 4.24Å; D48-R83 VanDerWaalsContact CG-NH2 3.32Å; D48-R83 IonicContact OD1-CZ 3.7Å; D48-R83 IonicContact OD1-NE 2.94Å; D48-R83 IonicContact OD1-NH1 2.62Å; D48-R83 PolarHBondContact OD1-NH1 3.48Å; D48-R83 IonicContact OD1-NH2 3.88Å; D48-R83 PolarHBondContact OD1-NH2 3.43Å; D48-R83 IonicContact OD2-CZ 2.78Å; D48-R83 IonicContact OD2-NH1 3.95Å; D48-R83 PolarHBondContact OD2-NH1 3.28Å; D48-R83 IonicContact OD2-NH2 3.37Å; D48-R83 PolarHBondContact OD2-NH2 2.96Å; A79-R83 WeakPolarHBondContact O-CB 3.2Å; A79-R83 PolarHBondContact O-N 2.96Å; I80-R83 PolarHBondContact O-N 3.36Å; A81-R83 PolarHBondContact O-N 2.81Å; R83-N86 PolarHBondContact O-N 2.85Å; R83-N87 PolarHBondContact O-N 2.91Å
84L96.6Very high94.3Very high0 Ų043.1 Ų43.10%022%0.218CC..Hα-helixtrans-66.9-43.5179.4-70.6177.7000111.7F47 V51 F70 V74 I80 A81 N86 N87 F90 L112 L116F47-L84 HydrophobicContact CE1-CD2 3.69Å; F47-L84 HydrophobicContact CE1-CG 3.89Å; F47-L84 HydrophobicContact CZ-CD1 4.07Å; F47-L84 HydrophobicContact CZ-CD2 3.67Å; F47-L84 HydrophobicContact CZ-CG 3.74Å; V51-L84 HydrophobicContact CG2-CD2 3.63Å; F70-L84 HydrophobicContact CB-CD1 4.13Å; F70-L84 HydrophobicContact CE2-CD2 4.48Å; F70-L84 HydrophobicContact CG-CD1 4.2Å; V74-L84 HydrophobicContact CG2-CD1 3.67Å; I80-L84 HydrophobicContact CG2-CD1 4.39Å; I80-L84 PolarHBondContact O-N 3.37Å; A81-L84 PolarHBondContact O-N 3.27Å; L84-N86 PolarHBondContact O-N 3.05Å; L84-N87 PolarHBondContact O-N 3.25Å; L84-N87 VanDerWaalsContact O-N 3.08Å; L84-F90 HydrophobicContact CB-CD1 3.98Å; L84-F90 HydrophobicContact CB-CE1 3.86Å; L84-F90 HydrophobicContact CD1-CE1 4.18Å; L84-F90 HydrophobicContact CD1-CZ 4.28Å; L84-F90 HydrophobicContact CD2-CD1 3.87Å; L84-F90 HydrophobicContact CD2-CD2 4.19Å; L84-F90 HydrophobicContact CD2-CE1 3.82Å; L84-F90 HydrophobicContact CD2-CE2 4.13Å; L84-F90 HydrophobicContact CD2-CG 4.07Å; L84-F90 HydrophobicContact CD2-CZ 3.96Å; L84-F90 HydrophobicContact CG-CD1 4.45Å; L84-F90 HydrophobicContact CG-CE1 4.17Å; L84-L112 HydrophobicContact CD1-CD1 4.35Å; L84-L116 HydrophobicContact CB-CD1 4.36Å; L84-L116 HydrophobicContact CB-CD2 4.16Å
85A96.4Very high94.5Very high0 Ų043.2 Ų43.20%022%0.219CC..Hα-helixtrans-64.3-27.4179.800000113.3A81 E82 W122 K125 M126A81-A85 VanDerWaalsContact O-CB 3.26Å; A81-A85 WeakPolarHBondContact O-CB 3.08Å; A81-A85 PolarHBondContact O-N 3.03Å; E82-A85 PolarHBondContact O-N 3.46Å; A85-W122 HydrophobicContact CB-CB 4.3Å; A85-K125 HydrophobicContact CB-CB 4.33Å; A85-M126 HydrophobicContact CB-CG 3.81Å; A85-M126 HydrophobicContact CB-SD 4.43Å
86N95.1Very high94.9Very high77 Ų7745.8 Ų45.841%0.41223%0.225SC..THydrogen-bonded Turntrans-85.1-11.4175.1-76.4-51.5000113.8E82 R83 L84 E88E82-N86 WeakPolarHBondContact CG-ND2 3.38Å; E82-N86 WeakPolarHBondContact O-CB 3.49Å; E82-N86 PolarHBondContact O-N 3.37Å; E82-N86 VanDerWaalsContact O-N 3.09Å; E82-N86 PolarHBondContact O-ND2 3.22Å; R83-N86 PolarHBondContact O-N 2.85Å; L84-N86 PolarHBondContact O-N 3.05Å; N86-E88 PolarHBondContact O-N 3.44Å
87N96Very high95.3Very high37 Ų3744.1 Ų44.120%0.19821%0.211CC..  trans-88.398.3179.9-173.3-45.8000110.2R83 L84 R89 F90 V91R83-N87 PolarHBondContact O-N 2.91Å; L84-N87 PolarHBondContact O-N 3.25Å; L84-N87 VanDerWaalsContact O-N 3.08Å; N87-R89 PolarHBondContact O-N 2.79Å; N87-R89 PolarHBondContact OD1-N 3.1Å; N87-F90 HydrophobicContact CB-CB 3.87Å; N87-F90 WeakPolarHBondContact O-CB 3.13Å; N87-F90 PolarHBondContact O-N 2.97Å; N87-F90 VanDerWaalsContact O-N 3.13Å; N87-F90 WeakPolarHBondContact OD1-CB 3.11Å; N87-F90 PolarHBondContact OD1-N 3.18Å; N87-V91 WeakPolarHBondContact O-CG2 3.1Å; N87-V91 PolarHBondContact O-N 3.42Å
88E96.1Very high95.7Very high114 Ų11442.8 Ų42.853%0.53321%0.205SC..Hα-helixtrans-50.3-50.9-178.8170.1170.6-17100113.2N86 F90 V91 V92 H129N86-E88 PolarHBondContact O-N 3.44Å; E88-F90 VanDerWaalsContact C-N 3.26Å; E88-F90 PolarHBondContact O-N 2.87Å; E88-V91 PolarHBondContact O-N 3.33Å; E88-V92 HydrophobicContact CG-CG2 4.41Å; E88-V92 WeakPolarHBondContact O-CG2 3.02Å; E88-V92 PolarHBondContact O-N 2.94Å; E88-H129 VanDerWaalsContact CG-ND1 3.34Å; E88-H129 WeakPolarHBondContact CG-ND1 3.41Å; E88-H129 IonicContact OE1-ND1 3.6Å; E88-H129 IonicContact OE2-CE1 3.15Å
89R96.9Very high95.9Very high153 Ų15341.2 Ų41.258%0.57719%0.193SC*.Hα-helixtrans-60.3-40.7-177.7-68.4176.764.9-158.3-1.3111.1L55 N87 E93L55-R89 HydrophobicContact CD1-CB 3.86Å; N87-R89 PolarHBondContact O-N 2.79Å; N87-R89 PolarHBondContact OD1-N 3.1Å; R89-E93 WeakPolarHBondContact O-CB 3.44Å; R89-E93 PolarHBondContact O-N 2.66Å; R89-E93 VanDerWaalsContact O-N 3.09Å
90F97.7Very high96Very high1 Ų141.3 Ų41.30%0.00419%0.191CC..Hα-helixtrans-66.3-45.9176.2178.3-94000112.5V51 F54 F70 L84 N87 E88 V92 E93 L94 L112 L116V51-F90 HydrophobicContact CG1-CB 4.1Å; V51-F90 HydrophobicContact CG1-CD2 4.12Å; V51-F90 HydrophobicContact CG1-CG 4.34Å; F54-F90 HydrophobicContact CD1-CD2 4.11Å; F54-F90 HydrophobicContact CD1-CE2 4.01Å; F54-F90 HydrophobicContact CE1-CD2 4.2Å; F54-F90 AromaticContact CE1-CE2 3.87Å; F54-F90 HydrophobicContact CE1-CE2 3.87Å; F70-F90 AromaticContact CD2-CE2 3.9Å; F70-F90 HydrophobicContact CD2-CE2 3.9Å; F70-F90 HydrophobicContact CD2-CZ 4.18Å; F70-F90 HydrophobicContact CE2-CD2 4.48Å; F70-F90 AromaticContact CE2-CE2 3.79Å; F70-F90 HydrophobicContact CE2-CE2 3.79Å; F70-F90 HydrophobicContact CE2-CZ 4.48Å; L84-F90 HydrophobicContact CB-CD1 3.98Å; L84-F90 HydrophobicContact CB-CE1 3.86Å; L84-F90 HydrophobicContact CD1-CE1 4.18Å; L84-F90 HydrophobicContact CD1-CZ 4.28Å; L84-F90 HydrophobicContact CD2-CD1 3.87Å; L84-F90 HydrophobicContact CD2-CD2 4.19Å; L84-F90 HydrophobicContact CD2-CE1 3.82Å; L84-F90 HydrophobicContact CD2-CE2 4.13Å; L84-F90 HydrophobicContact CD2-CG 4.07Å; L84-F90 HydrophobicContact CD2-CZ 3.96Å; L84-F90 HydrophobicContact CG-CD1 4.45Å; L84-F90 HydrophobicContact CG-CE1 4.17Å; N87-F90 HydrophobicContact CB-CB 3.87Å; N87-F90 WeakPolarHBondContact O-CB 3.13Å; N87-F90 PolarHBondContact O-N 2.97Å; N87-F90 VanDerWaalsContact O-N 3.13Å; N87-F90 WeakPolarHBondContact OD1-CB 3.11Å; N87-F90 PolarHBondContact OD1-N 3.18Å; E88-F90 VanDerWaalsContact C-N 3.26Å; E88-F90 PolarHBondContact O-N 2.87Å; F90-V92 PolarHBondContact O-N 3.37Å; F90-E93 PolarHBondContact O-N 3.26Å; F90-L94 HydrophobicContact CE1-CB 4.35Å; F90-L94 HydrophobicContact CE1-CD2 4.03Å; F90-L94 HydrophobicContact CZ-CD2 4.48Å; F90-L94 VanDerWaalsContact O-CB 3.28Å; F90-L94 WeakPolarHBondContact O-CB 3.2Å; F90-L94 PolarHBondContact O-N 3.11Å; F90-L112 HydrophobicContact CE1-CD2 4.49Å; F90-L112 HydrophobicContact CZ-CD2 3.64Å; F90-L116 HydrophobicContact CE1-CD1 4.02Å
91V98.1Very high95.9Very high0 Ų044.9 Ų44.90%022%0.215CC..Hα-helixtrans-63-43.5179.6175.40000111.1N87 E88 L94 F95 M126 H129 I130N87-V91 WeakPolarHBondContact O-CG2 3.1Å; N87-V91 PolarHBondContact O-N 3.42Å; E88-V91 PolarHBondContact O-N 3.33Å; V91-L94 PolarHBondContact O-N 2.6Å; V91-F95 HydrophobicContact CG1-CD2 3.92Å; V91-F95 HydrophobicContact CG1-CE2 4.17Å; V91-F95 WeakPolarHBondContact O-CD2 3.08Å; V91-F95 PolarHBondContact O-N 2.8Å; V91-M126 HydrophobicContact CG1-CB 3.9Å; V91-M126 HydrophobicContact CG1-CG 4.06Å; V91-M126 HydrophobicContact CG2-CB 4.48Å; V91-M126 HydrophobicContact CG2-CG 3.83Å; V91-M126 HydrophobicContact CG2-SD 4.43Å; V91-H129 HydrophobicContact CB-CB 4.19Å; V91-H129 HydrophobicContact CG1-CB 3.87Å; V91-I130 HydrophobicContact CG1-CG1 4.41Å
92V97.8Very high95.7Very high44 Ų4453.5 Ų53.527%0.26726%0.255SS..Hα-helixtrans-59.6-50.6176172.60000110.6E88 F90 L94 F95 Q96 H129E88-V92 HydrophobicContact CG-CG2 4.41Å; E88-V92 WeakPolarHBondContact O-CG2 3.02Å; E88-V92 PolarHBondContact O-N 2.94Å; F90-V92 PolarHBondContact O-N 3.37Å; V92-L94 PolarHBondContact O-N 3.11Å; V92-F95 PolarHBondContact O-N 3.41Å; V92-Q96 VanDerWaalsContact O-CB 3.3Å; V92-Q96 WeakPolarHBondContact O-CB 3.1Å; V92-Q96 PolarHBondContact O-N 3.41Å; V92-H129 HydrophobicContact CG2-CB 4.23Å
93E97.2Very high95.7Very high38 Ų3850.3 Ų50.318%0.17824%0.241CC..Hα-helixtrans-59.7-46.6178179.169.1-173.100111.5F54 L55 R63 R89 F90 F95 Q96 K97F54-E93 HydrophobicContact CE1-CG 4.44Å; L55-E93 HydrophobicContact CD2-CB 3.78Å; L55-E93 HydrophobicContact CD2-CG 3.92Å; R63-E93 IonicContact CZ-OE1 3.31Å; R63-E93 IonicContact NH1-OE1 3.47Å; R63-E93 IonicContact NH2-OE1 3.22Å; R63-E93 PolarHBondContact NH2-OE1 3.29Å; R89-E93 WeakPolarHBondContact O-CB 3.44Å; R89-E93 PolarHBondContact O-N 2.66Å; R89-E93 VanDerWaalsContact O-N 3.09Å; F90-E93 PolarHBondContact O-N 3.26Å; E93-F95 PolarHBondContact O-N 3.42Å; E93-Q96 PolarHBondContact O-N 3.32Å; E93-K97 HydrophobicContact CG-CG 4.34Å; E93-K97 WeakPolarHBondContact O-CB 3.46Å; E93-K97 WeakPolarHBondContact O-CG 3.26Å; E93-K97 PolarHBondContact O-N 3.42Å; E93-K97 WeakPolarHBondContact OE1-CE 3.28Å
94L98.1Very high95.7Very high0 Ų050.8 Ų50.80%026%0.255CS..Hα-helixtrans-55.3-53.4179.5173.361.6000111.2F90 V91 V92 K97 V98 Y109 L112 A113 L116F90-L94 HydrophobicContact CE1-CB 4.35Å; F90-L94 HydrophobicContact CE1-CD2 4.03Å; F90-L94 HydrophobicContact CZ-CD2 4.48Å; F90-L94 VanDerWaalsContact O-CB 3.28Å; F90-L94 WeakPolarHBondContact O-CB 3.2Å; F90-L94 PolarHBondContact O-N 3.11Å; V91-L94 PolarHBondContact O-N 2.6Å; V92-L94 PolarHBondContact O-N 3.11Å; L94-K97 PolarHBondContact O-N 3.42Å; L94-V98 HydrophobicContact CD1-CG2 4.41Å; L94-V98 WeakPolarHBondContact O-CG2 3.43Å; L94-V98 PolarHBondContact O-N 3.23Å; L94-Y109 HydrophobicContact CD1-CD1 3.9Å; L94-Y109 WeakPolarHBondContact CD1-O 3.47Å; L94-L112 HydrophobicContact CD1-CB 4.42Å; L94-L112 HydrophobicContact CD1-CG 4.5Å; L94-A113 HydrophobicContact CD1-CB 4.25Å; L94-A113 HydrophobicContact CD2-CB 4.28Å; L94-A113 HydrophobicContact CG-CB 4.36Å; L94-L116 HydrophobicContact CD2-CD1 3.62Å
95F97.9Very high95.6Very high2 Ų251.7 Ų51.71%0.00926%0.259CS..Hα-helixtrans-75.9-22.4-177.3-79.2-78.1000113.4V91 V92 E93 R99 M126 I130 L136 I158 L162V91-F95 HydrophobicContact CG1-CD2 3.92Å; V91-F95 HydrophobicContact CG1-CE2 4.17Å; V91-F95 WeakPolarHBondContact O-CD2 3.08Å; V91-F95 PolarHBondContact O-N 2.8Å; V92-F95 PolarHBondContact O-N 3.41Å; E93-F95 PolarHBondContact O-N 3.42Å; F95-R99 VanDerWaalsContact O-CG 3.32Å; F95-R99 WeakPolarHBondContact O-CG 3.47Å; F95-R99 PolarHBondContact O-N 3.14Å; F95-R99 PolarHBondContact O-NH1 3.17Å; F95-M126 HydrophobicContact CE2-SD 4.03Å; F95-I130 HydrophobicContact CD1-CD1 4.46Å; F95-I130 HydrophobicContact CD1-CG1 4.5Å; F95-I130 HydrophobicContact CD2-CD1 4.03Å; F95-I130 HydrophobicContact CD2-CG1 3.64Å; F95-I130 HydrophobicContact CE1-CD1 4.05Å; F95-I130 HydrophobicContact CE2-CD1 3.56Å; F95-I130 HydrophobicContact CE2-CG1 3.69Å; F95-I130 HydrophobicContact CG-CD1 4.45Å; F95-I130 HydrophobicContact CG-CG1 4.07Å; F95-I130 HydrophobicContact CZ-CD1 3.57Å; F95-I130 HydrophobicContact CZ-CG1 4.15Å; F95-L136 HydrophobicContact CD1-CD1 4.02Å; F95-L136 HydrophobicContact CD1-CD2 3.61Å; F95-L136 HydrophobicContact CE1-CD2 3.79Å; F95-I158 HydrophobicContact CE1-CG2 4.49Å; F95-L162 HydrophobicContact CE1-CD1 4.26Å
96Q97Very high95.5Very high109 Ų10953 Ų5351%0.50926%0.264SS..Hα-helixtrans-68-40.1167.2-175.7175.3-3.900111V92 E93 R99 S100V92-Q96 VanDerWaalsContact O-CB 3.3Å; V92-Q96 WeakPolarHBondContact O-CB 3.1Å; V92-Q96 PolarHBondContact O-N 3.41Å; E93-Q96 PolarHBondContact O-N 3.32Å; Q96-R99 WeakPolarHBondContact O-CB 3.46Å; Q96-R99 PolarHBondContact O-N 3.09Å; Q96-S100 PolarHBondContact O-N 3.29Å; Q96-S100 PolarHBondContact O-OG 2.92Å
97K96.6Very high95.5Very high43 Ų4351.4 Ų51.419%0.18726%0.258CS..Hα-helixtrans-73.8-33.6178.1-67.9-66.7-171.1175.50113.2E93 L94 R99 S100 D103 Y109E93-K97 HydrophobicContact CG-CG 4.34Å; E93-K97 WeakPolarHBondContact O-CB 3.46Å; E93-K97 WeakPolarHBondContact O-CG 3.26Å; E93-K97 PolarHBondContact O-N 3.42Å; E93-K97 WeakPolarHBondContact OE1-CE 3.28Å; L94-K97 PolarHBondContact O-N 3.42Å; K97-R99 PolarHBondContact O-N 2.78Å; K97-S100 WeakPolarHBondContact O-CB 3.28Å; K97-S100 PolarHBondContact O-N 3.45Å; K97-D103 VanDerWaalsContact CD-OD2 3.29Å; K97-D103 WeakPolarHBondContact CD-OD2 3.19Å; K97-D103 IonicContact NZ-OD2 3.65Å; K97-D103 PolarHBondContact NZ-OD2 2.03Å; K97-Y109 HydrophobicContact CB-CD1 3.56Å; K97-Y109 HydrophobicContact CB-CD2 3.69Å; K97-Y109 HydrophobicContact CB-CE1 3.52Å; K97-Y109 HydrophobicContact CB-CE2 3.65Å; K97-Y109 HydrophobicContact CB-CG 3.63Å; K97-Y109 HydrophobicContact CD-CE2 4.12Å; K97-Y109 HydrophobicContact CG-CD1 4.21Å; K97-Y109 HydrophobicContact CG-CD2 4.48Å; K97-Y109 HydrophobicContact CG-CE1 3.65Å; K97-Y109 HydrophobicContact CG-CE2 3.94Å
98V96.3Very high95.4Very high0 Ų052 Ų520%026%0.261CS..Hα-helixtrans-57.9-34.1168.9168.10000111.8L94 R106 A113 L136 L140 F155L94-V98 HydrophobicContact CD1-CG2 4.41Å; L94-V98 WeakPolarHBondContact O-CG2 3.43Å; L94-V98 PolarHBondContact O-N 3.23Å; V98-R106 PolarHBondContact O-NE 3.28Å; V98-R106 PolarHBondContact O-NH2 3.12Å; V98-A113 HydrophobicContact CG2-CB 3.89Å; V98-L136 HydrophobicContact CG1-CD1 4.32Å; V98-L140 HydrophobicContact CG1-CD2 3.89Å; V98-F155 HydrophobicContact CG1-CE1 3.98Å
99R95.9Very high95.5Very high48 Ų4846.6 Ų46.618%0.18124%0.236CC..Hα-helixtrans-76.5-21.1174.9-67.1175.717091.9-10.9114.8F95 Q96 K97 C101 L131 D132 D135 L136 V139F95-R99 VanDerWaalsContact O-CG 3.32Å; F95-R99 WeakPolarHBondContact O-CG 3.47Å; F95-R99 PolarHBondContact O-N 3.14Å; F95-R99 PolarHBondContact O-NH1 3.17Å; Q96-R99 WeakPolarHBondContact O-CB 3.46Å; Q96-R99 PolarHBondContact O-N 3.09Å; K97-R99 PolarHBondContact O-N 2.78Å; R99-C101 PolarHBondContact O-N 3.29Å; R99-L131 PolarHBondContact NH2-O 2.83Å; R99-D132 PolarHBondContact NH2-O 3.47Å; R99-D135 WeakPolarHBondContact CD-OD2 3.25Å; R99-D135 IonicContact CZ-OD2 3.67Å; R99-D135 IonicContact NE-OD2 3.61Å; R99-D135 PolarHBondContact NE-OD2 2.88Å; R99-D135 IonicContact NH2-OD2 2.85Å; R99-L136 HydrophobicContact CG-CD1 4.42Å; R99-V139 HydrophobicContact CB-CG2 4.46Å; R99-V139 HydrophobicContact CG-CB 4.5Å; R99-V139 HydrophobicContact CG-CG1 4.32Å; R99-V139 HydrophobicContact CG-CG2 4.12Å
100S94.3Very high95.5Very high40 Ų4039.3 Ų39.328%0.2821%0.208SC..  trans-8085-172.4-61.40000110.9Q96 K97 E102 D103 R106Q96-S100 PolarHBondContact O-N 3.29Å; Q96-S100 PolarHBondContact O-OG 2.92Å; K97-S100 WeakPolarHBondContact O-CB 3.28Å; K97-S100 PolarHBondContact O-N 3.45Å; S100-E102 PolarHBondContact O-N 3.09Å; S100-E102 VanDerWaalsContact O-N 3.12Å; S100-D103 WeakPolarHBondContact O-CB 3.45Å; S100-D103 PolarHBondContact O-N 3.34Å; S100-R106 WeakPolarHBondContact O-CD 3.14Å
101C88.7Confident95.4Very high74 Ų7441 Ų4150%0.522%0.22SC..THydrogen-bonded Turntrans-55.1-30.4-177.1-67.30000114.6R99 R106R99-C101 PolarHBondContact O-N 3.29Å; C101-R106 PolarHBondContact SG-NH1 3.5Å
102E90.5Very high95.4Very high181 Ų18141 Ų4185%0.84622%0.22SC*.THydrogen-bonded Turntrans-86.5-6.9-179.5-54.7-55.9148.400113.6S100 P104S100-E102 PolarHBondContact O-N 3.09Å; S100-E102 VanDerWaalsContact O-N 3.12Å; E102-P104 WeakPolarHBondContact O-CD 3.27Å
103D93Very high95.4Very high15 Ų1538.9 Ų38.98%0.0821%0.208CC..  trans-71.5120.4-177.9-166.3-57.9000109.8H60 K97 S100 I105 R106H60-D103 IonicContact CE1-OD1 3.46Å; H60-D103 IonicContact CE1-OD2 2.68Å; H60-D103 IonicContact ND1-OD1 2.69Å; K97-D103 VanDerWaalsContact CD-OD2 3.29Å; K97-D103 WeakPolarHBondContact CD-OD2 3.19Å; K97-D103 IonicContact NZ-OD2 3.65Å; K97-D103 PolarHBondContact NZ-OD2 2.03Å; S100-D103 WeakPolarHBondContact O-CB 3.45Å; S100-D103 PolarHBondContact O-N 3.34Å; D103-I105 PolarHBondContact O-N 2.82Å; D103-I105 VanDerWaalsContact O-N 3.1Å; D103-I105 WeakPolarHBondContact OD1-CG1 3.16Å; D103-I105 PolarHBondContact OD1-N 2.53Å; D103-I105 VanDerWaalsContact OD1-N 3.12Å; D103-R106 HydrophobicContact CB-CB 4.29Å; D103-R106 WeakPolarHBondContact O-CB 3.21Å; D103-R106 PolarHBondContact O-N 2.85Å
104P93.3Very high95.4Very high90 Ų9037.6 Ų37.658%0.58420%0.203SC*.THydrogen-bonded Turntrans-64.5-21.4-172.325.4-35.5000113.4H60 E102H60-P104 HydrophobicContact CB-CG 4.33Å; E102-P104 WeakPolarHBondContact O-CD 3.27Å
105I94.5Very high95.3Very high20 Ų2039.1 Ų39.110%0.10321%0.212CC..THydrogen-bonded Turntrans-107.813.8178.661.2167.7000112.1H60 R63 L67 D103 P107 L108 Y109H60-I105 HydrophobicContact CB-CD1 4.34Å; H60-I105 HydrophobicContact CB-CG2 4.25Å; R63-I105 HydrophobicContact CB-CD1 3.68Å; L67-I105 HydrophobicContact CD1-CD1 3.96Å; D103-I105 PolarHBondContact O-N 2.82Å; D103-I105 VanDerWaalsContact O-N 3.1Å; D103-I105 WeakPolarHBondContact OD1-CG1 3.16Å; D103-I105 PolarHBondContact OD1-N 2.53Å; D103-I105 VanDerWaalsContact OD1-N 3.12Å; I105-P107 VanDerWaalsContact O-N 3.15Å; I105-L108 HydrophobicContact CB-CD1 4.49Å; I105-L108 WeakPolarHBondContact O-CB 3.4Å; I105-L108 PolarHBondContact O-N 3.04Å; I105-Y109 HydrophobicContact CD1-CE2 3.9Å; I105-Y109 HydrophobicContact CG1-CD2 4.36Å; I105-Y109 HydrophobicContact CG1-CE2 3.69Å; I105-Y109 WeakPolarHBondContact O-CD2 3.45Å; I105-Y109 PolarHBondContact O-N 2.78Å
106R94.9Very high95.3Very high26 Ų2639 Ų3910%0.09821%0.211CC..Hα-helixtrans-43.4-41171.2-169.4-168.6-176.2-163.3-1.3114.2V98 S100 C101 D103 L108 Y109 G110 F155V98-R106 PolarHBondContact O-NE 3.28Å; V98-R106 PolarHBondContact O-NH2 3.12Å; S100-R106 WeakPolarHBondContact O-CD 3.14Å; C101-R106 PolarHBondContact SG-NH1 3.5Å; D103-R106 HydrophobicContact CB-CB 4.29Å; D103-R106 WeakPolarHBondContact O-CB 3.21Å; D103-R106 PolarHBondContact O-N 2.85Å; R106-L108 VanDerWaalsContact C-N 3.28Å; R106-L108 PolarHBondContact O-N 3.43Å; R106-Y109 WeakPolarHBondContact O-CB 3.28Å; R106-Y109 PolarHBondContact O-N 3.13Å; R106-G110 PolarHBondContact O-N 2.88Å; R106-F155 HydrophobicContact CG-CZ 4.06Å
107P93.9Very high95.3Very high45 Ų4533.9 Ų33.929%0.29219%0.187SC..Hα-helixtrans-62.4-32.3-179.6-25.137.6000113.7I105 G110 S111 F151I105-P107 VanDerWaalsContact O-N 3.15Å; P107-G110 PolarHBondContact O-N 3.46Å; P107-S111 PolarHBondContact O-N 3.44Å; P107-S111 PolarHBondContact O-OG 3.09Å; P107-F151 HydrophobicContact CB-CD1 4.07Å; P107-F151 HydrophobicContact CB-CE1 3.82Å; P107-F151 HydrophobicContact CG-CD1 3.89Å; P107-F151 HydrophobicContact CG-CE1 3.26Å; P107-F151 HydrophobicContact CG-CZ 3.79Å
108L95.6Very high95.2Very high49 Ų4936.8 Ų36.826%0.25720%0.197SC..Hα-helixtrans-70.8-40.3175.6-69.4175.3000111.6L67 I105 R106 G110 S111 L112L67-L108 HydrophobicContact CB-CB 4.14Å; L67-L108 HydrophobicContact CB-CD1 4.4Å; L67-L108 HydrophobicContact CD1-CB 3.96Å; I105-L108 HydrophobicContact CB-CD1 4.49Å; I105-L108 WeakPolarHBondContact O-CB 3.4Å; I105-L108 PolarHBondContact O-N 3.04Å; R106-L108 VanDerWaalsContact C-N 3.28Å; R106-L108 PolarHBondContact O-N 3.43Å; L108-G110 VanDerWaalsContact C-N 3.32Å; L108-G110 PolarHBondContact O-N 3.17Å; L108-S111 PolarHBondContact O-N 3.17Å; L108-L112 PolarHBondContact O-N 3.24Å
109Y97.3Very high95.2Very high1 Ų140.6 Ų40.60%0.00421%0.213CC..Hα-helixtrans-60.8-43.2171.3-67.4-78.9000111.8F54 R63 L67 L94 K97 I105 R106 S111 L112 A113F54-Y109 HydrophobicContact CE1-CE1 4.38Å; F54-Y109 AromaticContact CZ-CE1 3.62Å; F54-Y109 HydrophobicContact CZ-CE1 3.62Å; R63-Y109 VanDerWaalsContact CZ-OH 3.24Å; R63-Y109 PolarHBondContact NE-OH 2.96Å; R63-Y109 PolarHBondContact NH2-OH 3.36Å; L67-Y109 HydrophobicContact CD1-CD1 4.03Å; L67-Y109 HydrophobicContact CD1-CD2 4.12Å; L67-Y109 HydrophobicContact CD1-CE1 3.84Å; L67-Y109 HydrophobicContact CD1-CE2 3.96Å; L67-Y109 HydrophobicContact CD1-CG 4.17Å; L67-Y109 HydrophobicContact CD2-CD1 4Å; L67-Y109 HydrophobicContact CD2-CE1 4.07Å; L94-Y109 HydrophobicContact CD1-CD1 3.9Å; L94-Y109 WeakPolarHBondContact CD1-O 3.47Å; K97-Y109 HydrophobicContact CB-CD1 3.56Å; K97-Y109 HydrophobicContact CB-CD2 3.69Å; K97-Y109 HydrophobicContact CB-CE1 3.52Å; K97-Y109 HydrophobicContact CB-CE2 3.65Å; K97-Y109 HydrophobicContact CB-CG 3.63Å; K97-Y109 HydrophobicContact CD-CE2 4.12Å; K97-Y109 HydrophobicContact CG-CD1 4.21Å; K97-Y109 HydrophobicContact CG-CD2 4.48Å; K97-Y109 HydrophobicContact CG-CE1 3.65Å; K97-Y109 HydrophobicContact CG-CE2 3.94Å; I105-Y109 HydrophobicContact CD1-CE2 3.9Å; I105-Y109 HydrophobicContact CG1-CD2 4.36Å; I105-Y109 HydrophobicContact CG1-CE2 3.69Å; I105-Y109 WeakPolarHBondContact O-CD2 3.45Å; I105-Y109 PolarHBondContact O-N 2.78Å; R106-Y109 WeakPolarHBondContact O-CB 3.28Å; R106-Y109 PolarHBondContact O-N 3.13Å; Y109-S111 VanDerWaalsContact C-N 3.32Å; Y109-S111 PolarHBondContact O-N 2.88Å; Y109-L112 PolarHBondContact O-N 3.31Å; Y109-A113 VanDerWaalsContact O-CB 3.3Å; Y109-A113 WeakPolarHBondContact O-CB 3.48Å; Y109-A113 PolarHBondContact O-N 3.25Å
110G96.6Very high95.2Very high0 Ų042.7 Ų42.70%023%0.225CC..Hα-helixtrans-57.2-47.5173.800000111.3R106 P107 L108 L112 A113 A114 T154 I158R106-G110 PolarHBondContact O-N 2.88Å; P107-G110 PolarHBondContact O-N 3.46Å; L108-G110 VanDerWaalsContact C-N 3.32Å; L108-G110 PolarHBondContact O-N 3.17Å; G110-L112 VanDerWaalsContact C-N 3.32Å; G110-L112 PolarHBondContact O-N 3.29Å; G110-A113 PolarHBondContact O-N 3.46Å; G110-A114 WeakPolarHBondContact O-CB 3.38Å; G110-A114 PolarHBondContact O-N 3.46Å; G110-T154 WeakPolarHBondContact O-CG2 3.12Å; G110-I158 WeakPolarHBondContact O-CD1 3.41Å
111S96.2Very high95.3Very high36 Ų3645.3 Ų45.325%0.25223%0.233SC..Hα-helixtrans-61.9-41.9-178.4-58.70000111.5P107 L108 Y109 A114 N115 T154P107-S111 PolarHBondContact O-N 3.44Å; P107-S111 PolarHBondContact O-OG 3.09Å; L108-S111 PolarHBondContact O-N 3.17Å; Y109-S111 VanDerWaalsContact C-N 3.32Å; Y109-S111 PolarHBondContact O-N 2.88Å; S111-A114 PolarHBondContact O-N 3.4Å; S111-N115 PolarHBondContact O-N 2.98Å; S111-N115 VanDerWaalsContact O-N 3.09Å; S111-T154 VanDerWaalsContact N-CG2 3.26Å
112L97.6Very high95.7Very high0 Ų042 Ų420%021%0.21CC..Hα-helixtrans-66.7-43.9175.8-174.450.5000112.3L67 F70 V71 V74 L84 F90 L94 L108 Y109 G110 A114 N115 L116L67-L112 HydrophobicContact CD2-CD2 3.65Å; F70-L112 HydrophobicContact CB-CD1 3.98Å; F70-L112 HydrophobicContact CB-CD2 3.66Å; F70-L112 HydrophobicContact CD2-CD2 4.07Å; F70-L112 HydrophobicContact CG-CD2 4.37Å; V71-L112 HydrophobicContact CG2-CB 3.77Å; V71-L112 HydrophobicContact CG2-CD1 4.35Å; V74-L112 HydrophobicContact CB-CD1 4.3Å; V74-L112 HydrophobicContact CG2-CD1 3.83Å; L84-L112 HydrophobicContact CD1-CD1 4.35Å; F90-L112 HydrophobicContact CE1-CD2 4.49Å; F90-L112 HydrophobicContact CZ-CD2 3.64Å; L94-L112 HydrophobicContact CD1-CB 4.42Å; L94-L112 HydrophobicContact CD1-CG 4.5Å; L108-L112 PolarHBondContact O-N 3.24Å; Y109-L112 PolarHBondContact O-N 3.31Å; G110-L112 VanDerWaalsContact C-N 3.32Å; G110-L112 PolarHBondContact O-N 3.29Å; L112-A114 VanDerWaalsContact C-N 3.33Å; L112-A114 PolarHBondContact O-N 3.37Å; L112-N115 PolarHBondContact O-N 3.16Å; L112-L116 HydrophobicContact CD1-CD1 4.01Å; L112-L116 HydrophobicContact CD1-CG 4.15Å; L112-L116 HydrophobicContact CG-CD1 3.95Å; L112-L116 WeakPolarHBondContact O-CB 3.45Å; L112-L116 WeakPolarHBondContact O-CG 3.42Å; L112-L116 PolarHBondContact O-N 3.36Å
113A97.9Very high96Very high0 Ų033.3 Ų33.30%017%0.17CC..Hα-helixtrans-63.9-37.4176.300000112.1L94 V98 Y109 G110 N115 L116 S117 I158L94-A113 HydrophobicContact CD1-CB 4.25Å; L94-A113 HydrophobicContact CD2-CB 4.28Å; L94-A113 HydrophobicContact CG-CB 4.36Å; V98-A113 HydrophobicContact CG2-CB 3.89Å; Y109-A113 VanDerWaalsContact O-CB 3.3Å; Y109-A113 WeakPolarHBondContact O-CB 3.48Å; Y109-A113 PolarHBondContact O-N 3.25Å; G110-A113 PolarHBondContact O-N 3.46Å; A113-N115 VanDerWaalsContact C-N 3.33Å; A113-L116 PolarHBondContact O-N 2.9Å; A113-S117 VanDerWaalsContact O-CB 3.27Å; A113-S117 WeakPolarHBondContact O-CB 3.17Å; A113-S117 PolarHBondContact O-N 3.25Å; A113-S117 PolarHBondContact O-OG 3.46Å; A113-I158 HydrophobicContact CB-CD1 3.77Å; A113-I158 HydrophobicContact CB-CG1 4.09Å
114A96.8Very high96.2Very high11 Ų1137 Ų379%0.09119%0.186CC..Hα-helixtrans-61.6-44.9174.500000110.2G110 S111 L112 S117 R118 T154 C157 I158 N161G110-A114 WeakPolarHBondContact O-CB 3.38Å; G110-A114 PolarHBondContact O-N 3.46Å; S111-A114 PolarHBondContact O-N 3.4Å; L112-A114 VanDerWaalsContact C-N 3.33Å; L112-A114 PolarHBondContact O-N 3.37Å; A114-S117 PolarHBondContact O-N 3.42Å; A114-S117 PolarHBondContact O-OG 2.84Å; A114-R118 WeakPolarHBondContact O-CG 3.43Å; A114-T154 HydrophobicContact CB-CG2 4.12Å; A114-C157 HydrophobicContact CB-CB 4.35Å; A114-I158 HydrophobicContact CB-CG1 3.88Å; A114-N161 PolarHBondContact O-ND2 3.17Å
115N96.6Very high96.3Very high32 Ų3234.4 Ų34.417%0.17117%0.166CC..Hα-helixtrans-66.8-42.2177.8-77.9-11.5000113.5V71 V74 S75 S111 L112 A113 S117 R118V71-N115 PolarHBondContact O-ND2 3.27Å; V74-N115 HydrophobicContact CB-CB 4.43Å; V74-N115 HydrophobicContact CG1-CB 3.69Å; S75-N115 PolarHBondContact OG-ND2 3.39Å; S111-N115 PolarHBondContact O-N 2.98Å; S111-N115 VanDerWaalsContact O-N 3.09Å; L112-N115 PolarHBondContact O-N 3.16Å; A113-N115 VanDerWaalsContact C-N 3.33Å; N115-S117 VanDerWaalsContact C-N 3.28Å; N115-S117 PolarHBondContact O-N 3.09Å; N115-R118 WeakPolarHBondContact O-CG 3.44Å; N115-R118 PolarHBondContact O-N 3.47Å; N115-R118 PolarHBondContact O-NE 3.28Å
116L97.5Very high96.5Very high0 Ų033.5 Ų33.50%016%0.161CC..Hα-helixtrans-71.9-21179.2-74.3171.9000113V74 A81 L84 F90 L94 L112 A113 W122 M126V74-L116 HydrophobicContact CG1-CD2 3.85Å; V74-L116 HydrophobicContact CG1-CG 4.16Å; V74-L116 HydrophobicContact CG2-CD2 3.88Å; V74-L116 HydrophobicContact CG2-CG 4.38Å; A81-L116 HydrophobicContact CB-CD2 3.99Å; L84-L116 HydrophobicContact CB-CD1 4.36Å; L84-L116 HydrophobicContact CB-CD2 4.16Å; F90-L116 HydrophobicContact CE1-CD1 4.02Å; L94-L116 HydrophobicContact CD2-CD1 3.62Å; L112-L116 HydrophobicContact CD1-CD1 4.01Å; L112-L116 HydrophobicContact CD1-CG 4.15Å; L112-L116 HydrophobicContact CG-CD1 3.95Å; L112-L116 WeakPolarHBondContact O-CB 3.45Å; L112-L116 WeakPolarHBondContact O-CG 3.42Å; L112-L116 PolarHBondContact O-N 3.36Å; A113-L116 PolarHBondContact O-N 2.9Å; L116-W122 WeakPolarHBondContact O-CB 3.42Å; L116-M126 HydrophobicContact CB-CE 3.93Å; L116-M126 HydrophobicContact CB-SD 3.93Å; L116-M126 HydrophobicContact CD1-SD 4.44Å; L116-M126 WeakPolarHBondContact O-CE 3.31Å
117S97.4Very high96.5Very high0 Ų033.7 Ų33.70%017%0.166CC..THydrogen-bonded Turntrans-88.4-7.4178.855.60000114.1A113 A114 N115 K119 C123 N161 Q164A113-S117 VanDerWaalsContact O-CB 3.27Å; A113-S117 WeakPolarHBondContact O-CB 3.17Å; A113-S117 PolarHBondContact O-N 3.25Å; A113-S117 PolarHBondContact O-OG 3.46Å; A114-S117 PolarHBondContact O-N 3.42Å; A114-S117 PolarHBondContact O-OG 2.84Å; N115-S117 VanDerWaalsContact C-N 3.28Å; N115-S117 PolarHBondContact O-N 3.09Å; S117-K119 VanDerWaalsContact C-N 3.32Å; S117-K119 PolarHBondContact O-N 2.77Å; S117-C123 WeakPolarHBondContact CA-SG 3.16Å; S117-C123 PolarHBondContact O-SG 3.03Å; S117-N161 WeakPolarHBondContact O-CB 3.38Å; S117-N161 WeakPolarHBondContact OG-CB 3.37Å; S117-N161 PolarHBondContact OG-ND2 3.19Å; S117-Q164 PolarHBondContact O-NE2 3.29Å
118R95.4Very high96.5Very high105 Ų10539.8 Ų39.840%0.39618%0.183SC..SBendtrans-58.7-37.9-174.1-67.6179.5-63.5160.51114.2V74 A114 N115 Q164V74-R118 PolarHBondContact O-NH2 2.88Å; A114-R118 WeakPolarHBondContact O-CG 3.43Å; N115-R118 WeakPolarHBondContact O-CG 3.44Å; N115-R118 PolarHBondContact O-N 3.47Å; N115-R118 PolarHBondContact O-NE 3.28Å; R118-Q164 PolarHBondContact O-NE2 3.2Å
119K96Very high96.5Very high80 Ų8038.8 Ų38.835%0.34818%0.177SC..SBendtrans-101.7135.6-180-60.7-165.8-170.6-176.50111.2D78 S117 E121 W122 C123D78-K119 WeakPolarHBondContact OD1-CE 3.48Å; D78-K119 IonicContact OD1-NZ 2.65Å; D78-K119 PolarHBondContact OD1-NZ 3.3Å; D78-K119 VanDerWaalsContact OD1-NZ 3.15Å; D78-K119 IonicContact OD2-NZ 3.76Å; D78-K119 PolarHBondContact OD2-NZ 2.91Å; S117-K119 VanDerWaalsContact C-N 3.32Å; S117-K119 PolarHBondContact O-N 2.77Å; K119-E121 VanDerWaalsContact C-N 3.29Å; K119-E121 PolarHBondContact O-N 3.1Å; K119-W122 HydrophobicContact CB-CD2 3.78Å; K119-W122 HydrophobicContact CB-CE3 3.79Å; K119-W122 HydrophobicContact CB-CG 4.17Å; K119-W122 HydrophobicContact CB-CZ3 4.22Å; K119-W122 HydrophobicContact CD-CD2 4.18Å; K119-W122 HydrophobicContact CD-CE3 4.33Å; K119-W122 HydrophobicContact CD-CH2 3.71Å; K119-W122 HydrophobicContact CD-CZ2 3.51Å; K119-W122 HydrophobicContact CD-CZ3 4.11Å; K119-W122 HydrophobicContact CG-CD2 4.11Å; K119-W122 HydrophobicContact CG-CE3 3.88Å; K119-W122 HydrophobicContact CG-CH2 3.9Å; K119-W122 HydrophobicContact CG-CZ2 4.11Å; K119-W122 HydrophobicContact CG-CZ3 3.77Å; K119-W122 PolarHBondContact O-N 3.32Å; K119-W122 VanDerWaalsContact O-N 3.17Å; K119-C123 PolarHBondContact O-N 3.49Å; K119-C123 VanDerWaalsContact O-N 3.1Å
120Q96.2Very high96.4Very high92 Ų9239.3 Ų39.343%0.4318%0.18SC..Hα-helixtrans-52.2-45.3174.2-179174.2-12.500112.6W122 C123 E124 Q164Q120-W122 VanDerWaalsContact C-N 3.29Å; Q120-W122 PolarHBondContact O-N 2.98Å; Q120-C123 CarbonylContact O-C 3.37Å; Q120-C123 WeakPolarHBondContact O-CA 3.34Å; Q120-C123 WeakPolarHBondContact O-CB 3.41Å; Q120-C123 PolarHBondContact O-N 3.19Å; Q120-C123 VanDerWaalsContact O-N 3.11Å; Q120-E124 HydrophobicContact CG-CG 4.27Å; Q120-E124 WeakPolarHBondContact CG-OE1 3.35Å; Q120-E124 PolarHBondContact NE2-OE1 3.4Å; Q120-E124 WeakPolarHBondContact O-CG 3.2Å; Q120-E124 PolarHBondContact O-N 3.32Å; Q120-Q164 HydrophobicContact CB-CB 4.37Å; Q120-Q164 HydrophobicContact CG-CB 4.44Å
121E96.1Very high96.2Very high94 Ų9445 Ų4544%0.43921%0.21SC..Hα-helixtrans-56.1-41.3-179.7-169.8-161.7147.700112.7K119 E124 K125K119-E121 VanDerWaalsContact C-N 3.29Å; K119-E121 PolarHBondContact O-N 3.1Å; E121-E124 PolarHBondContact O-N 3.39Å; E121-K125 WeakPolarHBondContact O-CG 3.3Å; E121-K125 PolarHBondContact O-N 2.99Å; E121-K125 IonicContact OE1-NZ 3.35Å; E121-K125 PolarHBondContact OE1-NZ 3.47Å
122W96.4Very high96.1Very high4 Ų448.1 Ų48.12%0.01522%0.224CC..Hα-helixtrans-73.3-39.6178.4-56.4-22.4000111.5D78 A81 A85 L116 K119 Q120 E124 K125 M126D78-W122 HydrophobicContact CB-CZ2 3.94Å; D78-W122 VanDerWaalsContact OD1-CH2 3.22Å; D78-W122 WeakPolarHBondContact OD1-CH2 3.46Å; D78-W122 VanDerWaalsContact OD1-CZ2 3.27Å; D78-W122 WeakPolarHBondContact OD1-CZ2 3.32Å; A81-W122 HydrophobicContact CB-CD2 3.96Å; A81-W122 HydrophobicContact CB-CE3 4.02Å; A81-W122 HydrophobicContact CB-CH2 3.55Å; A81-W122 HydrophobicContact CB-CZ2 3.48Å; A81-W122 VanDerWaalsContact CB-CZ2 3.48Å; A81-W122 HydrophobicContact CB-CZ3 3.83Å; A85-W122 HydrophobicContact CB-CB 4.3Å; L116-W122 WeakPolarHBondContact O-CB 3.42Å; K119-W122 HydrophobicContact CB-CD2 3.78Å; K119-W122 HydrophobicContact CB-CE3 3.79Å; K119-W122 HydrophobicContact CB-CG 4.17Å; K119-W122 HydrophobicContact CB-CZ3 4.22Å; K119-W122 HydrophobicContact CD-CD2 4.18Å; K119-W122 HydrophobicContact CD-CE3 4.33Å; K119-W122 HydrophobicContact CD-CH2 3.71Å; K119-W122 HydrophobicContact CD-CZ2 3.51Å; K119-W122 HydrophobicContact CD-CZ3 4.11Å; K119-W122 HydrophobicContact CG-CD2 4.11Å; K119-W122 HydrophobicContact CG-CE3 3.88Å; K119-W122 HydrophobicContact CG-CH2 3.9Å; K119-W122 HydrophobicContact CG-CZ2 4.11Å; K119-W122 HydrophobicContact CG-CZ3 3.77Å; K119-W122 PolarHBondContact O-N 3.32Å; K119-W122 VanDerWaalsContact O-N 3.17Å; Q120-W122 VanDerWaalsContact C-N 3.29Å; Q120-W122 PolarHBondContact O-N 2.98Å; W122-E124 VanDerWaalsContact C-N 3.28Å; W122-E124 PolarHBondContact O-N 3.5Å; W122-K125 PolarHBondContact O-N 2.86Å; W122-M126 WeakPolarHBondContact O-CB 3.42Å; W122-M126 VanDerWaalsContact O-CG 3.29Å; W122-M126 WeakPolarHBondContact O-CG 3.37Å; W122-M126 PolarHBondContact O-N 2.86Å
123C97.5Very high96Very high0 Ų049 Ų490%023%0.229CC..Hα-helixtrans-56.1-43.9171.4-78.10000111.5S117 K119 Q120 M126 S127 L165S117-C123 WeakPolarHBondContact CA-SG 3.16Å; S117-C123 PolarHBondContact O-SG 3.03Å; K119-C123 PolarHBondContact O-N 3.49Å; K119-C123 VanDerWaalsContact O-N 3.1Å; Q120-C123 CarbonylContact O-C 3.37Å; Q120-C123 WeakPolarHBondContact O-CA 3.34Å; Q120-C123 WeakPolarHBondContact O-CB 3.41Å; Q120-C123 PolarHBondContact O-N 3.19Å; Q120-C123 VanDerWaalsContact O-N 3.11Å; C123-M126 PolarHBondContact O-N 3.47Å; C123-S127 VanDerWaalsContact O-CB 3.23Å; C123-S127 WeakPolarHBondContact O-CB 3.46Å; C123-S127 PolarHBondContact O-N 2.89Å; C123-S127 PolarHBondContact O-OG 2.82Å; C123-L165 HydrophobicContact CB-CD1 3.94Å; C123-L165 HydrophobicContact CB-CD2 3.76Å; C123-L165 HydrophobicContact CB-CG 3.81Å
124E96.8Very high95.8Very high92 Ų9252 Ų5243%0.4325%0.248SC..Hα-helixtrans-67.4-39.7179.5-72171.2174.600112Q120 E121 W122 S127 L165Q120-E124 HydrophobicContact CG-CG 4.27Å; Q120-E124 WeakPolarHBondContact CG-OE1 3.35Å; Q120-E124 PolarHBondContact NE2-OE1 3.4Å; Q120-E124 WeakPolarHBondContact O-CG 3.2Å; Q120-E124 PolarHBondContact O-N 3.32Å; E121-E124 PolarHBondContact O-N 3.39Å; W122-E124 VanDerWaalsContact C-N 3.28Å; W122-E124 PolarHBondContact O-N 3.5Å; E124-S127 PolarHBondContact O-OG 3.3Å; E124-L165 HydrophobicContact CB-CD2 4.38Å; E124-L165 HydrophobicContact CG-CD2 3.64Å
125K95.6Very high95.7Very high36 Ų3654.5 Ų54.516%0.15726%0.26CS..Hα-helixtrans-59.7-50.7172.5-76.6170.5173.2166.60110.8E82 A85 E121 W122 R128E82-K125 IonicContact OE1-NZ 2.7Å; E82-K125 PolarHBondContact OE1-NZ 3.02Å; A85-K125 HydrophobicContact CB-CB 4.33Å; E121-K125 WeakPolarHBondContact O-CG 3.3Å; E121-K125 PolarHBondContact O-N 2.99Å; E121-K125 IonicContact OE1-NZ 3.35Å; E121-K125 PolarHBondContact OE1-NZ 3.47Å; W122-K125 PolarHBondContact O-N 2.86Å; K125-R128 PolarHBondContact O-NE 3.03Å
126M97.2Very high95.7Very high0 Ų053.1 Ų53.10%025%0.252CS..Hα-helixtrans-69.8-33.1-178.4-68.9-172-64.400113.3A85 V91 F95 L116 W122 C123 R128 H129 I130A85-M126 HydrophobicContact CB-CG 3.81Å; A85-M126 HydrophobicContact CB-SD 4.43Å; V91-M126 HydrophobicContact CG1-CB 3.9Å; V91-M126 HydrophobicContact CG1-CG 4.06Å; V91-M126 HydrophobicContact CG2-CB 4.48Å; V91-M126 HydrophobicContact CG2-CG 3.83Å; V91-M126 HydrophobicContact CG2-SD 4.43Å; F95-M126 HydrophobicContact CE2-SD 4.03Å; L116-M126 HydrophobicContact CB-CE 3.93Å; L116-M126 HydrophobicContact CB-SD 3.93Å; L116-M126 HydrophobicContact CD1-SD 4.44Å; L116-M126 WeakPolarHBondContact O-CE 3.31Å; W122-M126 WeakPolarHBondContact O-CB 3.42Å; W122-M126 VanDerWaalsContact O-CG 3.29Å; W122-M126 WeakPolarHBondContact O-CG 3.37Å; W122-M126 PolarHBondContact O-N 2.86Å; C123-M126 PolarHBondContact O-N 3.47Å; M126-R128 PolarHBondContact O-N 2.95Å; M126-H129 PolarHBondContact O-N 2.86Å; M126-I130 HydrophobicContact CB-CD1 4.34Å; M126-I130 PolarHBondContact O-N 2.91Å; M126-I130 VanDerWaalsContact O-N 3.16Å
127S96.3Very high95.6Very high30 Ų3053.3 Ų53.321%0.2125%0.253CS..Hα-helixtrans-61.8-23.8-171.163.80000113.7C123 E124 H129C123-S127 VanDerWaalsContact O-CB 3.23Å; C123-S127 WeakPolarHBondContact O-CB 3.46Å; C123-S127 PolarHBondContact O-N 2.89Å; C123-S127 PolarHBondContact O-OG 2.82Å; E124-S127 PolarHBondContact O-OG 3.3Å; S127-H129 PolarHBondContact O-N 3.13Å
128R93.5Very high95.4Very high173 Ų17354.7 Ų54.765%0.65326%0.263SS*.THydrogen-bonded Turntrans-65.3-20.8173.6-65-179.4-67.9157.11.4113.2K125 M126K125-R128 PolarHBondContact O-NE 3.03Å; M126-R128 PolarHBondContact O-N 2.95Å
129H95.6Very high95.3Very high28 Ų2850.3 Ų50.313%0.1325%0.248CC..THydrogen-bonded Turntrans-115.8-9.9-175-51.1-65.4000112.9E88 V91 V92 M126 S127 L131E88-H129 VanDerWaalsContact CG-ND1 3.34Å; E88-H129 WeakPolarHBondContact CG-ND1 3.41Å; E88-H129 IonicContact OE1-ND1 3.6Å; E88-H129 IonicContact OE2-CE1 3.15Å; V91-H129 HydrophobicContact CB-CB 4.19Å; V91-H129 HydrophobicContact CG1-CB 3.87Å; V92-H129 HydrophobicContact CG2-CB 4.23Å; M126-H129 PolarHBondContact O-N 2.86Å; S127-H129 PolarHBondContact O-N 3.13Å; H129-L131 PolarHBondContact O-N 2.92Å; H129-L131 VanDerWaalsContact O-N 3.1Å
130I95.8Very high95.3Very high13 Ų1346.5 Ų46.57%0.06723%0.231CC..  trans-74.2101.5171.6-61.3173.6000108.3V91 F95 M126 I133 L136 L162V91-I130 HydrophobicContact CG1-CG1 4.41Å; F95-I130 HydrophobicContact CD1-CD1 4.46Å; F95-I130 HydrophobicContact CD1-CG1 4.5Å; F95-I130 HydrophobicContact CD2-CD1 4.03Å; F95-I130 HydrophobicContact CD2-CG1 3.64Å; F95-I130 HydrophobicContact CE1-CD1 4.05Å; F95-I130 HydrophobicContact CE2-CD1 3.56Å; F95-I130 HydrophobicContact CE2-CG1 3.69Å; F95-I130 HydrophobicContact CG-CD1 4.45Å; F95-I130 HydrophobicContact CG-CG1 4.07Å; F95-I130 HydrophobicContact CZ-CD1 3.57Å; F95-I130 HydrophobicContact CZ-CG1 4.15Å; M126-I130 HydrophobicContact CB-CD1 4.34Å; M126-I130 PolarHBondContact O-N 2.91Å; M126-I130 VanDerWaalsContact O-N 3.16Å; I130-I133 HydrophobicContact CG2-CG1 4.08Å; I130-L136 HydrophobicContact CG2-CD2 3.59Å; I130-L162 HydrophobicContact CD1-CD2 4.23Å
131L92.2Very high95.2Very high119 Ų11942.1 Ų42.162%0.62321%0.211SC*.  trans-67.5147.4173.2-53.6-178.8000110.2R99 H129R99-L131 PolarHBondContact NH2-O 2.83Å; H129-L131 PolarHBondContact O-N 2.92Å; H129-L131 VanDerWaalsContact O-N 3.1Å
132D93.7Very high95Very high102 Ų10243.1 Ų43.155%0.54521%0.213SC..  trans41.675.5172-160.7-20.4000114.9R99 P134 D135 L136R99-D132 PolarHBondContact NH2-O 3.47Å; D132-P134 WeakPolarHBondContact OD1-CD 3.49Å; D132-D135 HydrophobicContact CB-CB 4.05Å; D132-D135 VanDerWaalsContact CG-CB 3.43Å; D132-D135 PolarHBondContact O-N 3.22Å; D132-D135 WeakPolarHBondContact OD1-CB 3.49Å; D132-D135 PolarHBondContact OD1-N 3.07Å; D132-L136 PolarHBondContact O-N 3.1Å
133I95.1Very high94.7Very high19 Ų1943.5 Ų43.510%0.09722%0.217CC..Hα-helixtrans-59.4-43.6178.1-72169.9000112.7I130 D135 L136 I137 V167 V168 A171I130-I133 HydrophobicContact CG2-CG1 4.08Å; I133-D135 VanDerWaalsContact C-N 3.33Å; I133-D135 PolarHBondContact O-N 2.94Å; I133-L136 WeakPolarHBondContact O-CB 3.4Å; I133-L136 PolarHBondContact O-N 3.31Å; I133-L136 VanDerWaalsContact O-N 3.12Å; I133-I137 HydrophobicContact CG2-CD1 3.85Å; I133-I137 HydrophobicContact CG2-CG1 4.34Å; I133-I137 WeakPolarHBondContact O-CG1 3.3Å; I133-I137 PolarHBondContact O-N 3.5Å; I133-V167 HydrophobicContact CD1-CB 4.12Å; I133-V167 HydrophobicContact CD1-CG1 3.47Å; I133-V167 VanDerWaalsContact CD1-CG1 3.47Å; I133-V167 HydrophobicContact CD1-CG2 3.54Å; I133-V168 HydrophobicContact CG2-CG2 3.93Å; I133-A171 HydrophobicContact CG2-CB 4.07Å
134P94.2Very high94.4Very high62 Ų6243.5 Ų43.540%0.40322%0.217SC..Hα-helixtrans-55.5-43.5174.5-28.536.6000113.9D132 I137 C138 A171D132-P134 WeakPolarHBondContact OD1-CD 3.49Å; P134-I137 PolarHBondContact O-N 3.41Å; P134-C138 PolarHBondContact O-N 2.88Å; P134-C138 VanDerWaalsContact O-N 3.08Å; P134-A171 HydrophobicContact CG-CB 4.43Å
135D94.2Very high94.1Very high63 Ų6341.8 Ų41.834%0.33721%0.21SC..Hα-helixtrans-63.9-42173.8174.773000111.9R99 D132 I133 I137 C138 V139R99-D135 WeakPolarHBondContact CD-OD2 3.25Å; R99-D135 IonicContact CZ-OD2 3.67Å; R99-D135 IonicContact NE-OD2 3.61Å; R99-D135 PolarHBondContact NE-OD2 2.88Å; R99-D135 IonicContact NH2-OD2 2.85Å; D132-D135 HydrophobicContact CB-CB 4.05Å; D132-D135 VanDerWaalsContact CG-CB 3.43Å; D132-D135 PolarHBondContact O-N 3.22Å; D132-D135 WeakPolarHBondContact OD1-CB 3.49Å; D132-D135 PolarHBondContact OD1-N 3.07Å; I133-D135 VanDerWaalsContact C-N 3.33Å; I133-D135 PolarHBondContact O-N 2.94Å; D135-I137 VanDerWaalsContact C-N 3.31Å; D135-I137 PolarHBondContact O-N 2.62Å; D135-C138 VanDerWaalsContact O-CB 3.31Å; D135-C138 WeakPolarHBondContact O-CB 3.45Å; D135-C138 PolarHBondContact O-N 2.98Å; D135-C138 VanDerWaalsContact O-N 3.13Å; D135-V139 PolarHBondContact O-N 3.14Å
136L96Very high93.8Very high4 Ų443 Ų432%0.02122%0.218CC..Hα-helixtrans-57.9-45.6176.1-173.454.5000111.5F95 V98 R99 I130 D132 I133 C138 V139 L140 L162F95-L136 HydrophobicContact CD1-CD1 4.02Å; F95-L136 HydrophobicContact CD1-CD2 3.61Å; F95-L136 HydrophobicContact CE1-CD2 3.79Å; V98-L136 HydrophobicContact CG1-CD1 4.32Å; R99-L136 HydrophobicContact CG-CD1 4.42Å; I130-L136 HydrophobicContact CG2-CD2 3.59Å; D132-L136 PolarHBondContact O-N 3.1Å; I133-L136 WeakPolarHBondContact O-CB 3.4Å; I133-L136 PolarHBondContact O-N 3.31Å; I133-L136 VanDerWaalsContact O-N 3.12Å; L136-C138 VanDerWaalsContact C-N 3.3Å; L136-C138 PolarHBondContact O-N 3.16Å; L136-V139 PolarHBondContact O-N 2.9Å; L136-L140 HydrophobicContact CD1-CD1 4.06Å; L136-L140 HydrophobicContact CD1-CD2 4.47Å; L136-L140 HydrophobicContact CD1-CG 4.02Å; L136-L140 HydrophobicContact CD2-CD1 4.4Å; L136-L140 HydrophobicContact CG-CD1 3.81Å; L136-L140 HydrophobicContact CG-CG 4.19Å; L136-L140 VanDerWaalsContact O-CG 3.31Å; L136-L140 WeakPolarHBondContact O-CG 3.38Å; L136-L140 PolarHBondContact O-N 3.36Å; L136-L162 HydrophobicContact CD2-CD1 3.77Å
137I96.1Very high93.2Very high3 Ų346.4 Ų46.42%0.01524%0.242CC..Hα-helixtrans-58.7-45.6177.5-68.3164.8000109.7I133 P134 D135 V139 L140 A141 L159 V168 A171 L172 F186I133-I137 HydrophobicContact CG2-CD1 3.85Å; I133-I137 HydrophobicContact CG2-CG1 4.34Å; I133-I137 WeakPolarHBondContact O-CG1 3.3Å; I133-I137 PolarHBondContact O-N 3.5Å; P134-I137 PolarHBondContact O-N 3.41Å; D135-I137 VanDerWaalsContact C-N 3.31Å; D135-I137 PolarHBondContact O-N 2.62Å; I137-V139 VanDerWaalsContact C-N 3.31Å; I137-V139 PolarHBondContact O-N 3.15Å; I137-L140 PolarHBondContact O-N 3.2Å; I137-A141 WeakPolarHBondContact O-CB 3.49Å; I137-A141 PolarHBondContact O-N 3.3Å; I137-L159 HydrophobicContact CG1-CD1 4.13Å; I137-L159 HydrophobicContact CG2-CD1 4.34Å; I137-V168 HydrophobicContact CD1-CG1 4.16Å; I137-V168 HydrophobicContact CG1-CG1 4.42Å; I137-A171 HydrophobicContact CD1-CB 3.57Å; I137-L172 HydrophobicContact CD1-CD2 4.29Å; I137-L172 HydrophobicContact CD1-CG 4.14Å; I137-L172 HydrophobicContact CG2-CD2 3.68Å; I137-F186 HydrophobicContact CG2-CZ 4.35Å
138C94Very high92.8Very high30 Ų3054.5 Ų54.520%0.20327%0.268CS..Hα-helixtrans-56-44.8176.2175.50000112.2P134 D135 L136 K142 Y181P134-C138 PolarHBondContact O-N 2.88Å; P134-C138 VanDerWaalsContact O-N 3.08Å; D135-C138 VanDerWaalsContact O-CB 3.31Å; D135-C138 WeakPolarHBondContact O-CB 3.45Å; D135-C138 PolarHBondContact O-N 2.98Å; D135-C138 VanDerWaalsContact O-N 3.13Å; L136-C138 VanDerWaalsContact C-N 3.3Å; L136-C138 PolarHBondContact O-N 3.16Å; C138-K142 WeakPolarHBondContact O-CG 3.2Å; C138-K142 PolarHBondContact O-N 2.77Å; C138-Y181 HydrophobicContact CB-CD2 3.56Å; C138-Y181 HydrophobicContact CB-CE2 3.82Å; C138-Y181 HydrophobicContact CB-CG 4.48Å; C138-Y181 WeakPolarHBondContact SG-CE2 3.24Å
139V93.8Very high92.3Very high13 Ų1347.4 Ų47.48%0.07925%0.245CC..Hα-helixtrans-65.2-46.1178.2168.20000111.9R99 D135 L136 I137 P143R99-V139 HydrophobicContact CB-CG2 4.46Å; R99-V139 HydrophobicContact CG-CB 4.5Å; R99-V139 HydrophobicContact CG-CG1 4.32Å; R99-V139 HydrophobicContact CG-CG2 4.12Å; D135-V139 PolarHBondContact O-N 3.14Å; L136-V139 PolarHBondContact O-N 2.9Å; I137-V139 VanDerWaalsContact C-N 3.31Å; I137-V139 PolarHBondContact O-N 3.15Å; V139-P143 WeakPolarHBondContact O-CD 3.23Å
140L95.2Very high91.5Very high0 Ų053.3 Ų53.30%028%0.277CS..Hα-helixtrans-72.7-28.8-178.5-63.8176.3000112.5V98 L136 I137 P143 F155 I158 L159 L162V98-L140 HydrophobicContact CG1-CD2 3.89Å; L136-L140 HydrophobicContact CD1-CD1 4.06Å; L136-L140 HydrophobicContact CD1-CD2 4.47Å; L136-L140 HydrophobicContact CD1-CG 4.02Å; L136-L140 HydrophobicContact CD2-CD1 4.4Å; L136-L140 HydrophobicContact CG-CD1 3.81Å; L136-L140 HydrophobicContact CG-CG 4.19Å; L136-L140 VanDerWaalsContact O-CG 3.31Å; L136-L140 WeakPolarHBondContact O-CG 3.38Å; L136-L140 PolarHBondContact O-N 3.36Å; I137-L140 PolarHBondContact O-N 3.2Å; L140-P143 WeakPolarHBondContact O-CD 3.21Å; L140-F155 HydrophobicContact CD2-CB 4.46Å; L140-F155 HydrophobicContact CD2-CD1 3.7Å; L140-F155 HydrophobicContact CD2-CE1 4.41Å; L140-F155 HydrophobicContact CD2-CG 4.46Å; L140-I158 HydrophobicContact CD1-CB 4.2Å; L140-I158 HydrophobicContact CD1-CG2 3.61Å; L140-I158 HydrophobicContact CD2-CB 4.1Å; L140-I158 HydrophobicContact CD2-CD1 4.08Å; L140-I158 HydrophobicContact CD2-CG2 4.04Å; L140-L159 HydrophobicContact CB-CB 4.04Å; L140-L159 HydrophobicContact CB-CD2 4.48Å; L140-L159 HydrophobicContact CD1-CB 4.17Å; L140-L159 HydrophobicContact CD1-CD1 4.44Å; L140-L162 HydrophobicContact CD1-CD1 3.93Å
141A93.5Very high90.5Very high0 Ų057 Ų570%029%0.293CS..Hα-helixtrans-67.6-36.4177.800000112.4I137 L144 L145 Y181 F186I137-A141 WeakPolarHBondContact O-CB 3.49Å; I137-A141 PolarHBondContact O-N 3.3Å; A141-L144 WeakPolarHBondContact O-CB 3.48Å; A141-L144 PolarHBondContact O-N 3.15Å; A141-L144 VanDerWaalsContact O-N 3.07Å; A141-L145 HydrophobicContact CB-CD1 4.44Å; A141-L145 VanDerWaalsContact O-CG 3.32Å; A141-L145 WeakPolarHBondContact O-CG 3.48Å; A141-L145 PolarHBondContact O-N 3.28Å; A141-Y181 HydrophobicContact CB-CD1 3.64Å; A141-Y181 HydrophobicContact CB-CE1 3.64Å; A141-Y181 HydrophobicContact CB-CG 4.32Å; A141-F186 HydrophobicContact CB-CE1 3.51Å; A141-F186 HydrophobicContact CB-CZ 3.55Å
142K91.7Very high89.8Confident114 Ų11451.9 Ų51.950%0.49627%0.267SS..Hα-helixtrans-55.3-52.9-176.2-75.7170-174177.50113C138 L144 L145 D146C138-K142 WeakPolarHBondContact O-CG 3.2Å; C138-K142 PolarHBondContact O-N 2.77Å; K142-L144 VanDerWaalsContact C-N 3.3Å; K142-L144 PolarHBondContact O-N 2.8Å; K142-L145 PolarHBondContact O-N 3.31Å; K142-D146 PolarHBondContact O-N 2.89Å
143P90.1Very high89.2Confident13 Ų1352.7 Ų52.78%0.08427%0.271CS..Hα-helixtrans-59.9-34.9174.1-27.235.5000114.4V139 L140 S149 F155V139-P143 WeakPolarHBondContact O-CD 3.23Å; L140-P143 WeakPolarHBondContact O-CD 3.21Å; P143-S149 WeakPolarHBondContact CB-OG 3.22Å; P143-S149 WeakPolarHBondContact O-CB 3.17Å; P143-F155 HydrophobicContact CB-CB 3.94Å; P143-F155 HydrophobicContact CB-CG 4.46Å; P143-F155 HydrophobicContact CG-CB 3.94Å; P143-F155 HydrophobicContact CG-CD1 4.11Å; P143-F155 HydrophobicContact CG-CG 4.06Å
144L90.6Very high89Confident0 Ų053.5 Ų53.50%028%0.277CS..Hα-helixtrans-69.3-35.917917258000111.6A141 K142 A156 L159 F186 W196 Q197 V201 I204A141-L144 WeakPolarHBondContact O-CB 3.48Å; A141-L144 PolarHBondContact O-N 3.15Å; A141-L144 VanDerWaalsContact O-N 3.07Å; K142-L144 VanDerWaalsContact C-N 3.3Å; K142-L144 PolarHBondContact O-N 2.8Å; L144-A156 HydrophobicContact CB-CB 4.42Å; L144-A156 HydrophobicContact CD1-CB 4Å; L144-L159 HydrophobicContact CD2-CD2 4.12Å; L144-F186 HydrophobicContact CD2-CD1 3.76Å; L144-F186 HydrophobicContact CD2-CE1 3.82Å; L144-F186 HydrophobicContact CG-CD1 4.43Å; L144-W196 HydrophobicContact CD1-CE3 4.47Å; L144-W196 HydrophobicContact CD1-CZ3 3.98Å; L144-Q197 PolarHBondContact O-NE2 3.31Å; L144-V201 HydrophobicContact CD1-CG2 4.48Å; L144-V201 HydrophobicContact CD2-CG2 4.3Å; L144-I204 HydrophobicContact CD2-CD1 3.83Å
145L90.5Very high88.9Confident55 Ų5550.6 Ų50.629%0.28826%0.258SS..Hα-helixtrans-85.7-19.1-179-62179.4000113.4A141 K142 Y181 F186 C189A141-L145 HydrophobicContact CB-CD1 4.44Å; A141-L145 VanDerWaalsContact O-CG 3.32Å; A141-L145 WeakPolarHBondContact O-CG 3.48Å; A141-L145 PolarHBondContact O-N 3.28Å; K142-L145 PolarHBondContact O-N 3.31Å; L145-Y181 HydrophobicContact CD1-CE1 3.73Å; L145-F186 HydrophobicContact CD2-CD1 3.92Å; L145-F186 HydrophobicContact CG-CD1 4.43Å; L145-C189 WeakPolarHBondContact CD2-SG 3.39Å
146D90.6Very high88.8Confident61 Ų6147.7 Ų47.733%0.32624%0.242SC..  trans-89107.4174.6-174.44.6000111.4K142 R148 S149K142-D146 PolarHBondContact O-N 2.89Å; D146-R148 PolarHBondContact O-N 2.83Å; D146-R148 WeakPolarHBondContact OD1-CB 3.39Å; D146-R148 PolarHBondContact OD1-N 3.37Å; D146-R148 IonicContact OD1-NE 3.57Å; D146-R148 PolarHBondContact OD1-NE 3.28Å; D146-S149 WeakPolarHBondContact O-CB 3.45Å; D146-S149 PolarHBondContact O-N 2.98Å
147S85.2Confident88.8Confident73 Ų7350.4 Ų50.451%0.5126%0.261SS..THydrogen-bonded Turntrans-63.7-7.7178.364.70000114.3
148R87.1Confident88.8Confident200 Ų20050.2 Ų50.276%0.75526%0.26SS*.THydrogen-bonded Turntrans-105.8-0.3177.1-56.8172.4-63.5174.23.4113.4D146D146-R148 PolarHBondContact O-N 2.83Å; D146-R148 WeakPolarHBondContact OD1-CB 3.39Å; D146-R148 PolarHBondContact OD1-N 3.37Å; D146-R148 IonicContact OD1-NE 3.57Å; D146-R148 PolarHBondContact OD1-NE 3.28Å
149S83.6Confident89Confident23 Ų2348.8 Ų48.816%0.16125%0.251CS..  trans-64.7137.5-178.81640000110.6P143 D146 F151 V152P143-S149 WeakPolarHBondContact CB-OG 3.22Å; P143-S149 WeakPolarHBondContact O-CB 3.17Å; D146-S149 WeakPolarHBondContact O-CB 3.45Å; D146-S149 PolarHBondContact O-N 2.98Å; S149-F151 PolarHBondContact OG-N 3.34Å; S149-V152 WeakPolarHBondContact O-CG2 3.49Å
150N78.1Confident89.1Confident152 Ų15249.1 Ų49.181%0.81325%0.253SS*.SBendtrans-89.6-6.2175.1-68.3-36.6000112.9
151F75.9Confident89.2Confident92 Ų9250.6 Ų50.640%0.40426%0.261SS..SBendtrans-109.619.3-174.8-56.2-61.6000112.1P107 S149 F155P107-F151 HydrophobicContact CB-CD1 4.07Å; P107-F151 HydrophobicContact CB-CE1 3.82Å; P107-F151 HydrophobicContact CG-CD1 3.89Å; P107-F151 HydrophobicContact CG-CE1 3.26Å; P107-F151 HydrophobicContact CG-CZ 3.79Å; S149-F151 PolarHBondContact OG-N 3.34Å; F151-F155 HydrophobicContact CB-CD2 3.75Å; F151-F155 HydrophobicContact CB-CE2 3.96Å; F151-F155 VanDerWaalsContact O-CD2 3.29Å; F151-F155 WeakPolarHBondContact O-CD2 3.27Å; F151-F155 PolarHBondContact O-N 3.44Å
152V76.7Confident89.5Confident10 Ų1050.8 Ų50.86%0.06126%0.262CS..Hα-helixtrans-65.8-52-165.6-160.10000112S149 T154 F155 A156 W196S149-V152 WeakPolarHBondContact O-CG2 3.49Å; V152-T154 PolarHBondContact O-N 2.85Å; V152-F155 PolarHBondContact O-N 3.3Å; V152-F155 VanDerWaalsContact O-N 3.17Å; V152-A156 HydrophobicContact CG1-CB 4.17Å; V152-A156 WeakPolarHBondContact O-CB 3.43Å; V152-A156 PolarHBondContact O-N 3.49Å; V152-W196 HydrophobicContact CB-CE3 4.33Å; V152-W196 HydrophobicContact CB-CH2 4.04Å; V152-W196 HydrophobicContact CB-CZ3 3.95Å; V152-W196 HydrophobicContact CG1-CD2 4.33Å; V152-W196 HydrophobicContact CG1-CE3 3.45Å; V152-W196 VanDerWaalsContact CG1-CE3 3.45Å; V152-W196 HydrophobicContact CG1-CH2 3.33Å; V152-W196 HydrophobicContact CG1-CZ2 4.2Å; V152-W196 HydrophobicContact CG1-CZ3 2.89Å; V152-W196 HydrophobicContact CG2-CH2 3.74Å; V152-W196 HydrophobicContact CG2-CZ2 3.99Å; V152-W196 HydrophobicContact CG2-CZ3 4.18Å
153D81.7Confident89.8Confident120 Ų12045.4 Ų45.464%0.64224%0.238SC*.Hα-helixtrans-53.8-47.3-173-60.2-27.4000110.2C157D153-C157 WeakPolarHBondContact O-CB 3.45Å; D153-C157 PolarHBondContact O-N 2.59Å; D153-C157 PolarHBondContact O-SG 2.88Å
154T90.8Very high90.1Very high35 Ų3546.8 Ų46.822%0.21524%0.244CC..Hα-helixtrans-65.4-51.5-179.9-51.70000112.7G110 S111 A114 V152 C157 I158G110-T154 WeakPolarHBondContact O-CG2 3.12Å; S111-T154 VanDerWaalsContact N-CG2 3.26Å; A114-T154 HydrophobicContact CB-CG2 4.12Å; V152-T154 PolarHBondContact O-N 2.85Å; T154-C157 WeakPolarHBondContact O-CB 3.14Å; T154-C157 PolarHBondContact O-N 2.99Å; T154-I158 VanDerWaalsContact O-CG1 3.31Å; T154-I158 WeakPolarHBondContact O-CG1 3.48Å; T154-I158 PolarHBondContact O-N 3.46Å
155F92.3Very high90.5Very high1 Ų147.2 Ų47.20%0.00425%0.246CC..Hα-helixtrans-76.9-35.3-171.6-77.6-109.8000112.6V98 R106 L140 P143 F151 V152 I158 L159V98-F155 HydrophobicContact CG1-CE1 3.98Å; R106-F155 HydrophobicContact CG-CZ 4.06Å; L140-F155 HydrophobicContact CD2-CB 4.46Å; L140-F155 HydrophobicContact CD2-CD1 3.7Å; L140-F155 HydrophobicContact CD2-CE1 4.41Å; L140-F155 HydrophobicContact CD2-CG 4.46Å; P143-F155 HydrophobicContact CB-CB 3.94Å; P143-F155 HydrophobicContact CB-CG 4.46Å; P143-F155 HydrophobicContact CG-CB 3.94Å; P143-F155 HydrophobicContact CG-CD1 4.11Å; P143-F155 HydrophobicContact CG-CG 4.06Å; F151-F155 HydrophobicContact CB-CD2 3.75Å; F151-F155 HydrophobicContact CB-CE2 3.96Å; F151-F155 VanDerWaalsContact O-CD2 3.29Å; F151-F155 WeakPolarHBondContact O-CD2 3.27Å; F151-F155 PolarHBondContact O-N 3.44Å; V152-F155 PolarHBondContact O-N 3.3Å; V152-F155 VanDerWaalsContact O-N 3.17Å; F155-I158 PolarHBondContact O-N 3.19Å; F155-L159 PolarHBondContact O-N 3.4Å; F155-L159 VanDerWaalsContact O-N 3.16Å
156A91.8Very high90.8Very high2 Ų248.3 Ų48.32%0.01725%0.249CC..Hα-helixtrans-63.5-43.717000000110.7L144 V152 I158 L159 V160L144-A156 HydrophobicContact CB-CB 4.42Å; L144-A156 HydrophobicContact CD1-CB 4Å; V152-A156 HydrophobicContact CG1-CB 4.17Å; V152-A156 WeakPolarHBondContact O-CB 3.43Å; V152-A156 PolarHBondContact O-N 3.49Å; A156-I158 VanDerWaalsContact C-N 3.33Å; A156-I158 PolarHBondContact O-N 3.19Å; A156-L159 PolarHBondContact O-N 2.98Å; A156-V160 WeakPolarHBondContact O-CB 3.36Å; A156-V160 VanDerWaalsContact O-CG2 3.27Å; A156-V160 WeakPolarHBondContact O-CG2 3.37Å; A156-V160 PolarHBondContact O-N 3.06Å
157C94.8Very high91Very high61 Ų6147.5 Ų47.541%0.41225%0.246SC..Hα-helixtrans-57-44.5174.2-790000112A114 D153 T154 L159 V160 N161A114-C157 HydrophobicContact CB-CB 4.35Å; D153-C157 WeakPolarHBondContact O-CB 3.45Å; D153-C157 PolarHBondContact O-N 2.59Å; D153-C157 PolarHBondContact O-SG 2.88Å; T154-C157 WeakPolarHBondContact O-CB 3.14Å; T154-C157 PolarHBondContact O-N 2.99Å; C157-L159 PolarHBondContact O-N 3.22Å; C157-V160 PolarHBondContact O-N 3.33Å; C157-N161 WeakPolarHBondContact O-CB 3.32Å; C157-N161 PolarHBondContact O-N 3.01Å; C157-N161 PolarHBondContact O-ND2 3.29Å
158I97.4Very high91.6Very high0 Ų044.2 Ų44.20%022%0.223CC..Hα-helixtrans-58-49.5176.8-61.3161.8000110.2F95 G110 A113 A114 L140 T154 F155 A156 N161 L162F95-I158 HydrophobicContact CE1-CG2 4.49Å; G110-I158 WeakPolarHBondContact O-CD1 3.41Å; A113-I158 HydrophobicContact CB-CD1 3.77Å; A113-I158 HydrophobicContact CB-CG1 4.09Å; A114-I158 HydrophobicContact CB-CG1 3.88Å; L140-I158 HydrophobicContact CD1-CB 4.2Å; L140-I158 HydrophobicContact CD1-CG2 3.61Å; L140-I158 HydrophobicContact CD2-CB 4.1Å; L140-I158 HydrophobicContact CD2-CD1 4.08Å; L140-I158 HydrophobicContact CD2-CG2 4.04Å; T154-I158 VanDerWaalsContact O-CG1 3.31Å; T154-I158 WeakPolarHBondContact O-CG1 3.48Å; T154-I158 PolarHBondContact O-N 3.46Å; F155-I158 PolarHBondContact O-N 3.19Å; A156-I158 VanDerWaalsContact C-N 3.33Å; A156-I158 PolarHBondContact O-N 3.19Å; I158-N161 PolarHBondContact O-N 3.4Å; I158-L162 HydrophobicContact CG2-CD1 3.73Å; I158-L162 HydrophobicContact CG2-CG 4.1Å; I158-L162 WeakPolarHBondContact O-CB 3.24Å; I158-L162 VanDerWaalsContact O-CG 3.25Å; I158-L162 WeakPolarHBondContact O-CG 3.49Å; I158-L162 PolarHBondContact O-N 2.84Å
159L97.1Very high92.1Very high0 Ų036 Ų360%019%0.192CC..Hα-helixtrans-63.3-48.8-178.2-178.256.8000111.5I137 L140 L144 F155 A156 C157 N161 L162 T163 F186 I204I137-L159 HydrophobicContact CG1-CD1 4.13Å; I137-L159 HydrophobicContact CG2-CD1 4.34Å; L140-L159 HydrophobicContact CB-CB 4.04Å; L140-L159 HydrophobicContact CB-CD2 4.48Å; L140-L159 HydrophobicContact CD1-CB 4.17Å; L140-L159 HydrophobicContact CD1-CD1 4.44Å; L144-L159 HydrophobicContact CD2-CD2 4.12Å; F155-L159 PolarHBondContact O-N 3.4Å; F155-L159 VanDerWaalsContact O-N 3.16Å; A156-L159 PolarHBondContact O-N 2.98Å; C157-L159 PolarHBondContact O-N 3.22Å; L159-N161 VanDerWaalsContact C-N 3.29Å; L159-N161 PolarHBondContact O-N 2.81Å; L159-L162 PolarHBondContact O-N 2.99Å; L159-T163 WeakPolarHBondContact O-CG2 3.02Å; L159-T163 PolarHBondContact O-N 3Å; L159-T163 VanDerWaalsContact O-N 3.1Å; L159-F186 HydrophobicContact CD2-CE1 3.77Å; L159-F186 HydrophobicContact CD2-CZ 3.77Å; L159-I204 HydrophobicContact CD2-CD1 3.81Å; L159-I204 HydrophobicContact CG-CD1 3.87Å
160V96.8Very high92.7Very high20 Ų2040.3 Ų40.312%0.12121%0.205CC..Hα-helixtrans-53.1-49.4175168.60000110.3A156 C157 L162 T163 R203 I204 N207A156-V160 WeakPolarHBondContact O-CB 3.36Å; A156-V160 VanDerWaalsContact O-CG2 3.27Å; A156-V160 WeakPolarHBondContact O-CG2 3.37Å; A156-V160 PolarHBondContact O-N 3.06Å; C157-V160 PolarHBondContact O-N 3.33Å; V160-L162 PolarHBondContact O-N 3.13Å; V160-T163 PolarHBondContact O-N 3.37Å; V160-T163 PolarHBondContact O-OG1 3.04Å; V160-R203 HydrophobicContact CG1-CB 4.18Å; V160-R203 HydrophobicContact CG1-CG 3.49Å; V160-R203 VanDerWaalsContact CG1-CG 3.49Å; V160-I204 HydrophobicContact CG2-CD1 4.18Å; V160-I204 HydrophobicContact CG2-CG1 3.86Å; V160-N207 PolarHBondContact O-ND2 2.86Å
161N97.9Very high93.6Very high31 Ų3134.1 Ų34.117%0.16618%0.175CC..Hα-helixtrans-64.1-42.8-179.9-76-7.9000112.8A114 S117 C157 I158 L159 T163 Q164A114-N161 PolarHBondContact O-ND2 3.17Å; S117-N161 WeakPolarHBondContact O-CB 3.38Å; S117-N161 WeakPolarHBondContact OG-CB 3.37Å; S117-N161 PolarHBondContact OG-ND2 3.19Å; C157-N161 WeakPolarHBondContact O-CB 3.32Å; C157-N161 PolarHBondContact O-N 3.01Å; C157-N161 PolarHBondContact O-ND2 3.29Å; I158-N161 PolarHBondContact O-N 3.4Å; L159-N161 VanDerWaalsContact C-N 3.29Å; L159-N161 PolarHBondContact O-N 2.81Å; N161-T163 PolarHBondContact O-N 3.04Å; N161-Q164 VanDerWaalsContact O-CB 3.29Å; N161-Q164 WeakPolarHBondContact O-CB 3.49Å; N161-Q164 WeakPolarHBondContact O-CG 3.37Å; N161-Q164 PolarHBondContact O-N 2.82Å; N161-Q164 VanDerWaalsContact O-N 3.11Å; N161-Q164 PolarHBondContact O-NE2 3.14Å
162L98.1Very high94.6Very high4 Ų429.8 Ų29.82%0.02116%0.156CC..Hα-helixtrans-66-24.5179.5-74.5179.9000112.7F95 I130 L136 L140 I158 L159 V160 Q164 L165 V168F95-L162 HydrophobicContact CE1-CD1 4.26Å; I130-L162 HydrophobicContact CD1-CD2 4.23Å; L136-L162 HydrophobicContact CD2-CD1 3.77Å; L140-L162 HydrophobicContact CD1-CD1 3.93Å; I158-L162 HydrophobicContact CG2-CD1 3.73Å; I158-L162 HydrophobicContact CG2-CG 4.1Å; I158-L162 WeakPolarHBondContact O-CB 3.24Å; I158-L162 VanDerWaalsContact O-CG 3.25Å; I158-L162 WeakPolarHBondContact O-CG 3.49Å; I158-L162 PolarHBondContact O-N 2.84Å; L159-L162 PolarHBondContact O-N 2.99Å; V160-L162 PolarHBondContact O-N 3.13Å; L162-Q164 PolarHBondContact O-N 2.68Å; L162-Q164 VanDerWaalsContact O-N 3.07Å; L162-L165 HydrophobicContact CD2-CD1 4.25Å; L162-L165 WeakPolarHBondContact O-CB 3.29Å; L162-L165 PolarHBondContact O-N 3.27Å; L162-V168 HydrophobicContact CB-CG1 4.33Å; L162-V168 HydrophobicContact CB-CG2 4.21Å; L162-V168 WeakPolarHBondContact O-CB 3.27Å; L162-V168 WeakPolarHBondContact O-CG2 3.22Å
163T98.2Very high95.6Very high0 Ų029.4 Ų29.40%015%0.153CC..THydrogen-bonded Turntrans-66.1-4172.760.70000114.3L159 V160 N161 L165 V168 R169 L172 I204 N207L159-T163 WeakPolarHBondContact O-CG2 3.02Å; L159-T163 PolarHBondContact O-N 3Å; L159-T163 VanDerWaalsContact O-N 3.1Å; V160-T163 PolarHBondContact O-N 3.37Å; V160-T163 PolarHBondContact O-OG1 3.04Å; N161-T163 PolarHBondContact O-N 3.04Å; T163-L165 PolarHBondContact O-N 3.3Å; T163-V168 HydrophobicContact CG2-CG1 4.01Å; T163-R169 WeakPolarHBondContact O-CG 3.32Å; T163-R169 PolarHBondContact O-NE 3.11Å; T163-L172 HydrophobicContact CG2-CD1 3.53Å; T163-I204 HydrophobicContact CG2-CG1 4.29Å; T163-I204 HydrophobicContact CG2-CG2 4.11Å; T163-N207 VanDerWaalsContact OG1-CB 3.22Å; T163-N207 WeakPolarHBondContact OG1-CB 3.47Å; T163-N207 PolarHBondContact OG1-ND2 3.17Å
164Q97.2Very high96.1Very high43 Ų4325.6 Ų25.620%0.20114%0.135CC..THydrogen-bonded Turntrans-61.4-24.6163.1-68.217488.400112S117 R118 Q120 N161 L162 R169S117-Q164 PolarHBondContact O-NE2 3.29Å; R118-Q164 PolarHBondContact O-NE2 3.2Å; Q120-Q164 HydrophobicContact CB-CB 4.37Å; Q120-Q164 HydrophobicContact CG-CB 4.44Å; N161-Q164 VanDerWaalsContact O-CB 3.29Å; N161-Q164 WeakPolarHBondContact O-CB 3.49Å; N161-Q164 WeakPolarHBondContact O-CG 3.37Å; N161-Q164 PolarHBondContact O-N 2.82Å; N161-Q164 VanDerWaalsContact O-N 3.11Å; N161-Q164 PolarHBondContact O-NE2 3.14Å; L162-Q164 PolarHBondContact O-N 2.68Å; L162-Q164 VanDerWaalsContact O-N 3.07Å; Q164-R169 PolarHBondContact O-NH2 3.28Å
165L98Very high96Very high8 Ų827.7 Ų27.74%0.04215%0.145CC..SBendtrans-86.2132.2-178.4-62.3172000112.6C123 E124 L162 T163 V167 V168 R169C123-L165 HydrophobicContact CB-CD1 3.94Å; C123-L165 HydrophobicContact CB-CD2 3.76Å; C123-L165 HydrophobicContact CB-CG 3.81Å; E124-L165 HydrophobicContact CB-CD2 4.38Å; E124-L165 HydrophobicContact CG-CD2 3.64Å; L162-L165 HydrophobicContact CD2-CD1 4.25Å; L162-L165 WeakPolarHBondContact O-CB 3.29Å; L162-L165 PolarHBondContact O-N 3.27Å; T163-L165 PolarHBondContact O-N 3.3Å; L165-V167 HydrophobicContact CB-CG1 4.08Å; L165-V167 PolarHBondContact O-N 3.09Å; L165-V168 HydrophobicContact CB-CB 4.28Å; L165-V168 HydrophobicContact CB-CG2 3.93Å; L165-V168 HydrophobicContact CD1-CG2 4.08Å; L165-V168 PolarHBondContact O-N 3.26Å; L165-R169 WeakPolarHBondContact O-CG 2.95Å; L165-R169 PolarHBondContact O-N 3.11Å; L165-R169 VanDerWaalsContact O-N 3.07Å
166H97.1Very high95.5Very high78 Ų7835.4 Ų35.436%0.36119%0.186SC..Hα-helixtrans-48.5-46.6171.6170.974.3000112.3V168 R169 R170 D211H166-V168 VanDerWaalsContact C-N 3.27Å; H166-V168 PolarHBondContact O-N 3.17Å; H166-R169 PolarHBondContact O-N 3.1Å; H166-R170 VanDerWaalsContact O-CB 3.31Å; H166-R170 WeakPolarHBondContact O-CB 3.49Å; H166-R170 PolarHBondContact O-N 2.87Å; H166-D211 IonicContact CE1-OD2 3.79Å; H166-D211 IonicContact CG-OD2 3.41Å; H166-D211 IonicContact ND1-OD1 2.73Å; H166-D211 IonicContact ND1-OD2 3.78Å; H166-D211 PolarHBondContact ND1-OD2 3Å
167V96.1Very high94.8Very high44 Ų4439 Ų3927%0.26722%0.223SC..Hα-helixtrans-63.7-30.9-177.161.90000113I133 L165 A171I133-V167 HydrophobicContact CD1-CB 4.12Å; I133-V167 HydrophobicContact CD1-CG1 3.47Å; I133-V167 VanDerWaalsContact CD1-CG1 3.47Å; I133-V167 HydrophobicContact CD1-CG2 3.54Å; L165-V167 HydrophobicContact CB-CG1 4.08Å; L165-V167 PolarHBondContact O-N 3.09Å; V167-A171 WeakPolarHBondContact O-CB 3.31Å; V167-A171 PolarHBondContact O-N 2.83Å; V167-A171 VanDerWaalsContact O-N 3.12Å
168V97.6Very high94.2Very high4 Ų440.6 Ų40.62%0.02423%0.225CC..Hα-helixtrans-78.2-43.6177.2178.50000110.3I133 I137 L162 T163 L165 H166 R170 A171 L172I133-V168 HydrophobicContact CG2-CG2 3.93Å; I137-V168 HydrophobicContact CD1-CG1 4.16Å; I137-V168 HydrophobicContact CG1-CG1 4.42Å; L162-V168 HydrophobicContact CB-CG1 4.33Å; L162-V168 HydrophobicContact CB-CG2 4.21Å; L162-V168 WeakPolarHBondContact O-CB 3.27Å; L162-V168 WeakPolarHBondContact O-CG2 3.22Å; T163-V168 HydrophobicContact CG2-CG1 4.01Å; L165-V168 HydrophobicContact CB-CB 4.28Å; L165-V168 HydrophobicContact CB-CG2 3.93Å; L165-V168 HydrophobicContact CD1-CG2 4.08Å; L165-V168 PolarHBondContact O-N 3.26Å; H166-V168 VanDerWaalsContact C-N 3.27Å; H166-V168 PolarHBondContact O-N 3.17Å; V168-R170 VanDerWaalsContact C-N 3.29Å; V168-R170 PolarHBondContact O-N 3.07Å; V168-A171 PolarHBondContact O-N 3.04Å; V168-L172 HydrophobicContact CG1-CD1 4.43Å; V168-L172 PolarHBondContact O-N 3.22Å
169R97.6Very high93.3Very high29 Ų2946.2 Ų46.211%0.10926%0.264CS..Hα-helixtrans-57.8-43.6172.8-60.2174.2-155.7-1789.3111T163 Q164 L165 H166 A171 L172 L173 N207 M210 L214T163-R169 WeakPolarHBondContact O-CG 3.32Å; T163-R169 PolarHBondContact O-NE 3.11Å; Q164-R169 PolarHBondContact O-NH2 3.28Å; L165-R169 WeakPolarHBondContact O-CG 2.95Å; L165-R169 PolarHBondContact O-N 3.11Å; L165-R169 VanDerWaalsContact O-N 3.07Å; H166-R169 PolarHBondContact O-N 3.1Å; R169-A171 VanDerWaalsContact C-N 3.34Å; R169-A171 PolarHBondContact O-N 3.24Å; R169-L172 PolarHBondContact O-N 2.94Å; R169-L173 PolarHBondContact O-N 3.07Å; R169-N207 VanDerWaalsContact CD-O 3.23Å; R169-N207 WeakPolarHBondContact CD-O 3.34Å; R169-N207 PolarHBondContact NE-O 3.22Å; R169-M210 VanDerWaalsContact NH1-CB 3.3Å; R169-M210 PolarHBondContact NH1-O 3.06Å; R169-M210 VanDerWaalsContact NH1-O 3.07Å; R169-L214 HydrophobicContact CB-CD1 3.6Å
170R96.4Very high92.4Very high113 Ų11348.8 Ų48.843%0.42629%0.291SS..Hα-helixtrans-61.9-40176.8-169.8-178.977.5-172.54.5112.2H166 V168 L173 L214H166-R170 VanDerWaalsContact O-CB 3.31Å; H166-R170 WeakPolarHBondContact O-CB 3.49Å; H166-R170 PolarHBondContact O-N 2.87Å; V168-R170 VanDerWaalsContact C-N 3.29Å; V168-R170 PolarHBondContact O-N 3.07Å; R170-L173 CarbonylContact O-C 3.53Å; R170-L173 VanDerWaalsContact O-C 3.25Å; R170-L173 PolarHBondContact O-N 3.27Å; R170-L173 VanDerWaalsContact O-O 3.05Å; R170-L214 HydrophobicContact CB-CD1 4.07Å; R170-L214 HydrophobicContact CB-CD2 4.18Å; R170-L214 HydrophobicContact CG-CD2 4.07Å
171A95.9Very high92Very high22 Ų2250.7 Ų50.718%0.18230%0.297CS..Hα-helixtrans-68.6-33.6176.500000112.5I133 P134 I137 V167 V168 R169 L173I133-A171 HydrophobicContact CG2-CB 4.07Å; P134-A171 HydrophobicContact CG-CB 4.43Å; I137-A171 HydrophobicContact CD1-CB 3.57Å; V167-A171 WeakPolarHBondContact O-CB 3.31Å; V167-A171 PolarHBondContact O-N 2.83Å; V167-A171 VanDerWaalsContact O-N 3.12Å; V168-A171 PolarHBondContact O-N 3.04Å; R169-A171 VanDerWaalsContact C-N 3.34Å; R169-A171 PolarHBondContact O-N 3.24Å; A171-L173 VanDerWaalsContact C-N 3.33Å
172L97.3Very high91.8Very high0 Ų050.1 Ų50.10%030%0.295CS..Hα-helixtrans-76-19.7174.3-71.8172000113.7I137 T163 V168 R169 P174 S182 I183 F186 I204I137-L172 HydrophobicContact CD1-CD2 4.29Å; I137-L172 HydrophobicContact CD1-CG 4.14Å; I137-L172 HydrophobicContact CG2-CD2 3.68Å; T163-L172 HydrophobicContact CG2-CD1 3.53Å; V168-L172 HydrophobicContact CG1-CD1 4.43Å; V168-L172 PolarHBondContact O-N 3.22Å; R169-L172 PolarHBondContact O-N 2.94Å; L172-P174 WeakPolarHBondContact O-CD 3.12Å; L172-S182 CarbonylContact O-C 3.6Å; L172-S182 WeakPolarHBondContact O-CA 3.36Å; L172-I183 PolarHBondContact O-N 3.4Å; L172-F186 HydrophobicContact CD2-CE2 3.65Å; L172-F186 HydrophobicContact CD2-CZ 4.32Å; L172-I204 HydrophobicContact CD1-CG2 3.85Å
173L96.6Very high91.7Very high2 Ų250 Ų501%0.0129%0.294CS..SBendtrans-114.269.1175.6-64.6174.2000109.9R169 R170 A171 I183 C208 L214 R217 I218 I221R169-L173 PolarHBondContact O-N 3.07Å; R170-L173 CarbonylContact O-C 3.53Å; R170-L173 VanDerWaalsContact O-C 3.25Å; R170-L173 PolarHBondContact O-N 3.27Å; R170-L173 VanDerWaalsContact O-O 3.05Å; A171-L173 VanDerWaalsContact C-N 3.33Å; L173-I183 HydrophobicContact CD2-CG2 3.75Å; L173-C208 HydrophobicContact CD1-CB 4.15Å; L173-L214 HydrophobicContact CD1-CB 3.97Å; L173-L214 HydrophobicContact CD1-CD1 4.48Å; L173-R217 HydrophobicContact CB-CB 4.08Å; L173-R217 WeakPolarHBondContact O-CD 3.41Å; L173-R217 PolarHBondContact O-NH1 3.45Å; L173-I218 HydrophobicContact CD1-CD1 4.12Å; L173-I218 HydrophobicContact CD1-CG1 3.82Å; L173-I218 HydrophobicContact CD2-CG1 3.86Å; L173-I221 HydrophobicContact CD2-CD1 4.04Å
174P93.1Very high91.5Very high41 Ų4153.3 Ų53.327%0.26631%0.311SS..PPolyproline II helixtrans-64.7148.1-177.725-32.7000112.3L172 E178L172-P174 WeakPolarHBondContact O-CD 3.12Å; P174-E178 WeakPolarHBondContact CA-OE2 3.08Å; P174-E178 HydrophobicContact CB-CB 3.54Å
175N89.3Confident91.4Very high78 Ų7854.7 Ų54.742%0.41732%0.32SS..PPolyproline II helixtrans-71.3165.5164.3-77.5-26.4000111G177 E178 R217N175-G177 PolarHBondContact O-N 3.21Å; N175-G177 VanDerWaalsContact O-N 3.12Å; N175-E178 HydrophobicContact CB-CG 4.36Å; N175-E178 PolarHBondContact N-OE2 2.89Å; N175-E178 WeakPolarHBondContact O-CB 3.23Å; N175-E178 PolarHBondContact O-N 2.97Å; N175-R217 PolarHBondContact ND2-NH2 3.37Å; N175-R217 VanDerWaalsContact ND2-NH2 3.2Å; N175-R217 PolarHBondContact OD1-NE 3.41Å
176N80.4Confident91.2Very high163 Ų16354.3 Ų54.387%0.87232%0.318SS*.THydrogen-bonded Turntrans-52121.6172.7-69.2-11.1000111
177G77.2Confident91Very high77 Ų7751.3 Ų51.379%0.79431%0.305SS*.THydrogen-bonded Turntrans93.5-13.3179.200000115.3N175 S179N175-G177 PolarHBondContact O-N 3.21Å; N175-G177 VanDerWaalsContact O-N 3.12Å; G177-S179 PolarHBondContact O-N 2.83Å
178E82.3Confident90.9Very high95 Ų9552.5 Ų52.544%0.44431%0.313SS..  trans-70.6128.5168.9-72.1172.3-173.400108.9P174 N175 R217P174-E178 WeakPolarHBondContact CA-OE2 3.08Å; P174-E178 HydrophobicContact CB-CB 3.54Å; N175-E178 HydrophobicContact CB-CG 4.36Å; N175-E178 PolarHBondContact N-OE2 2.89Å; N175-E178 WeakPolarHBondContact O-CB 3.23Å; N175-E178 PolarHBondContact O-N 2.97Å; E178-R217 IonicContact OE2-NH1 3.78Å
179S78.3Confident90.6Very high118 Ų11852.8 Ų52.883%0.82532%0.316SS*.  trans-102.8148.5-178.4-630000110.5G177G177-S179 PolarHBondContact O-N 2.83Å
180G79.4Confident90.4Very high55 Ų5552 Ų5257%0.56731%0.313SS*.SBendtrans142.8-173.217800000112.3S182G180-S182 PolarHBondContact O-N 2.83Å
181Y87.9Confident90Very high60 Ų6051.6 Ų51.624%0.23532%0.315CS..  trans-70.3121.1169.7-89.9-102.4000109.5C138 A141 L145 N185 F186C138-Y181 HydrophobicContact CB-CD2 3.56Å; C138-Y181 HydrophobicContact CB-CE2 3.82Å; C138-Y181 HydrophobicContact CB-CG 4.48Å; C138-Y181 WeakPolarHBondContact SG-CE2 3.24Å; A141-Y181 HydrophobicContact CB-CD1 3.64Å; A141-Y181 HydrophobicContact CB-CE1 3.64Å; A141-Y181 HydrophobicContact CB-CG 4.32Å; L145-Y181 HydrophobicContact CD1-CE1 3.73Å; Y181-N185 HydrophobicContact CD1-CB 3.77Å; Y181-N185 HydrophobicContact CE1-CB 4.15Å; Y181-F186 HydrophobicContact CD1-CE2 4.47Å; Y181-F186 HydrophobicContact CD1-CZ 4.25Å
182S93.8Very high89.7Confident18 Ų1858.9 Ų58.913%0.12634%0.339CS..  trans-105.7170.5171.171.30000110.3L172 G180 L184 N185 F186L172-S182 CarbonylContact O-C 3.6Å; L172-S182 WeakPolarHBondContact O-CA 3.36Å; G180-S182 PolarHBondContact O-N 2.83Å; S182-L184 PolarHBondContact O-N 3.42Å; S182-L184 VanDerWaalsContact O-N 3.13Å; S182-L184 WeakPolarHBondContact OG-CB 3.39Å; S182-L184 PolarHBondContact OG-N 2.87Å; S182-N185 PolarHBondContact N-OD1 3.5Å; S182-N185 WeakPolarHBondContact O-CB 3.43Å; S182-N185 PolarHBondContact O-N 3.1Å; S182-N185 PolarHBondContact O-OD1 3.26Å; S182-N185 PolarHBondContact OG-OD1 3.37Å; S182-F186 WeakPolarHBondContact O-CD2 3.39Å; S182-F186 WeakPolarHBondContact O-CE2 3.35Å
183I95.4Very high89.4Confident1 Ų159.5 Ų59.51%0.00535%0.345CS..G310 helixtrans-56.4-28.9173.9-167.556000112.7L172 L173 N185 F186 I187 I204 M205 I221 F225L172-I183 PolarHBondContact O-N 3.4Å; L173-I183 HydrophobicContact CD2-CG2 3.75Å; I183-N185 PolarHBondContact O-N 2.88Å; I183-F186 HydrophobicContact CD1-CD2 4.21Å; I183-F186 PolarHBondContact O-N 3.26Å; I183-I187 PolarHBondContact O-N 3.43Å; I183-I204 HydrophobicContact CD1-CG2 3.49Å; I183-I204 VanDerWaalsContact CD1-CG2 3.49Å; I183-M205 HydrophobicContact CD1-CG 3.8Å; I183-M205 HydrophobicContact CG1-CG 3.97Å; I183-I221 HydrophobicContact CG2-CD1 3.62Å; I183-F225 HydrophobicContact CB-CE2 4.45Å; I183-F225 HydrophobicContact CG1-CD2 4.03Å; I183-F225 HydrophobicContact CG1-CE2 3.78Å; I183-F225 HydrophobicContact CG2-CD2 3.8Å; I183-F225 HydrophobicContact CG2-CE2 4.05Å
184L94.8Very high89.1Confident70 Ų7063.4 Ų63.437%0.36637%0.366SS..G310 helixtrans-62.1-27.9178.4-62.1-178.6000113S182 F186 I187 P188 I221 A224S182-L184 PolarHBondContact O-N 3.42Å; S182-L184 VanDerWaalsContact O-N 3.13Å; S182-L184 WeakPolarHBondContact OG-CB 3.39Å; S182-L184 PolarHBondContact OG-N 2.87Å; L184-F186 PolarHBondContact O-N 3.37Å; L184-I187 HydrophobicContact CD2-CD1 3.63Å; L184-P188 WeakPolarHBondContact O-CD 3.33Å; L184-I221 HydrophobicContact CD1-CG2 3.95Å; L184-I221 HydrophobicContact CD2-CB 4.09Å; L184-I221 HydrophobicContact CD2-CD1 4.14Å; L184-I221 HydrophobicContact CD2-CG2 4.37Å; L184-I221 HydrophobicContact CG-CD1 4.42Å; L184-I221 HydrophobicContact CG-CG2 4.43Å; L184-A224 HydrophobicContact CD2-CB 3.77Å
185N94.5Very high89Confident72 Ų7265.6 Ų65.639%0.38537%0.373SS..G310 helixtrans-67.2-21.7177.4-64.194.3000112.5Y181 S182 I183Y181-N185 HydrophobicContact CD1-CB 3.77Å; Y181-N185 HydrophobicContact CE1-CB 4.15Å; S182-N185 PolarHBondContact N-OD1 3.5Å; S182-N185 WeakPolarHBondContact O-CB 3.43Å; S182-N185 PolarHBondContact O-N 3.1Å; S182-N185 PolarHBondContact O-OD1 3.26Å; S182-N185 PolarHBondContact OG-OD1 3.37Å; I183-N185 PolarHBondContact O-N 2.88Å
186F94.2Very high89Confident0 Ų065.4 Ų65.40%037%0.367CS..THydrogen-bonded Turntrans-97.1-27.4-178-56.5-86.2000113.1I137 A141 L144 L145 L159 L172 Y181 S182 I183 L184 P188 C189 V201I137-F186 HydrophobicContact CG2-CZ 4.35Å; A141-F186 HydrophobicContact CB-CE1 3.51Å; A141-F186 HydrophobicContact CB-CZ 3.55Å; L144-F186 HydrophobicContact CD2-CD1 3.76Å; L144-F186 HydrophobicContact CD2-CE1 3.82Å; L144-F186 HydrophobicContact CG-CD1 4.43Å; L145-F186 HydrophobicContact CD2-CD1 3.92Å; L145-F186 HydrophobicContact CG-CD1 4.43Å; L159-F186 HydrophobicContact CD2-CE1 3.77Å; L159-F186 HydrophobicContact CD2-CZ 3.77Å; L172-F186 HydrophobicContact CD2-CE2 3.65Å; L172-F186 HydrophobicContact CD2-CZ 4.32Å; Y181-F186 HydrophobicContact CD1-CE2 4.47Å; Y181-F186 HydrophobicContact CD1-CZ 4.25Å; S182-F186 WeakPolarHBondContact O-CD2 3.39Å; S182-F186 WeakPolarHBondContact O-CE2 3.35Å; I183-F186 HydrophobicContact CD1-CD2 4.21Å; I183-F186 PolarHBondContact O-N 3.26Å; L184-F186 PolarHBondContact O-N 3.37Å; F186-P188 VanDerWaalsContact C-N 3.31Å; F186-P188 VanDerWaalsContact O-N 3.15Å; F186-C189 WeakPolarHBondContact O-CB 3.15Å; F186-C189 PolarHBondContact O-N 3.38Å; F186-V201 HydrophobicContact CB-CB 4.4Å; F186-V201 HydrophobicContact CB-CG1 3.68Å; F186-V201 HydrophobicContact CB-CG2 3.81Å; F186-V201 HydrophobicContact CD1-CG2 4.42Å
187I93Very high89.5Confident16 Ų1658 Ų588%0.08233%0.327CS..THydrogen-bonded Turntrans-47.4-42.6-177.5-79.4176.4000114.1I183 L184 C189 I190 A224 F225 E228I183-I187 PolarHBondContact O-N 3.43Å; L184-I187 HydrophobicContact CD2-CD1 3.63Å; I187-C189 PolarHBondContact O-N 3Å; I187-I190 WeakPolarHBondContact O-CB 3.35Å; I187-I190 PolarHBondContact O-N 2.88Å; I187-A224 HydrophobicContact CD1-CB 3.91Å; I187-F225 HydrophobicContact CD1-CB 4.48Å; I187-E228 HydrophobicContact CG2-CG 3.83Å
188P93.3Very high90.3Very high68 Ų6857 Ų5744%0.44230%0.301SS..Hα-helixtrans-55.9-26177.6-2836.3000114.6L184 F186 I190 K191 Y192L184-P188 WeakPolarHBondContact O-CD 3.33Å; F186-P188 VanDerWaalsContact C-N 3.31Å; F186-P188 VanDerWaalsContact O-N 3.15Å; P188-I190 VanDerWaalsContact C-N 3.32Å; P188-I190 PolarHBondContact O-N 3.46Å; P188-K191 PolarHBondContact O-N 3.46Å; P188-Y192 HydrophobicContact CB-CD2 4.48Å; P188-Y192 WeakPolarHBondContact O-CD2 3.38Å; P188-Y192 PolarHBondContact O-N 3.18Å
189C92.6Very high90.9Very high11 Ų1155.8 Ų55.87%0.07430%0.3CS..Hα-helixtrans-67.1-28.7176-70.10000113.4L145 F186 I187 K191 G193 Q197 K198 V201L145-C189 WeakPolarHBondContact CD2-SG 3.39Å; F186-C189 WeakPolarHBondContact O-CB 3.15Å; F186-C189 PolarHBondContact O-N 3.38Å; I187-C189 PolarHBondContact O-N 3Å; C189-K191 PolarHBondContact O-N 3.17Å; C189-G193 WeakPolarHBondContact O-CA 3.27Å; C189-G193 PolarHBondContact O-N 2.95Å; C189-Q197 HydrophobicContact CB-CB 4.04Å; C189-K198 WeakPolarHBondContact O-CG 3.42Å; C189-V201 HydrophobicContact CB-CG2 3.87Å
190I91.9Very high91.7Very high11 Ų1151.3 Ų51.36%0.05627%0.268CS..Hα-helixtrans-61-41.6175.5-61.4-63.3000109.9I187 P188 K198 V201 L202 M205 E228I187-I190 WeakPolarHBondContact O-CB 3.35Å; I187-I190 PolarHBondContact O-N 2.88Å; P188-I190 VanDerWaalsContact C-N 3.32Å; P188-I190 PolarHBondContact O-N 3.46Å; I190-K198 WeakPolarHBondContact CD1-O 3.18Å; I190-K198 WeakPolarHBondContact O-CD 3.4Å; I190-K198 WeakPolarHBondContact O-CE 3.35Å; I190-K198 PolarHBondContact O-NZ 3.49Å; I190-V201 HydrophobicContact CD1-CB 3.87Å; I190-V201 HydrophobicContact CD1-CG1 3.75Å; I190-V201 HydrophobicContact CG1-CB 4.43Å; I190-V201 HydrophobicContact CG1-CG1 3.86Å; I190-L202 HydrophobicContact CD1-CB 4.06Å; I190-M205 HydrophobicContact CD1-SD 4.35Å; I190-M205 HydrophobicContact CG1-SD 4.16Å; I190-E228 HydrophobicContact CB-CB 4.46Å; I190-E228 HydrophobicContact CB-CG 4.4Å; I190-E228 HydrophobicContact CG1-CB 4.4Å; I190-E228 HydrophobicContact CG2-CB 4.2Å; I190-E228 HydrophobicContact CG2-CG 4.45Å; I190-E228 WeakPolarHBondContact CG2-OE2 3.43Å
191K87.9Confident92.4Very high106 Ų10648.7 Ų48.746%0.46124%0.241SC..Hα-helixtrans-82.5-46.4-177.3-167.9168.7178178.50113.4P188 C189P188-K191 PolarHBondContact O-N 3.46Å; C189-K191 PolarHBondContact O-N 3.17Å
192Y90Very high92.9Very high174 Ų17446 Ų4668%0.68223%0.231SC*.Hα-helixtrans-114.8-4.3-168.5-51.6-64.8000114.6P188P188-Y192 HydrophobicContact CB-CD2 4.48Å; P188-Y192 WeakPolarHBondContact O-CD2 3.38Å; P188-Y192 PolarHBondContact O-N 3.18Å
193G90.5Very high93Very high13 Ų1349.1 Ų49.113%0.13424%0.24CC..SBendtrans-81.6166.7-177.500000113.7C189 K198C189-G193 WeakPolarHBondContact O-CA 3.27Å; C189-G193 PolarHBondContact O-N 2.95Å; G193-K198 WeakPolarHBondContact O-CE 3.18Å
194L91.3Very high93.1Very high85 Ų8549 Ų4945%0.44524%0.24SC..  trans-66.7159.9168.1-61.7175.3000110.7W196 Q197 K198L194-W196 HydrophobicContact CB-CD2 4.45Å; L194-W196 HydrophobicContact CB-CG 4.38Å; L194-W196 HydrophobicContact CB-CZ2 4.45Å; L194-W196 HydrophobicContact CD1-CZ2 3.88Å; L194-W196 VanDerWaalsContact CD1-NE1 3.28Å; L194-W196 PolarHBondContact O-N 2.99Å; L194-W196 VanDerWaalsContact O-N 3.13Å; L194-Q197 WeakPolarHBondContact O-CA 3.44Å; L194-Q197 VanDerWaalsContact O-CB 3.3Å; L194-Q197 WeakPolarHBondContact O-CB 3.31Å; L194-Q197 PolarHBondContact O-N 3.43Å; L194-K198 WeakPolarHBondContact O-CG 3.33Å; L194-K198 PolarHBondContact O-N 3.1Å
195M90.8Very high93.3Very high87 Ų8745.7 Ų45.743%0.42922%0.222SC..Hα-helixtrans-55.8-36.9-175.2-170.458.9-173.400113.4K198 T199 F267M195-K198 PolarHBondContact O-N 3.36Å; M195-K198 HydrophobicContact SD-CD 4.42Å; M195-T199 WeakPolarHBondContact O-CB 3.31Å; M195-T199 PolarHBondContact O-N 2.73Å; M195-T199 PolarHBondContact O-OG1 2.85Å; M195-F267 HydrophobicContact CE-CD2 3.79Å; M195-F267 HydrophobicContact CE-CE2 4.39Å
196W88.7Confident93.5Very high73 Ų7342.7 Ų42.728%0.27721%0.206SC..Hα-helixtrans-67.4-33.4175.261.7-104.3000112.9L144 V152 L194 S200L144-W196 HydrophobicContact CD1-CE3 4.47Å; L144-W196 HydrophobicContact CD1-CZ3 3.98Å; V152-W196 HydrophobicContact CB-CE3 4.33Å; V152-W196 HydrophobicContact CB-CH2 4.04Å; V152-W196 HydrophobicContact CB-CZ3 3.95Å; V152-W196 HydrophobicContact CG1-CD2 4.33Å; V152-W196 HydrophobicContact CG1-CE3 3.45Å; V152-W196 VanDerWaalsContact CG1-CE3 3.45Å; V152-W196 HydrophobicContact CG1-CH2 3.33Å; V152-W196 HydrophobicContact CG1-CZ2 4.2Å; V152-W196 HydrophobicContact CG1-CZ3 2.89Å; V152-W196 HydrophobicContact CG2-CH2 3.74Å; V152-W196 HydrophobicContact CG2-CZ2 3.99Å; V152-W196 HydrophobicContact CG2-CZ3 4.18Å; L194-W196 HydrophobicContact CB-CD2 4.45Å; L194-W196 HydrophobicContact CB-CG 4.38Å; L194-W196 HydrophobicContact CB-CZ2 4.45Å; L194-W196 HydrophobicContact CD1-CZ2 3.88Å; L194-W196 VanDerWaalsContact CD1-NE1 3.28Å; L194-W196 PolarHBondContact O-N 2.99Å; L194-W196 VanDerWaalsContact O-N 3.13Å; W196-S200 WeakPolarHBondContact O-CB 3.45Å; W196-S200 PolarHBondContact O-N 2.98Å; W196-S200 PolarHBondContact O-OG 2.76Å
197Q92.5Very high93.7Very high8 Ų843.7 Ų43.74%0.03721%0.211CC..Hα-helixtrans-66.2-48.6173.4-69.9179.6-65.800109.6L144 C189 L194 T199 S200 V201L144-Q197 PolarHBondContact O-NE2 3.31Å; C189-Q197 HydrophobicContact CB-CB 4.04Å; L194-Q197 WeakPolarHBondContact O-CA 3.44Å; L194-Q197 VanDerWaalsContact O-CB 3.3Å; L194-Q197 WeakPolarHBondContact O-CB 3.31Å; L194-Q197 PolarHBondContact O-N 3.43Å; Q197-T199 VanDerWaalsContact C-N 3.32Å; Q197-T199 PolarHBondContact O-N 3.23Å; Q197-S200 PolarHBondContact O-N 3.01Å; Q197-V201 WeakPolarHBondContact O-CB 3.32Å; Q197-V201 VanDerWaalsContact O-CG2 3.32Å; Q197-V201 WeakPolarHBondContact O-CG2 3.38Å; Q197-V201 PolarHBondContact O-N 3.24Å
198K94.1Very high93.9Very high56 Ų5642.9 Ų42.924%0.24321%0.207CC..Hα-helixtrans-55.7-49.4178.6-61.5-173.5-178.9-160.90111.1C189 I190 G193 L194 M195 S200 V201 L202 F267C189-K198 WeakPolarHBondContact O-CG 3.42Å; I190-K198 WeakPolarHBondContact CD1-O 3.18Å; I190-K198 WeakPolarHBondContact O-CD 3.4Å; I190-K198 WeakPolarHBondContact O-CE 3.35Å; I190-K198 PolarHBondContact O-NZ 3.49Å; G193-K198 WeakPolarHBondContact O-CE 3.18Å; L194-K198 WeakPolarHBondContact O-CG 3.33Å; L194-K198 PolarHBondContact O-N 3.1Å; M195-K198 PolarHBondContact O-N 3.36Å; M195-K198 HydrophobicContact SD-CD 4.42Å; K198-S200 PolarHBondContact O-N 2.82Å; K198-V201 PolarHBondContact O-N 2.92Å; K198-L202 WeakPolarHBondContact O-CB 3.41Å; K198-L202 PolarHBondContact O-N 3.33Å; K198-F267 HydrophobicContact CB-CE2 3.8Å; K198-F267 HydrophobicContact CB-CZ 4.16Å
199T93.5Very high94.2Very high70 Ų7039.7 Ų39.743%0.42919%0.186SC..Hα-helixtrans-62.3-45.7-179.3-54.90000111.8M195 Q197 R203M195-T199 WeakPolarHBondContact O-CB 3.31Å; M195-T199 PolarHBondContact O-N 2.73Å; M195-T199 PolarHBondContact O-OG1 2.85Å; Q197-T199 VanDerWaalsContact C-N 3.32Å; Q197-T199 PolarHBondContact O-N 3.23Å; T199-R203 WeakPolarHBondContact O-CB 3.45Å; T199-R203 PolarHBondContact O-N 2.68Å
200S94.6Very high94.4Very high23 Ų2342.2 Ų42.216%0.16120%0.198CC..Hα-helixtrans-65.5-45.5-179.9-59.10000111.9W196 Q197 K198 R203 I204W196-S200 WeakPolarHBondContact O-CB 3.45Å; W196-S200 PolarHBondContact O-N 2.98Å; W196-S200 PolarHBondContact O-OG 2.76Å; Q197-S200 PolarHBondContact O-N 3.01Å; K198-S200 PolarHBondContact O-N 2.82Å; S200-R203 PolarHBondContact O-N 3.12Å; S200-I204 WeakPolarHBondContact O-CG1 3.45Å; S200-I204 PolarHBondContact O-N 3.24Å
201V95.6Very high94.7Very high0 Ų042.2 Ų42.20%020%0.198CC..Hα-helixtrans-67.6-41.6179.3174.10000111.1L144 F186 C189 I190 Q197 K198 R203 I204 M205L144-V201 HydrophobicContact CD1-CG2 4.48Å; L144-V201 HydrophobicContact CD2-CG2 4.3Å; F186-V201 HydrophobicContact CB-CB 4.4Å; F186-V201 HydrophobicContact CB-CG1 3.68Å; F186-V201 HydrophobicContact CB-CG2 3.81Å; F186-V201 HydrophobicContact CD1-CG2 4.42Å; C189-V201 HydrophobicContact CB-CG2 3.87Å; I190-V201 HydrophobicContact CD1-CB 3.87Å; I190-V201 HydrophobicContact CD1-CG1 3.75Å; I190-V201 HydrophobicContact CG1-CB 4.43Å; I190-V201 HydrophobicContact CG1-CG1 3.86Å; Q197-V201 WeakPolarHBondContact O-CB 3.32Å; Q197-V201 VanDerWaalsContact O-CG2 3.32Å; Q197-V201 WeakPolarHBondContact O-CG2 3.38Å; Q197-V201 PolarHBondContact O-N 3.24Å; K198-V201 PolarHBondContact O-N 2.92Å; V201-R203 VanDerWaalsContact C-N 3.28Å; V201-R203 PolarHBondContact O-N 3.09Å; V201-I204 WeakPolarHBondContact O-CB 3.47Å; V201-I204 PolarHBondContact O-N 3.44Å; V201-M205 HydrophobicContact CG1-CG 4.4Å; V201-M205 HydrophobicContact CG1-SD 4.14Å; V201-M205 WeakPolarHBondContact O-CG 3.49Å; V201-M205 PolarHBondContact O-N 3.47Å
202L97Very high95.2Very high3 Ų338.2 Ų38.22%0.01618%0.183CC..Hα-helixtrans-59.6-42.4175-179.265.4000110.8I190 K198 M205 H206 L229 F267 V270 A271I190-L202 HydrophobicContact CD1-CB 4.06Å; K198-L202 WeakPolarHBondContact O-CB 3.41Å; K198-L202 PolarHBondContact O-N 3.33Å; L202-M205 PolarHBondContact O-N 3.45Å; L202-H206 VanDerWaalsContact O-CB 3.31Å; L202-H206 WeakPolarHBondContact O-CB 3.39Å; L202-H206 PolarHBondContact O-N 3.16Å; L202-L229 HydrophobicContact CD1-CD2 3.77Å; L202-F267 HydrophobicContact CB-CE2 4.31Å; L202-F267 HydrophobicContact CB-CZ 4.26Å; L202-F267 HydrophobicContact CD2-CD1 3.75Å; L202-F267 HydrophobicContact CD2-CD2 3.86Å; L202-F267 HydrophobicContact CD2-CE1 3.64Å; L202-F267 HydrophobicContact CD2-CE2 3.74Å; L202-F267 HydrophobicContact CD2-CG 3.87Å; L202-F267 HydrophobicContact CD2-CZ 3.64Å; L202-F267 WeakPolarHBondContact CD2-O 3.36Å; L202-F267 HydrophobicContact CG-CZ 4.43Å; L202-V270 HydrophobicContact CD2-CB 3.89Å; L202-V270 HydrophobicContact CD2-CG1 3.95Å; L202-V270 HydrophobicContact CG-CB 4.32Å; L202-V270 HydrophobicContact CG-CG1 3.81Å; L202-A271 HydrophobicContact CD1-CB 4.02Å; L202-A271 HydrophobicContact CD2-CB 4.28Å
203R97.3Very high95.5Very high84 Ų8435.8 Ų35.832%0.31718%0.181SC..Hα-helixtrans-65.1-39.3176.8-174.562.570.9-171.57112.5V160 T199 S200 V201 H206 N207 V270 E273V160-R203 HydrophobicContact CG1-CB 4.18Å; V160-R203 HydrophobicContact CG1-CG 3.49Å; V160-R203 VanDerWaalsContact CG1-CG 3.49Å; T199-R203 WeakPolarHBondContact O-CB 3.45Å; T199-R203 PolarHBondContact O-N 2.68Å; S200-R203 PolarHBondContact O-N 3.12Å; V201-R203 VanDerWaalsContact C-N 3.28Å; V201-R203 PolarHBondContact O-N 3.09Å; R203-H206 PolarHBondContact O-N 3.38Å; R203-N207 WeakPolarHBondContact O-CB 3.4Å; R203-N207 PolarHBondContact O-N 2.87Å; R203-N207 PolarHBondContact O-OD1 3.42Å; R203-V270 VanDerWaalsContact CZ-CG2 3.47Å; R203-E273 IonicContact NH1-OE2 2.62Å
204I97.6Very high95.8Very high0 Ų035.4 Ų35.40%018%0.176CC..Hα-helixtrans-60.4-47.8172.8-71.8167.3000110.2L144 L159 V160 T163 L172 I183 S200 V201 N207 C208L144-I204 HydrophobicContact CD2-CD1 3.83Å; L159-I204 HydrophobicContact CD2-CD1 3.81Å; L159-I204 HydrophobicContact CG-CD1 3.87Å; V160-I204 HydrophobicContact CG2-CD1 4.18Å; V160-I204 HydrophobicContact CG2-CG1 3.86Å; T163-I204 HydrophobicContact CG2-CG1 4.29Å; T163-I204 HydrophobicContact CG2-CG2 4.11Å; L172-I204 HydrophobicContact CD1-CG2 3.85Å; I183-I204 HydrophobicContact CD1-CG2 3.49Å; I183-I204 VanDerWaalsContact CD1-CG2 3.49Å; S200-I204 WeakPolarHBondContact O-CG1 3.45Å; S200-I204 PolarHBondContact O-N 3.24Å; V201-I204 WeakPolarHBondContact O-CB 3.47Å; V201-I204 PolarHBondContact O-N 3.44Å; I204-N207 PolarHBondContact O-N 3.37Å; I204-C208 PolarHBondContact O-N 2.89Å; I204-C208 PolarHBondContact O-SG 2.8Å
205M98.2Very high96.2Very high0 Ų031.3 Ų31.30%016%0.155CC..Hα-helixtrans-60.1-47.5177.5-70172.969.700111.6I183 I190 V201 L202 N207 C208 C209 F225 E228 L229I183-M205 HydrophobicContact CD1-CG 3.8Å; I183-M205 HydrophobicContact CG1-CG 3.97Å; I190-M205 HydrophobicContact CD1-SD 4.35Å; I190-M205 HydrophobicContact CG1-SD 4.16Å; V201-M205 HydrophobicContact CG1-CG 4.4Å; V201-M205 HydrophobicContact CG1-SD 4.14Å; V201-M205 WeakPolarHBondContact O-CG 3.49Å; V201-M205 PolarHBondContact O-N 3.47Å; L202-M205 PolarHBondContact O-N 3.45Å; M205-N207 VanDerWaalsContact C-N 3.33Å; M205-N207 PolarHBondContact O-N 3.29Å; M205-C208 WeakPolarHBondContact O-CB 3.34Å; M205-C208 PolarHBondContact O-N 3.07Å; M205-C208 VanDerWaalsContact O-N 3.15Å; M205-C209 PolarHBondContact O-N 3.24Å; M205-C209 VanDerWaalsContact O-N 3.09Å; M205-C209 PolarHBondContact O-SG 3.38Å; M205-F225 HydrophobicContact CB-CE2 4.35Å; M205-F225 HydrophobicContact CB-CZ 4.09Å; M205-F225 HydrophobicContact CE-CD1 4.29Å; M205-F225 HydrophobicContact CE-CD2 4.33Å; M205-F225 HydrophobicContact CE-CE1 4.41Å; M205-F225 HydrophobicContact CE-CE2 4.48Å; M205-F225 HydrophobicContact CE-CG 4.24Å; M205-F225 WeakPolarHBondContact CE-O 3.42Å; M205-F225 HydrophobicContact CG-CE2 4.27Å; M205-F225 HydrophobicContact CG-CZ 4.47Å; M205-E228 HydrophobicContact CE-CB 3.94Å; M205-L229 HydrophobicContact CB-CD2 4.39Å; M205-L229 HydrophobicContact CE-CD2 4.13Å; M205-L229 HydrophobicContact CE-CG 3.88Å
206H98.3Very high96.5Very high8 Ų833 Ų334%0.03716%0.161CC..Hα-helixtrans-54.5-47.5173.9160.9-85.3000111.7L202 R203 C208 C209 M210 V270 E273L202-H206 VanDerWaalsContact O-CB 3.31Å; L202-H206 WeakPolarHBondContact O-CB 3.39Å; L202-H206 PolarHBondContact O-N 3.16Å; R203-H206 PolarHBondContact O-N 3.38Å; H206-C208 VanDerWaalsContact C-N 3.3Å; H206-C208 PolarHBondContact O-N 3.06Å; H206-C209 WeakPolarHBondContact O-CA 3.49Å; H206-C209 VanDerWaalsContact O-CB 3.28Å; H206-C209 WeakPolarHBondContact O-CB 3.48Å; H206-C209 PolarHBondContact O-N 3.18Å; H206-M210 WeakPolarHBondContact CE1-CE 3.26Å; H206-M210 WeakPolarHBondContact NE2-CE 3.42Å; H206-M210 PolarHBondContact O-N 3.46Å; H206-V270 HydrophobicContact CB-CG1 3.81Å; H206-V270 PolarHBondContact CD2-O 3.2Å; H206-E273 IonicContact CD2-OE2 2.77Å; H206-E273 IonicContact NE2-OE2 3.28Å; H206-E273 PolarHBondContact NE2-OE2 3.48Å
207N98.2Very high96.9Very high21 Ų2131.9 Ų31.911%0.11216%0.157CC..Hα-helixtrans-66-32.2179.3-69.7-5000112.2V160 T163 R169 R203 I204 M205 C209 M210V160-N207 PolarHBondContact O-ND2 2.86Å; T163-N207 VanDerWaalsContact OG1-CB 3.22Å; T163-N207 WeakPolarHBondContact OG1-CB 3.47Å; T163-N207 PolarHBondContact OG1-ND2 3.17Å; R169-N207 VanDerWaalsContact CD-O 3.23Å; R169-N207 WeakPolarHBondContact CD-O 3.34Å; R169-N207 PolarHBondContact NE-O 3.22Å; R203-N207 WeakPolarHBondContact O-CB 3.4Å; R203-N207 PolarHBondContact O-N 2.87Å; R203-N207 PolarHBondContact O-OD1 3.42Å; I204-N207 PolarHBondContact O-N 3.37Å; M205-N207 VanDerWaalsContact C-N 3.33Å; M205-N207 PolarHBondContact O-N 3.29Å; N207-C209 VanDerWaalsContact C-N 3.29Å; N207-C209 PolarHBondContact O-N 3.05Å; N207-M210 WeakPolarHBondContact O-CB 3.23Å; N207-M210 PolarHBondContact O-N 2.69Å
208C98.4Very high97.1Very high0 Ų031.5 Ų31.50%016%0.155CC..Hα-helixtrans-65.2-30.8170-71.90000112.8L173 I204 M205 H206 M210 F225L173-C208 HydrophobicContact CD1-CB 4.15Å; I204-C208 PolarHBondContact O-N 2.89Å; I204-C208 PolarHBondContact O-SG 2.8Å; M205-C208 WeakPolarHBondContact O-CB 3.34Å; M205-C208 PolarHBondContact O-N 3.07Å; M205-C208 VanDerWaalsContact O-N 3.15Å; H206-C208 VanDerWaalsContact C-N 3.3Å; H206-C208 PolarHBondContact O-N 3.06Å; C208-M210 VanDerWaalsContact C-N 3.27Å; C208-M210 PolarHBondContact O-N 2.67Å; C208-F225 HydrophobicContact CB-CE2 4.5Å; C208-F225 HydrophobicContact CB-CZ 4.35Å
209C98.6Very high97.3Very high0 Ų031 Ų310%016%0.156CC..Hα-helixtrans-73.6-16.5175.3-56.80000113.1M205 H206 N207 D211 H215 F225 G274 Q277 L278M205-C209 PolarHBondContact O-N 3.24Å; M205-C209 VanDerWaalsContact O-N 3.09Å; M205-C209 PolarHBondContact O-SG 3.38Å; H206-C209 WeakPolarHBondContact O-CA 3.49Å; H206-C209 VanDerWaalsContact O-CB 3.28Å; H206-C209 WeakPolarHBondContact O-CB 3.48Å; H206-C209 PolarHBondContact O-N 3.18Å; N207-C209 VanDerWaalsContact C-N 3.29Å; N207-C209 PolarHBondContact O-N 3.05Å; C209-D211 PolarHBondContact O-N 3.29Å; C209-H215 PolarHBondContact O-NE2 3.36Å; C209-F225 VanDerWaalsContact SG-CE1 3.6Å; C209-G274 WeakPolarHBondContact CB-O 3.32Å; C209-Q277 HydrophobicContact CB-CB 4.03Å; C209-Q277 VanDerWaalsContact O-CB 3.25Å; C209-Q277 WeakPolarHBondContact O-CB 3.36Å; C209-L278 HydrophobicContact CB-CD2 4.16Å; C209-L278 HydrophobicContact CB-CG 3.99Å
210M97.7Very high97.4Very high64 Ų6432 Ų3232%0.31516%0.164SC..THydrogen-bonded Turntrans-75.2-1179.1-70.4-81.3-179.500113.3R169 H206 N207 C208 P212 Q277R169-M210 VanDerWaalsContact NH1-CB 3.3Å; R169-M210 PolarHBondContact NH1-O 3.06Å; R169-M210 VanDerWaalsContact NH1-O 3.07Å; H206-M210 WeakPolarHBondContact CE1-CE 3.26Å; H206-M210 WeakPolarHBondContact NE2-CE 3.42Å; H206-M210 PolarHBondContact O-N 3.46Å; N207-M210 WeakPolarHBondContact O-CB 3.23Å; N207-M210 PolarHBondContact O-N 2.69Å; C208-M210 VanDerWaalsContact C-N 3.27Å; C208-M210 PolarHBondContact O-N 2.67Å; M210-P212 WeakPolarHBondContact O-CD 3.29Å; M210-Q277 HydrophobicContact CE-CG 3.61Å; M210-Q277 HydrophobicContact CG-CG 4.27Å; M210-Q277 HydrophobicContact SD-CB 4.47Å; M210-Q277 HydrophobicContact SD-CG 3.51Å; M210-Q277 VanDerWaalsContact SD-CG 3.51Å
211D97.6Very high97.4Very high11 Ų1132.8 Ų32.86%0.05917%0.166CC..  trans-115.591.9-177.8-162.1-28.1000111.4H166 C209 L213 L214 H215H166-D211 IonicContact CE1-OD2 3.79Å; H166-D211 IonicContact CG-OD2 3.41Å; H166-D211 IonicContact ND1-OD1 2.73Å; H166-D211 IonicContact ND1-OD2 3.78Å; H166-D211 PolarHBondContact ND1-OD2 3Å; C209-D211 PolarHBondContact O-N 3.29Å; D211-L213 PolarHBondContact O-N 3.44Å; D211-L213 VanDerWaalsContact O-N 3.1Å; D211-L213 WeakPolarHBondContact OD1-CB 3.19Å; D211-L213 PolarHBondContact OD1-N 3.2Å; D211-L214 HydrophobicContact CB-CB 4.23Å; D211-L214 HydrophobicContact CB-CD1 4.02Å; D211-L214 HydrophobicContact CB-CG 4.17Å; D211-L214 PolarHBondContact O-N 2.76Å; D211-L214 WeakPolarHBondContact OD2-CD1 3.48Å; D211-H215 PolarHBondContact O-CD2 3.46Å; D211-H215 PolarHBondContact O-N 3.31Å; D211-H215 PolarHBondContact O-NE2 3.47Å
212P98Very high97.4Very high22 Ų2235.1 Ų35.114%0.14318%0.176CC..G310 helixtrans-60.1-25.5-177.426.5-36.7000113.4M210 L214 H215 N280 I331M210-P212 WeakPolarHBondContact O-CD 3.29Å; P212-L214 PolarHBondContact O-N 3.02Å; P212-H215 PolarHBondContact O-N 3.28Å; P212-N280 HydrophobicContact CB-CB 4.46Å; P212-N280 WeakPolarHBondContact CG-ND2 3.38Å; P212-I331 HydrophobicContact CB-CD1 4.17Å; P212-I331 HydrophobicContact CB-CG1 4.21Å; P212-I331 HydrophobicContact CB-CG2 3.89Å; P212-I331 HydrophobicContact CG-CD1 4.43Å; P212-I331 HydrophobicContact CG-CG2 3.83Å
213L97.4Very high97.4Very high123 Ų12339 Ų3964%0.64420%0.197SC*.G310 helixtrans-69.7-18.8177.7-56176000112.5D211 I331D211-L213 PolarHBondContact O-N 3.44Å; D211-L213 VanDerWaalsContact O-N 3.1Å; D211-L213 WeakPolarHBondContact OD1-CB 3.19Å; D211-L213 PolarHBondContact OD1-N 3.2Å; L213-I331 HydrophobicContact CD2-CD1 3.66Å
214L97.6Very high97.3Very high5 Ų536.8 Ų36.83%0.02620%0.197CC..G310 helixtrans-103.6-5.6-179.5-61.9179.3000113.5R169 R170 L173 D211 P212 Q216 R217R169-L214 HydrophobicContact CB-CD1 3.6Å; R170-L214 HydrophobicContact CB-CD1 4.07Å; R170-L214 HydrophobicContact CB-CD2 4.18Å; R170-L214 HydrophobicContact CG-CD2 4.07Å; L173-L214 HydrophobicContact CD1-CB 3.97Å; L173-L214 HydrophobicContact CD1-CD1 4.48Å; D211-L214 HydrophobicContact CB-CB 4.23Å; D211-L214 HydrophobicContact CB-CD1 4.02Å; D211-L214 HydrophobicContact CB-CG 4.17Å; D211-L214 PolarHBondContact O-N 2.76Å; D211-L214 WeakPolarHBondContact OD2-CD1 3.48Å; P212-L214 PolarHBondContact O-N 3.02Å; L214-Q216 PolarHBondContact O-N 2.88Å; L214-Q216 VanDerWaalsContact O-N 3.16Å; L214-R217 WeakPolarHBondContact O-CA 3.46Å; L214-R217 VanDerWaalsContact O-CB 3.3Å; L214-R217 WeakPolarHBondContact O-CB 3.44Å; L214-R217 PolarHBondContact O-N 3.07Å
215H98.3Very high97.2Very high0 Ų036.8 Ų36.80%020%0.197CC..Hα-helixtrans-57.8-34.2-178.3-70.1179.5000113C209 D211 P212 R217 I218 V219 Q277 L278 S281 A283C209-H215 PolarHBondContact O-NE2 3.36Å; D211-H215 PolarHBondContact O-CD2 3.46Å; D211-H215 PolarHBondContact O-N 3.31Å; D211-H215 PolarHBondContact O-NE2 3.47Å; P212-H215 PolarHBondContact O-N 3.28Å; H215-R217 PolarHBondContact O-N 3.13Å; H215-R217 VanDerWaalsContact O-N 3.14Å; H215-I218 WeakPolarHBondContact O-CB 3.24Å; H215-I218 PolarHBondContact O-N 3.19Å; H215-V219 PolarHBondContact O-N 2.86Å; H215-Q277 PolarHBondContact CE1-O 3.22Å; H215-L278 VanDerWaalsContact CE1-CA 3.45Å; H215-L278 WeakPolarHBondContact CE1-CA 3.47Å; H215-L278 PolarHBondContact ND1-O 2.81Å; H215-S281 VanDerWaalsContact CB-OG 3.28Å; H215-S281 WeakPolarHBondContact CB-OG 3.43Å; H215-S281 PolarHBondContact ND1-OG 3.3Å; H215-A283 HydrophobicContact CB-CB 4.39Å
216Q97.1Very high97.2Very high122 Ų12236.8 Ų36.857%0.5720%0.197SC*.Hα-helixtrans-63-21.8177.2-166.859.59.900113L214 P220L214-Q216 PolarHBondContact O-N 2.88Å; L214-Q216 VanDerWaalsContact O-N 3.16Å; Q216-P220 WeakPolarHBondContact O-CD 3.39Å
217R96.8Very high97.1Very high50 Ų5037 Ų3719%0.18920%0.199CC..Hα-helixtrans-80.7-16.3173.3-53.3-166.3-178.8-155.2-9.7113.3L173 N175 E178 L214 H215 P220L173-R217 HydrophobicContact CB-CB 4.08Å; L173-R217 WeakPolarHBondContact O-CD 3.41Å; L173-R217 PolarHBondContact O-NH1 3.45Å; N175-R217 PolarHBondContact ND2-NH2 3.37Å; N175-R217 VanDerWaalsContact ND2-NH2 3.2Å; N175-R217 PolarHBondContact OD1-NE 3.41Å; E178-R217 IonicContact OE2-NH1 3.78Å; L214-R217 WeakPolarHBondContact O-CA 3.46Å; L214-R217 VanDerWaalsContact O-CB 3.3Å; L214-R217 WeakPolarHBondContact O-CB 3.44Å; L214-R217 PolarHBondContact O-N 3.07Å; H215-R217 PolarHBondContact O-N 3.13Å; H215-R217 VanDerWaalsContact O-N 3.14Å; R217-P220 WeakPolarHBondContact O-CD 3.25Å
218I97.7Very high97Very high0 Ų037.4 Ų37.40%020%0.2CC..Hα-helixtrans-82-31.6174.7-58.8173.1000110.4L173 H215 P220 I221 K222 F225 L278 M287L173-I218 HydrophobicContact CD1-CD1 4.12Å; L173-I218 HydrophobicContact CD1-CG1 3.82Å; L173-I218 HydrophobicContact CD2-CG1 3.86Å; H215-I218 WeakPolarHBondContact O-CB 3.24Å; H215-I218 PolarHBondContact O-N 3.19Å; I218-P220 VanDerWaalsContact C-CD 3.49Å; I218-I221 HydrophobicContact CG2-CG1 4.42Å; I218-I221 CarbonylContact O-C 3.37Å; I218-I221 WeakPolarHBondContact O-CA 3.15Å; I218-I221 WeakPolarHBondContact O-CG1 3.44Å; I218-I221 PolarHBondContact O-N 2.78Å; I218-K222 PolarHBondContact O-N 3.43Å; I218-F225 HydrophobicContact CD1-CE1 4.16Å; I218-F225 HydrophobicContact CD1-CZ 4.05Å; I218-F225 HydrophobicContact CG2-CB 4.11Å; I218-F225 HydrophobicContact CG2-CD1 3.64Å; I218-F225 HydrophobicContact CG2-CD2 4.36Å; I218-F225 HydrophobicContact CG2-CE1 4.09Å; I218-F225 HydrophobicContact CG2-CG 3.8Å; I218-L278 HydrophobicContact CD1-CD2 3.74Å; I218-M287 HydrophobicContact CB-SD 4.47Å; I218-M287 HydrophobicContact CG2-CE 3.98Å; I218-M287 HydrophobicContact CG2-SD 4Å
219V97.5Very high96.9Very high44 Ų4437.4 Ų37.427%0.26720%0.2SC..G310 helixtrans-48.6-47.2-178.3177.80000113.7H215 I221 K222 M287H215-V219 PolarHBondContact O-N 2.86Å; V219-I221 PolarHBondContact O-N 2.9Å; V219-K222 WeakPolarHBondContact O-CB 3.41Å; V219-K222 WeakPolarHBondContact O-CG 3.36Å; V219-K222 PolarHBondContact O-N 3.12Å; V219-M287 HydrophobicContact CB-SD 4.48Å; V219-M287 HydrophobicContact CG2-CB 4.36Å; V219-M287 HydrophobicContact CG2-SD 4.07Å
220P95.5Very high96.9Very high92 Ų9237.4 Ų37.460%0.59720%0.2SC*.G310 helixtrans-67.6-20.3179.5-20.734.7000114.3Q216 R217 I218Q216-P220 WeakPolarHBondContact O-CD 3.39Å; R217-P220 WeakPolarHBondContact O-CD 3.25Å; I218-P220 VanDerWaalsContact C-CD 3.49Å
221I95.3Very high96.8Very high39 Ų3937.3 Ų37.320%0.220%0.199CC..G310 helixtrans-11212.1-177.364.8164.9000112.6L173 I183 L184 I218 V219 D223 A224 F225L173-I221 HydrophobicContact CD2-CD1 4.04Å; I183-I221 HydrophobicContact CG2-CD1 3.62Å; L184-I221 HydrophobicContact CD1-CG2 3.95Å; L184-I221 HydrophobicContact CD2-CB 4.09Å; L184-I221 HydrophobicContact CD2-CD1 4.14Å; L184-I221 HydrophobicContact CD2-CG2 4.37Å; L184-I221 HydrophobicContact CG-CD1 4.42Å; L184-I221 HydrophobicContact CG-CG2 4.43Å; I218-I221 HydrophobicContact CG2-CG1 4.42Å; I218-I221 CarbonylContact O-C 3.37Å; I218-I221 WeakPolarHBondContact O-CA 3.15Å; I218-I221 WeakPolarHBondContact O-CG1 3.44Å; I218-I221 PolarHBondContact O-N 2.78Å; V219-I221 PolarHBondContact O-N 2.9Å; I221-D223 PolarHBondContact O-N 2.86Å; I221-A224 PolarHBondContact O-N 3.18Å; I221-A224 VanDerWaalsContact O-N 3.1Å; I221-F225 HydrophobicContact CD1-CB 4.32Å; I221-F225 HydrophobicContact CD1-CD2 4.16Å; I221-F225 HydrophobicContact CG1-CB 4.29Å; I221-F225 WeakPolarHBondContact O-CB 3.44Å; I221-F225 PolarHBondContact O-N 3.48Å
222K96.4Very high96.7Very high49 Ų4937 Ų3721%0.21320%0.197CC..Hα-helixtrans-57.2-36-171.372-178.2-173.91730113.1I218 V219 A224 F225 V226 M287 S290 M291I218-K222 PolarHBondContact O-N 3.43Å; V219-K222 WeakPolarHBondContact O-CB 3.41Å; V219-K222 WeakPolarHBondContact O-CG 3.36Å; V219-K222 PolarHBondContact O-N 3.12Å; K222-A224 VanDerWaalsContact C-N 3.27Å; K222-A224 PolarHBondContact O-N 3.35Å; K222-F225 PolarHBondContact O-N 3.49Å; K222-V226 HydrophobicContact CB-CG2 4.05Å; K222-V226 WeakPolarHBondContact O-CA 3.23Å; K222-V226 VanDerWaalsContact O-CB 3.26Å; K222-V226 WeakPolarHBondContact O-CB 3.49Å; K222-V226 PolarHBondContact O-N 3.12Å; K222-M287 HydrophobicContact CB-CG 3.78Å; K222-M287 HydrophobicContact CB-SD 3.48Å; K222-M287 WeakPolarHBondContact CB-SD 3.34Å; K222-M287 HydrophobicContact CD-CG 3.69Å; K222-M287 HydrophobicContact CD-SD 4.43Å; K222-M287 HydrophobicContact CG-CG 4.36Å; K222-S290 PolarHBondContact NZ-OG 3Å; K222-M291 HydrophobicContact CB-SD 3.87Å; K222-M291 HydrophobicContact CD-CG 4.15Å; K222-M291 HydrophobicContact CD-SD 3.77Å; K222-M291 HydrophobicContact CG-CE 4.25Å; K222-M291 HydrophobicContact CG-SD 3.76Å
223D95.3Very high96.7Very high84 Ų8435.9 Ų35.945%0.44919%0.191SC..Hα-helixtrans-66.6-31.2-177.4-55.8-27.8000111.7I221 T227I221-D223 PolarHBondContact O-N 2.86Å; D223-T227 WeakPolarHBondContact O-CB 3.3Å; D223-T227 PolarHBondContact O-OG1 3.4Å
224A95.2Very high96.6Very high39 Ų3930.1 Ų30.132%0.32216%0.16SC..Hα-helixtrans-83.9-46.1171.500000111.2L184 I187 I221 K222L184-A224 HydrophobicContact CD2-CB 3.77Å; I187-A224 HydrophobicContact CD1-CB 3.91Å; I221-A224 PolarHBondContact O-N 3.18Å; I221-A224 VanDerWaalsContact O-N 3.1Å; K222-A224 VanDerWaalsContact C-N 3.27Å; K222-A224 PolarHBondContact O-N 3.35Å
225F97.2Very high96.3Very high0 Ų030 Ų300%016%0.16CC..Hα-helixtrans-75.2-53.2-170.2-171.7-77.4000113I183 I187 M205 C208 C209 I218 I221 K222 E228 L229I183-F225 HydrophobicContact CB-CE2 4.45Å; I183-F225 HydrophobicContact CG1-CD2 4.03Å; I183-F225 HydrophobicContact CG1-CE2 3.78Å; I183-F225 HydrophobicContact CG2-CD2 3.8Å; I183-F225 HydrophobicContact CG2-CE2 4.05Å; I187-F225 HydrophobicContact CD1-CB 4.48Å; M205-F225 HydrophobicContact CB-CE2 4.35Å; M205-F225 HydrophobicContact CB-CZ 4.09Å; M205-F225 HydrophobicContact CE-CD1 4.29Å; M205-F225 HydrophobicContact CE-CD2 4.33Å; M205-F225 HydrophobicContact CE-CE1 4.41Å; M205-F225 HydrophobicContact CE-CE2 4.48Å; M205-F225 HydrophobicContact CE-CG 4.24Å; M205-F225 WeakPolarHBondContact CE-O 3.42Å; M205-F225 HydrophobicContact CG-CE2 4.27Å; M205-F225 HydrophobicContact CG-CZ 4.47Å; C208-F225 HydrophobicContact CB-CE2 4.5Å; C208-F225 HydrophobicContact CB-CZ 4.35Å; C209-F225 VanDerWaalsContact SG-CE1 3.6Å; I218-F225 HydrophobicContact CD1-CE1 4.16Å; I218-F225 HydrophobicContact CD1-CZ 4.05Å; I218-F225 HydrophobicContact CG2-CB 4.11Å; I218-F225 HydrophobicContact CG2-CD1 3.64Å; I218-F225 HydrophobicContact CG2-CD2 4.36Å; I218-F225 HydrophobicContact CG2-CE1 4.09Å; I218-F225 HydrophobicContact CG2-CG 3.8Å; I221-F225 HydrophobicContact CD1-CB 4.32Å; I221-F225 HydrophobicContact CD1-CD2 4.16Å; I221-F225 HydrophobicContact CG1-CB 4.29Å; I221-F225 WeakPolarHBondContact O-CB 3.44Å; I221-F225 PolarHBondContact O-N 3.48Å; K222-F225 PolarHBondContact O-N 3.49Å; F225-E228 PolarHBondContact O-N 2.81Å; F225-L229 HydrophobicContact CD1-CD1 4.01Å; F225-L229 HydrophobicContact CE1-CD1 3.58Å; F225-L229 HydrophobicContact CE1-CG 4.36Å; F225-L229 PolarHBondContact O-N 3.01Å
226V97.8Very high95.9Very high0 Ų036.9 Ų36.90%020%0.197CC..Hα-helixtrans-71.3-34.6-176.6178.90000110.7K222 E228 L229 V230 W251 L275 M287 L288 M291 V293K222-V226 HydrophobicContact CB-CG2 4.05Å; K222-V226 WeakPolarHBondContact O-CA 3.23Å; K222-V226 VanDerWaalsContact O-CB 3.26Å; K222-V226 WeakPolarHBondContact O-CB 3.49Å; K222-V226 PolarHBondContact O-N 3.12Å; V226-E228 VanDerWaalsContact C-N 3.29Å; V226-E228 PolarHBondContact O-N 2.92Å; V226-L229 PolarHBondContact O-N 3.12Å; V226-L229 VanDerWaalsContact O-N 3.11Å; V226-V230 HydrophobicContact CG1-CG2 3.84Å; V226-V230 WeakPolarHBondContact O-CB 3.13Å; V226-V230 WeakPolarHBondContact O-CG2 3.45Å; V226-V230 PolarHBondContact O-N 3.49Å; V226-W251 HydrophobicContact CG1-CH2 4Å; V226-W251 HydrophobicContact CG1-CZ2 4.08Å; V226-L275 HydrophobicContact CG1-CD2 4.46Å; V226-M287 HydrophobicContact CG2-CE 3.75Å; V226-M287 HydrophobicContact CG2-SD 4.06Å; V226-L288 HydrophobicContact CG1-CD2 3.7Å; V226-L288 HydrophobicContact CG2-CD2 4.27Å; V226-M291 HydrophobicContact CB-CE 4.06Å; V226-M291 HydrophobicContact CB-SD 3.75Å; V226-M291 HydrophobicContact CG1-CE 4.3Å; V226-M291 HydrophobicContact CG1-SD 3.81Å; V226-M291 HydrophobicContact CG2-SD 4.06Å; V226-V293 HydrophobicContact CG1-CG2 4.17Å
227T96Very high95.5Very high13 Ų1331.8 Ų31.88%0.0818%0.177CC..Hα-helixtrans-54.6-45.6176-67.80000112D223 V230 H231 W251D223-T227 WeakPolarHBondContact O-CB 3.3Å; D223-T227 PolarHBondContact O-OG1 3.4Å; T227-V230 PolarHBondContact O-N 3.36Å; T227-H231 WeakPolarHBondContact O-CB 3.48Å; T227-H231 PolarHBondContact O-N 3.42Å; T227-W251 PolarHBondContact OG1-NE1 3.24Å
228E95.5Very high95.2Very high28 Ų2835.6 Ų35.613%0.13120%0.201CC..Hα-helixtrans-71.6-30.1179.3-62.9-54.4147.200112.9I187 I190 M205 F225 V226 P232I187-E228 HydrophobicContact CG2-CG 3.83Å; I190-E228 HydrophobicContact CB-CB 4.46Å; I190-E228 HydrophobicContact CB-CG 4.4Å; I190-E228 HydrophobicContact CG1-CB 4.4Å; I190-E228 HydrophobicContact CG2-CB 4.2Å; I190-E228 HydrophobicContact CG2-CG 4.45Å; I190-E228 WeakPolarHBondContact CG2-OE2 3.43Å; M205-E228 HydrophobicContact CE-CB 3.94Å; F225-E228 PolarHBondContact O-N 2.81Å; V226-E228 VanDerWaalsContact C-N 3.29Å; V226-E228 PolarHBondContact O-N 2.92Å; E228-P232 WeakPolarHBondContact O-CD 3.24Å
229L97.7Very high95Very high0 Ų036.3 Ų36.30%021%0.205CC..Hα-helixtrans-69.1-33.2170.9-72.2179.2000112.6L202 M205 F225 V226 P232 F233 L275 L278L202-L229 HydrophobicContact CD1-CD2 3.77Å; M205-L229 HydrophobicContact CB-CD2 4.39Å; M205-L229 HydrophobicContact CE-CD2 4.13Å; M205-L229 HydrophobicContact CE-CG 3.88Å; F225-L229 HydrophobicContact CD1-CD1 4.01Å; F225-L229 HydrophobicContact CE1-CD1 3.58Å; F225-L229 HydrophobicContact CE1-CG 4.36Å; F225-L229 PolarHBondContact O-N 3.01Å; V226-L229 PolarHBondContact O-N 3.12Å; V226-L229 VanDerWaalsContact O-N 3.11Å; L229-P232 WeakPolarHBondContact O-CD 3.31Å; L229-F233 WeakPolarHBondContact O-CE2 3.28Å; L229-L275 HydrophobicContact CB-CD2 3.88Å; L229-L275 HydrophobicContact CB-CG 4.33Å; L229-L275 HydrophobicContact CD1-CD2 4.16Å; L229-L278 HydrophobicContact CD1-CD1 4.03Å
230V97.6Very high94.8Very high0 Ų037.6 Ų37.60%021%0.213CC..Hα-helixtrans-86.2-28.8-176.7172.60000112.3V226 T227 P232 F233 I234 W251 L275 V293 I296V226-V230 HydrophobicContact CG1-CG2 3.84Å; V226-V230 WeakPolarHBondContact O-CB 3.13Å; V226-V230 WeakPolarHBondContact O-CG2 3.45Å; V226-V230 PolarHBondContact O-N 3.49Å; T227-V230 PolarHBondContact O-N 3.36Å; V230-P232 VanDerWaalsContact C-N 3.3Å; V230-P232 VanDerWaalsContact O-N 3.11Å; V230-F233 WeakPolarHBondContact O-CB 3.49Å; V230-F233 WeakPolarHBondContact O-CD2 3.46Å; V230-F233 PolarHBondContact O-N 3.07Å; V230-I234 HydrophobicContact CG1-CD1 4.29Å; V230-I234 HydrophobicContact CG1-CG1 4.03Å; V230-I234 PolarHBondContact O-N 3.42Å; V230-W251 HydrophobicContact CB-CH2 4.09Å; V230-W251 HydrophobicContact CB-CZ2 4Å; V230-W251 HydrophobicContact CB-CZ3 4.45Å; V230-W251 HydrophobicContact CG1-CD2 4.17Å; V230-W251 HydrophobicContact CG1-CE3 3.97Å; V230-W251 HydrophobicContact CG1-CH2 4.06Å; V230-W251 HydrophobicContact CG1-CZ2 4.22Å; V230-W251 HydrophobicContact CG1-CZ3 3.92Å; V230-W251 HydrophobicContact CG2-CH2 3.74Å; V230-W251 HydrophobicContact CG2-CZ2 4.01Å; V230-W251 HydrophobicContact CG2-CZ3 4.28Å; V230-L275 HydrophobicContact CG2-CD1 4.14Å; V230-L275 HydrophobicContact CG2-CD2 4.07Å; V230-V293 HydrophobicContact CG2-CG1 4.32Å; V230-V293 HydrophobicContact CG2-CG2 4.04Å; V230-I296 HydrophobicContact CG1-CB 4.23Å; V230-I296 HydrophobicContact CG1-CG1 4.21Å; V230-I296 HydrophobicContact CG1-CG2 3.81Å
231H95Very high94.7Very high62 Ų6237.8 Ų37.829%0.28722%0.216SC..G310 helixtrans-48.5-38.1-177.3-174.2-91.9000115.4T227 F233 I234 K259T227-H231 WeakPolarHBondContact O-CB 3.48Å; T227-H231 PolarHBondContact O-N 3.42Å; H231-F233 PolarHBondContact O-N 2.78Å; H231-I234 PolarHBondContact O-N 3.3Å; H231-K259 WeakPolarHBondContact CE1-CE 3.41Å; H231-K259 WeakPolarHBondContact NE2-CE 3.38Å; H231-K259 WeakPolarHBondContact O-CE 3.32Å; H231-K259 PolarHBondContact O-NZ 3.21Å
232P95.9Very high94.7Very high4 Ų439.7 Ų39.73%0.02623%0.233CC..G310 helixtrans-58.4-28.1175.5-27.538.4000114.5E228 L229 V230 E262 F267 R268 A271E228-P232 WeakPolarHBondContact O-CD 3.24Å; L229-P232 WeakPolarHBondContact O-CD 3.31Å; V230-P232 VanDerWaalsContact C-N 3.3Å; V230-P232 VanDerWaalsContact O-N 3.11Å; P232-E262 HydrophobicContact CB-CB 3.72Å; P232-E262 HydrophobicContact CB-CG 4.47Å; P232-E262 PolarHBondContact O-N 2.69Å; P232-F267 HydrophobicContact CG-CD1 4.11Å; P232-F267 HydrophobicContact CG-CE1 3.9Å; P232-R268 HydrophobicContact CB-CG 4.38Å; P232-A271 HydrophobicContact CG-CB 4.01Å
233F97.7Very high94.6Very high0 Ų038.7 Ų38.70%023%0.229CC..G310 helixtrans-95-17.9-173.5-48.1-55.7000113.5L229 V230 H231 G235 R261 R268 A271 L272 L275 I296 L297 Y300L229-F233 WeakPolarHBondContact O-CE2 3.28Å; V230-F233 WeakPolarHBondContact O-CB 3.49Å; V230-F233 WeakPolarHBondContact O-CD2 3.46Å; V230-F233 PolarHBondContact O-N 3.07Å; H231-F233 PolarHBondContact O-N 2.78Å; F233-G235 PolarHBondContact O-N 3.35Å; F233-R261 PolarHBondContact O-NE 3.29Å; F233-R268 HydrophobicContact CE1-CB 4.04Å; F233-R268 HydrophobicContact CE1-CG 4.33Å; F233-R268 WeakPolarHBondContact CZ-O 3.45Å; F233-A271 HydrophobicContact CE2-CB 4.09Å; F233-A271 HydrophobicContact CZ-CB 3.71Å; F233-L272 HydrophobicContact CE1-CB 4.21Å; F233-L272 HydrophobicContact CZ-CB 3.71Å; F233-L272 HydrophobicContact CZ-CD1 4.22Å; F233-L275 HydrophobicContact CD2-CD1 4.01Å; F233-L275 HydrophobicContact CE2-CD1 3.57Å; F233-I296 HydrophobicContact CB-CG2 3.96Å; F233-L297 HydrophobicContact CB-CD2 4.36Å; F233-L297 HydrophobicContact CD2-CD2 3.76Å; F233-L297 HydrophobicContact CE2-CD2 4.26Å; F233-L297 HydrophobicContact CG-CD2 3.98Å; F233-Y300 HydrophobicContact CB-CD1 4.46Å; F233-Y300 HydrophobicContact CB-CD2 4.27Å; F233-Y300 HydrophobicContact CB-CG 3.97Å; F233-Y300 AromaticContact CD1-CD1 3.75Å; F233-Y300 HydrophobicContact CD1-CD1 3.75Å; F233-Y300 AromaticContact CD1-CD2 3.79Å; F233-Y300 HydrophobicContact CD1-CD2 3.79Å; F233-Y300 AromaticContact CD1-CE1 3.66Å; F233-Y300 HydrophobicContact CD1-CE1 3.66Å; F233-Y300 AromaticContact CD1-CE2 3.71Å; F233-Y300 HydrophobicContact CD1-CE2 3.71Å; F233-Y300 AromaticContact CD1-CG 3.79Å; F233-Y300 HydrophobicContact CD1-CG 3.79Å; F233-Y300 AromaticContact CD1-CZ 3.61Å; F233-Y300 HydrophobicContact CE1-CD1 4.37Å; F233-Y300 AromaticContact CE1-CE1 3.88Å; F233-Y300 HydrophobicContact CE1-CE1 3.88Å; F233-Y300 HydrophobicContact CE1-CE2 4.28Å; F233-Y300 AromaticContact CE1-CZ 3.8Å; F233-Y300 HydrophobicContact CG-CD1 4.26Å; F233-Y300 HydrophobicContact CG-CD2 4.48Å; F233-Y300 HydrophobicContact CG-CG 4.19Å
234I95Very high94.5Very high1 Ų138.6 Ų38.61%0.00522%0.222CC..  trans-66.7128.2178.9-56178.6000109.3V230 H231 W251 Y254 L255 K259 I296V230-I234 HydrophobicContact CG1-CD1 4.29Å; V230-I234 HydrophobicContact CG1-CG1 4.03Å; V230-I234 PolarHBondContact O-N 3.42Å; H231-I234 PolarHBondContact O-N 3.3Å; I234-W251 HydrophobicContact CD1-CB 4.07Å; I234-W251 HydrophobicContact CD1-CG 3.96Å; I234-Y254 HydrophobicContact CD1-CD2 3.97Å; I234-L255 HydrophobicContact CG2-CD2 3.81Å; I234-K259 HydrophobicContact CB-CD 4.1Å; I234-K259 HydrophobicContact CG2-CD 3.99Å; I234-K259 PolarHBondContact O-NZ 2.88Å; I234-I296 HydrophobicContact CG1-CG2 4.13Å
235G92.7Very high94.4Very high3 Ų342.7 Ų42.73%0.03124%0.239CC..SBendtrans-175.3-166.6173.100000109.8F233 G237 K259F233-G235 PolarHBondContact O-N 3.35Å; G235-G237 PolarHBondContact O-N 3.42Å; G235-K259 VanDerWaalsContact CA-O 3.26Å; G235-K259 WeakPolarHBondContact CA-O 3.29Å
236D89.4Confident94.4Very high144 Ų14448.2 Ų48.277%0.7727%0.265SS*.SBendtrans-55.6139.2179.8-169.830.9000112.1R261D236-R261 VanDerWaalsContact O-CZ 3.28Å; D236-R261 PolarHBondContact O-NH1 2.88Å; D236-R261 PolarHBondContact O-NH2 3.48Å
237G89.1Confident94.3Very high15 Ų1548.3 Ų48.316%0.15527%0.265CS..  trans-176.5155.2-173.600000113.6G235 F239G235-G237 PolarHBondContact O-N 3.42Å; G237-F239 VanDerWaalsContact O-CD2 3.27Å; G237-F239 WeakPolarHBondContact O-CD2 3.19Å; G237-F239 PolarHBondContact O-N 2.95Å
238D90.4Very high94.2Very high130 Ų13048.2 Ų48.270%0.69527%0.265SS*.  trans-89.495.8-177.9-68.8-41.2000110.3R298 E299D238-R298 PolarHBondContact O-NH2 3.42Å; D238-E299 PolarHBondContact N-OE2 3.14Å; D238-E299 VanDerWaalsContact N-OE2 3.12Å
239F92.9Very high94.1Very high16 Ų1651 Ų517%0.0729%0.285CS..  trans-108.8120.4175.6-55.7-84.9000110.9G237 R244 I247 L255 Y295 I296 E299G237-F239 VanDerWaalsContact O-CD2 3.27Å; G237-F239 WeakPolarHBondContact O-CD2 3.19Å; G237-F239 PolarHBondContact O-N 2.95Å; F239-R244 HydrophobicContact CB-CG 3.76Å; F239-R244 PolarHBondContact O-NE 3.2Å; F239-R244 VanDerWaalsContact O-NE 3.1Å; F239-R244 PolarHBondContact O-NH2 2.89Å; F239-I247 HydrophobicContact CD1-CD1 3.55Å; F239-I247 HydrophobicContact CE1-CD1 3.7Å; F239-I247 HydrophobicContact CG-CD1 4.3Å; F239-L255 HydrophobicContact CD2-CD1 4.04Å; F239-L255 HydrophobicContact CD2-CD2 4.35Å; F239-L255 HydrophobicContact CE1-CD1 4.49Å; F239-L255 HydrophobicContact CE2-CD1 3.96Å; F239-L255 HydrophobicContact CE2-CD2 3.62Å; F239-L255 HydrophobicContact CE2-CG 4.33Å; F239-L255 HydrophobicContact CG-CD1 4.36Å; F239-L255 HydrophobicContact CZ-CD1 4.18Å; F239-L255 HydrophobicContact CZ-CD2 3.99Å; F239-Y295 WeakPolarHBondContact CE1-O 3.46Å; F239-I296 HydrophobicContact CE1-CD1 4.2Å; F239-I296 HydrophobicContact CZ-CD1 4.07Å; F239-E299 HydrophobicContact CD1-CG 4.28Å; F239-E299 HydrophobicContact CE1-CB 4.48Å; F239-E299 HydrophobicContact CE1-CG 3.63Å; F239-E299 HydrophobicContact CE2-CG 3.97Å; F239-E299 HydrophobicContact CZ-CB 3.97Å; F239-E299 HydrophobicContact CZ-CG 3.45Å; F239-E299 VanDerWaalsContact CZ-CG 3.45Å
240T93.8Very high93.6Very high71 Ų7155 Ų5544%0.43630%0.304SS..  trans-65.3159.9169.665.80000110.7S242 E243 R244T240-S242 VanDerWaalsContact C-N 3.3Å; T240-S242 PolarHBondContact O-N 3.28Å; T240-S242 PolarHBondContact OG1-OG 3.04Å; T240-E243 PolarHBondContact N-OE2 3.43Å; T240-E243 PolarHBondContact O-N 3.37Å; T240-E243 VanDerWaalsContact O-N 3.11Å; T240-E243 WeakPolarHBondContact OG1-CG 3.44Å; T240-E243 PolarHBondContact OG1-N 2.82Å; T240-E243 PolarHBondContact OG1-OE2 3.32Å; T240-E243 VanDerWaalsContact OG1-OE2 3.11Å; T240-R244 WeakPolarHBondContact O-CG 3.34Å; T240-R244 PolarHBondContact O-N 3.39Å
241S92.2Very high93.4Very high95 Ų9555 Ų5566%0.66430%0.304SS*.Hα-helixtrans-56.5-43.8178.5-55.50000112.4E243 R244 D245S241-E243 VanDerWaalsContact C-N 3.29Å; S241-E243 PolarHBondContact O-N 2.8Å; S241-R244 PolarHBondContact O-N 3.24Å; S241-D245 PolarHBondContact O-N 2.86Å
242S95Very high93.2Very high80 Ų8055.1 Ų55.156%0.55931%0.305SS*.Hα-helixtrans-64.3-31.5177.850.20000113.5T240 Q246T240-S242 VanDerWaalsContact C-N 3.3Å; T240-S242 PolarHBondContact O-N 3.28Å; T240-S242 PolarHBondContact OG1-OG 3.04Å; S242-Q246 WeakPolarHBondContact O-CG 3.39Å
243E95.4Very high92.7Very high27 Ų2760 Ų6013%0.12633%0.33CS..Hα-helixtrans-74-39176.5-68.8167.6159.500111.3T240 S241 D245 Q246 I247 Y295 R298T240-E243 PolarHBondContact N-OE2 3.43Å; T240-E243 PolarHBondContact O-N 3.37Å; T240-E243 VanDerWaalsContact O-N 3.11Å; T240-E243 WeakPolarHBondContact OG1-CG 3.44Å; T240-E243 PolarHBondContact OG1-N 2.82Å; T240-E243 PolarHBondContact OG1-OE2 3.32Å; T240-E243 VanDerWaalsContact OG1-OE2 3.11Å; S241-E243 VanDerWaalsContact C-N 3.29Å; S241-E243 PolarHBondContact O-N 2.8Å; E243-D245 PolarHBondContact O-N 3.37Å; E243-Q246 PolarHBondContact O-N 3.18Å; E243-I247 WeakPolarHBondContact O-CG1 3.48Å; E243-I247 PolarHBondContact O-N 3.08Å; E243-Y295 HydrophobicContact CB-CD1 3.98Å; E243-Y295 HydrophobicContact CB-CE1 4.14Å; E243-Y295 HydrophobicContact CB-CG 4.32Å; E243-Y295 HydrophobicContact CG-CD1 3.7Å; E243-Y295 HydrophobicContact CG-CE1 3.56Å; E243-R298 VanDerWaalsContact CD-NH2 3.35Å; E243-R298 IonicContact OE1-CZ 3.37Å; E243-R298 IonicContact OE1-NH1 2.65Å; E243-R298 PolarHBondContact OE1-NH1 3.22Å; E243-R298 IonicContact OE1-NH2 3.22Å; E243-R298 PolarHBondContact OE1-NH2 3.07Å; E243-R298 IonicContact OE2-CZ 3.89Å; E243-R298 IonicContact OE2-NH1 3.88Å; E243-R298 IonicContact OE2-NH2 2.99Å; E243-R298 PolarHBondContact OE2-NH2 3.29Å
244R92.8Very high92Very high82 Ų8263.1 Ų63.131%0.30934%0.342SS..Hα-helixtrans-58.7-39.5175-67.7178.5-165.8-106.5-0.7111.1F239 T240 S241 Q246 I247 Q252F239-R244 HydrophobicContact CB-CG 3.76Å; F239-R244 PolarHBondContact O-NE 3.2Å; F239-R244 VanDerWaalsContact O-NE 3.1Å; F239-R244 PolarHBondContact O-NH2 2.89Å; T240-R244 WeakPolarHBondContact O-CG 3.34Å; T240-R244 PolarHBondContact O-N 3.39Å; S241-R244 PolarHBondContact O-N 3.24Å; R244-Q246 PolarHBondContact O-N 3.43Å; R244-I247 PolarHBondContact O-N 3.13Å; R244-Q252 PolarHBondContact O-NE2 2.91Å
245D94.3Very high91.5Very high126 Ų12664.3 Ų64.367%0.67435%0.348SS*.THydrogen-bonded Turntrans-63.9-21.9177-64.8-22.3000113.6S241 E243S241-D245 PolarHBondContact O-N 2.86Å; E243-D245 PolarHBondContact O-N 3.37Å
246Q95.6Very high90.8Very high115 Ų11569.2 Ų69.254%0.53738%0.378SS..THydrogen-bonded Turntrans-92.8-18.1177.8-60.6-65.8-37.400113.2S242 E243 R244 G292 Y295S242-Q246 WeakPolarHBondContact O-CG 3.39Å; E243-Q246 PolarHBondContact O-N 3.18Å; R244-Q246 PolarHBondContact O-N 3.43Å; Q246-G292 WeakPolarHBondContact O-CA 3.45Å; Q246-G292 PolarHBondContact O-N 2.91Å; Q246-Y295 HydrophobicContact CB-CD2 4.21Å; Q246-Y295 HydrophobicContact CB-CE2 3.48Å; Q246-Y295 VanDerWaalsContact CB-CE2 3.48Å; Q246-Y295 HydrophobicContact CG-CE2 4.17Å
247I96.2Very high90.4Very high2 Ų266.3 Ų66.31%0.0137%0.365CS..SBendtrans-80.2137.2176.6-67.7167.5000108.7F239 E243 R244 W251 Q252 L255 Y295 I296F239-I247 HydrophobicContact CD1-CD1 3.55Å; F239-I247 HydrophobicContact CE1-CD1 3.7Å; F239-I247 HydrophobicContact CG-CD1 4.3Å; E243-I247 WeakPolarHBondContact O-CG1 3.48Å; E243-I247 PolarHBondContact O-N 3.08Å; R244-I247 PolarHBondContact O-N 3.13Å; I247-W251 HydrophobicContact CG2-CB 3.92Å; I247-W251 HydrophobicContact CG2-CE3 4.1Å; I247-Q252 HydrophobicContact CB-CG 4.46Å; I247-Q252 HydrophobicContact CG2-CG 4.24Å; I247-Q252 PolarHBondContact O-NE2 3.18Å; I247-L255 HydrophobicContact CD1-CD1 3.81Å; I247-L255 HydrophobicContact CG2-CD1 4.29Å; I247-Y295 HydrophobicContact CG1-CD2 4.01Å; I247-Y295 HydrophobicContact CG1-CG 4.36Å; I247-I296 HydrophobicContact CD1-CD1 4.06Å; I247-I296 HydrophobicContact CG2-CD1 4.27Å
248C95Very high89.9Confident12 Ų1272.9 Ų72.98%0.08140%0.402CS..  trans-58.9142.8-177.488.70000111.8E250 W251 Q252 M291C248-E250 PolarHBondContact O-N 3.17Å; C248-E250 VanDerWaalsContact O-N 3.16Å; C248-E250 PolarHBondContact SG-OE2 3.02Å; C248-E250 VanDerWaalsContact SG-OE2 3.33Å; C248-W251 PolarHBondContact O-N 3.22Å; C248-W251 VanDerWaalsContact SG-CD1 3.53Å; C248-W251 PolarHBondContact SG-NE1 3.27Å; C248-Q252 PolarHBondContact O-N 3.39Å; C248-M291 HydrophobicContact CB-CB 4.41Å; C248-M291 PolarHBondContact N-O 2.97Å; C248-M291 VanDerWaalsContact N-O 3.11Å
249P91.5Very high89.9Confident86 Ų8668.3 Ų68.356%0.55838%0.376SS*.Hα-helixtrans-56.9-35.1-171.5-27.636.1000114.3W251 Q252P249-W251 PolarHBondContact O-N 2.97Å; P249-Q252 PolarHBondContact O-N 2.92Å
250E88Confident89.9Confident85 Ų8575.7 Ų75.740%0.39741%0.41SS..Hα-helixtrans-59.4-35.7179.4-63.972.6-158.600111.5C248C248-E250 PolarHBondContact O-N 3.17Å; C248-E250 VanDerWaalsContact O-N 3.16Å; C248-E250 PolarHBondContact SG-OE2 3.02Å; C248-E250 VanDerWaalsContact SG-OE2 3.33Å
251W93.3Very high90Very high0 Ų073.6 Ų73.60%039%0.394CS..Hα-helixtrans-83.6-28.7-178.1-55.8-10.2000112.6V226 T227 V230 I234 I247 C248 P249 I253 Y254 L255 M291 V293 I296V226-W251 HydrophobicContact CG1-CH2 4Å; V226-W251 HydrophobicContact CG1-CZ2 4.08Å; T227-W251 PolarHBondContact OG1-NE1 3.24Å; V230-W251 HydrophobicContact CB-CH2 4.09Å; V230-W251 HydrophobicContact CB-CZ2 4Å; V230-W251 HydrophobicContact CB-CZ3 4.45Å; V230-W251 HydrophobicContact CG1-CD2 4.17Å; V230-W251 HydrophobicContact CG1-CE3 3.97Å; V230-W251 HydrophobicContact CG1-CH2 4.06Å; V230-W251 HydrophobicContact CG1-CZ2 4.22Å; V230-W251 HydrophobicContact CG1-CZ3 3.92Å; V230-W251 HydrophobicContact CG2-CH2 3.74Å; V230-W251 HydrophobicContact CG2-CZ2 4.01Å; V230-W251 HydrophobicContact CG2-CZ3 4.28Å; I234-W251 HydrophobicContact CD1-CB 4.07Å; I234-W251 HydrophobicContact CD1-CG 3.96Å; I247-W251 HydrophobicContact CG2-CB 3.92Å; I247-W251 HydrophobicContact CG2-CE3 4.1Å; C248-W251 PolarHBondContact O-N 3.22Å; C248-W251 VanDerWaalsContact SG-CD1 3.53Å; C248-W251 PolarHBondContact SG-NE1 3.27Å; P249-W251 PolarHBondContact O-N 2.97Å; W251-I253 PolarHBondContact O-N 3.4Å; W251-Y254 WeakPolarHBondContact O-CA 3.19Å; W251-Y254 WeakPolarHBondContact O-CB 3.47Å; W251-Y254 PolarHBondContact O-N 3.37Å; W251-L255 PolarHBondContact O-N 3.49Å; W251-M291 HydrophobicContact CH2-CB 3.66Å; W251-M291 HydrophobicContact CH2-CE 4Å; W251-M291 HydrophobicContact CH2-SD 4.42Å; W251-M291 HydrophobicContact CZ2-CB 4.42Å; W251-M291 HydrophobicContact CZ2-CE 3.6Å; W251-M291 HydrophobicContact CZ3-CB 4.08Å; W251-M291 WeakPolarHBondContact CZ3-O 3.39Å; W251-V293 HydrophobicContact CH2-CG2 3.55Å; W251-V293 HydrophobicContact CZ3-CG2 3.76Å; W251-I296 HydrophobicContact CE3-CG1 3.95Å; W251-I296 HydrophobicContact CZ3-CG1 4.34Å
252Q90.2Very high90.1Very high63 Ų6371.4 Ų71.429%0.29437%0.374SS..Hα-helixtrans-57.2-33.3178-63.2-1792700112.1R244 I247 C248 P249 Y254 L255 T256R244-Q252 PolarHBondContact O-NE2 2.91Å; I247-Q252 HydrophobicContact CB-CG 4.46Å; I247-Q252 HydrophobicContact CG2-CG 4.24Å; I247-Q252 PolarHBondContact O-NE2 3.18Å; C248-Q252 PolarHBondContact O-N 3.39Å; P249-Q252 PolarHBondContact O-N 2.92Å; Q252-Y254 VanDerWaalsContact C-N 3.28Å; Q252-Y254 PolarHBondContact O-N 3.47Å; Q252-L255 WeakPolarHBondContact O-CB 3.43Å; Q252-L255 PolarHBondContact O-N 2.92Å; Q252-T256 PolarHBondContact O-N 3.48Å
253I86.6Confident90.2Very high108 Ų10872.6 Ų72.655%0.55438%0.382SS*.Hα-helixtrans-56.7-46.1174.7-61.7172000110W251 L255 T256 V257W251-I253 PolarHBondContact O-N 3.4Å; I253-L255 VanDerWaalsContact C-N 3.25Å; I253-L255 PolarHBondContact O-N 3.41Å; I253-T256 PolarHBondContact O-N 2.72Å; I253-T256 PolarHBondContact O-OG1 2.76Å; I253-V257 PolarHBondContact O-N 3.02Å
254Y83.7Confident90.2Very high65 Ų6574.2 Ų74.226%0.25539%0.391SS..Hα-helixtrans-69.5-19.6178.3-59.2-58.6000114I234 W251 Q252 K259I234-Y254 HydrophobicContact CD1-CD2 3.97Å; W251-Y254 WeakPolarHBondContact O-CA 3.19Å; W251-Y254 WeakPolarHBondContact O-CB 3.47Å; W251-Y254 PolarHBondContact O-N 3.37Å; Q252-Y254 VanDerWaalsContact C-N 3.28Å; Q252-Y254 PolarHBondContact O-N 3.47Å; Y254-K259 HydrophobicContact CD1-CD 4.26Å; Y254-K259 HydrophobicContact CG-CD 4.31Å
255L83.2Confident90.4Very high25 Ų2571.6 Ų71.613%0.13139%0.386CS..Hα-helixtrans-85.7-9.2175.9-58.4-178.2000113.4I234 F239 I247 W251 Q252 I253 I296I234-L255 HydrophobicContact CG2-CD2 3.81Å; F239-L255 HydrophobicContact CD2-CD1 4.04Å; F239-L255 HydrophobicContact CD2-CD2 4.35Å; F239-L255 HydrophobicContact CE1-CD1 4.49Å; F239-L255 HydrophobicContact CE2-CD1 3.96Å; F239-L255 HydrophobicContact CE2-CD2 3.62Å; F239-L255 HydrophobicContact CE2-CG 4.33Å; F239-L255 HydrophobicContact CG-CD1 4.36Å; F239-L255 HydrophobicContact CZ-CD1 4.18Å; F239-L255 HydrophobicContact CZ-CD2 3.99Å; I247-L255 HydrophobicContact CD1-CD1 3.81Å; I247-L255 HydrophobicContact CG2-CD1 4.29Å; W251-L255 PolarHBondContact O-N 3.49Å; Q252-L255 WeakPolarHBondContact O-CB 3.43Å; Q252-L255 PolarHBondContact O-N 2.92Å; I253-L255 VanDerWaalsContact C-N 3.25Å; I253-L255 PolarHBondContact O-N 3.41Å; L255-I296 HydrophobicContact CD1-CD1 4.16Å; L255-I296 HydrophobicContact CD2-CD1 4.21Å
256T78.7Confident90.5Very high107 Ų10771.6 Ų71.666%0.65638%0.381SS*.Hα-helixtrans-102.3-17.5176.558.10000112.9Q252 I253Q252-T256 PolarHBondContact O-N 3.48Å; I253-T256 PolarHBondContact O-N 2.72Å; I253-T256 PolarHBondContact O-OG1 2.76Å
257V81.5Confident90.6Very high82 Ų8266.7 Ų66.750%0.49736%0.359SS..SBendtrans-103.8150.6173-58.80000110I253 K259I253-V257 PolarHBondContact O-N 3.02Å; V257-K259 PolarHBondContact O-N 3.3Å
258V78.7Confident90.7Very high153 Ų15367.1 Ų67.193%0.92736%0.36SS*.  trans-67.9104.7172.7-178.50000108.2
259K89.8Confident90.8Very high34 Ų3467.5 Ų67.515%0.14836%0.361CS..  trans-117129.5172.4179-173.5173.7-60.30109.2H231 I234 G235 Y254 V257H231-K259 WeakPolarHBondContact CE1-CE 3.41Å; H231-K259 WeakPolarHBondContact NE2-CE 3.38Å; H231-K259 WeakPolarHBondContact O-CE 3.32Å; H231-K259 PolarHBondContact O-NZ 3.21Å; I234-K259 HydrophobicContact CB-CD 4.1Å; I234-K259 HydrophobicContact CG2-CD 3.99Å; I234-K259 PolarHBondContact O-NZ 2.88Å; G235-K259 VanDerWaalsContact CA-O 3.26Å; G235-K259 WeakPolarHBondContact CA-O 3.29Å; Y254-K259 HydrophobicContact CD1-CD 4.26Å; Y254-K259 HydrophobicContact CG-CD 4.31Å; V257-K259 PolarHBondContact O-N 3.3Å
260E92.4Very high91.1Very high171 Ų17164 Ų6480%0.79934%0.338SS*.PPolyproline II helixtrans-81144.8169.2-65-175.616900110.8
261R95.3Very high91.6Very high27 Ų2759.9 Ų59.910%0.10232%0.319CS..PPolyproline II helixtrans-67.6158.3171.3-69.2178.7172.289.64.8109.6F233 D236 S263 W303F233-R261 PolarHBondContact O-NE 3.29Å; D236-R261 VanDerWaalsContact O-CZ 3.28Å; D236-R261 PolarHBondContact O-NH1 2.88Å; D236-R261 PolarHBondContact O-NH2 3.48Å; R261-S263 PolarHBondContact O-N 3.42Å; R261-W303 HydrophobicContact CB-CH2 4.08Å; R261-W303 HydrophobicContact CB-CZ2 4.2Å; R261-W303 HydrophobicContact CB-CZ3 4.25Å; R261-W303 VanDerWaalsContact CD-CD2 3.5Å
262E95.6Very high91.9Very high50 Ų5059.9 Ų59.923%0.23432%0.319CS..PPolyproline II helixtrans-58.2127.8173.2176.253.4-102.100109.6P232 D264 F267 R268P232-E262 HydrophobicContact CB-CB 3.72Å; P232-E262 HydrophobicContact CB-CG 4.47Å; P232-E262 PolarHBondContact O-N 2.69Å; E262-D264 HydrophobicContact CG-CB 4.32Å; E262-D264 PolarHBondContact OE1-N 3.21Å; E262-F267 HydrophobicContact CG-CB 4.01Å; E262-F267 HydrophobicContact CG-CD1 3.82Å; E262-F267 HydrophobicContact CG-CG 4.19Å; E262-R268 HydrophobicContact CB-CG 3.89Å; E262-R268 HydrophobicContact CG-CG 4.06Å; E262-R268 VanDerWaalsContact O-CD 3.29Å; E262-R268 WeakPolarHBondContact O-CD 3.28Å; E262-R268 PolarHBondContact O-NH1 2.85Å
263S95.8Very high92.3Very high105 Ų10560.1 Ų60.173%0.73432%0.32SS*.  trans-78.7-32.2-177.863.90000112.5R261 C265 R268R261-S263 PolarHBondContact O-N 3.42Å; S263-C265 PolarHBondContact O-N 3.13Å; S263-R268 PolarHBondContact O-NH1 3.29Å
264D95.9Very high92.9Very high60 Ų6055 Ų5532%0.32129%0.293SS..  trans-73111.6179.8-174.2-14.8000111E262 E266 F267 R268E262-D264 HydrophobicContact CG-CB 4.32Å; E262-D264 PolarHBondContact OE1-N 3.21Å; D264-E266 VanDerWaalsContact C-N 3.33Å; D264-E266 PolarHBondContact O-N 3.12Å; D264-E266 WeakPolarHBondContact OD1-CB 3.44Å; D264-E266 PolarHBondContact OD1-N 3.06Å; D264-F267 HydrophobicContact CB-CB 3.83Å; D264-F267 PolarHBondContact O-N 3.09Å; D264-F267 PolarHBondContact OD1-N 3.48Å; D264-R268 WeakPolarHBondContact O-CG 3.27Å; D264-R268 PolarHBondContact O-N 3.31Å; D264-R268 PolarHBondContact O-NH1 3.06Å
265C97.3Very high93.6Very high28 Ų2851.9 Ų51.919%0.18928%0.281CS..Hα-helixtrans-63.7-36.6-179.6-170.80000112.7S263 F267 R268 L269 N306S263-C265 PolarHBondContact O-N 3.13Å; C265-F267 VanDerWaalsContact C-N 3.35Å; C265-R268 PolarHBondContact O-N 3.47Å; C265-L269 WeakPolarHBondContact O-CB 3.38Å; C265-L269 WeakPolarHBondContact O-CG 3.47Å; C265-L269 PolarHBondContact O-N 3.42Å; C265-N306 VanDerWaalsContact SG-CB 3.55Å
266E96.5Very high94.3Very high125 Ų12554 Ų5458%0.58429%0.288SS*.Hα-helixtrans-67.7-41.5178.8-67.9-60.4137.700110D264 R268 L269 V270D264-E266 VanDerWaalsContact C-N 3.33Å; D264-E266 PolarHBondContact O-N 3.12Å; D264-E266 WeakPolarHBondContact OD1-CB 3.44Å; D264-E266 PolarHBondContact OD1-N 3.06Å; E266-R268 VanDerWaalsContact C-N 3.33Å; E266-R268 PolarHBondContact O-N 3.37Å; E266-L269 PolarHBondContact O-N 3.48Å; E266-V270 WeakPolarHBondContact O-CG2 3.4Å; E266-V270 PolarHBondContact O-N 3.27Å
267F96.9Very high95.3Very high13 Ų1351 Ų516%0.05727%0.267CS..Hα-helixtrans-60.3-43.8174.8-161.9-83.5000111.7M195 K198 L202 P232 E262 D264 C265 A271M195-F267 HydrophobicContact CE-CD2 3.79Å; M195-F267 HydrophobicContact CE-CE2 4.39Å; K198-F267 HydrophobicContact CB-CE2 3.8Å; K198-F267 HydrophobicContact CB-CZ 4.16Å; L202-F267 HydrophobicContact CB-CE2 4.31Å; L202-F267 HydrophobicContact CB-CZ 4.26Å; L202-F267 HydrophobicContact CD2-CD1 3.75Å; L202-F267 HydrophobicContact CD2-CD2 3.86Å; L202-F267 HydrophobicContact CD2-CE1 3.64Å; L202-F267 HydrophobicContact CD2-CE2 3.74Å; L202-F267 HydrophobicContact CD2-CG 3.87Å; L202-F267 HydrophobicContact CD2-CZ 3.64Å; L202-F267 WeakPolarHBondContact CD2-O 3.36Å; L202-F267 HydrophobicContact CG-CZ 4.43Å; P232-F267 HydrophobicContact CG-CD1 4.11Å; P232-F267 HydrophobicContact CG-CE1 3.9Å; E262-F267 HydrophobicContact CG-CB 4.01Å; E262-F267 HydrophobicContact CG-CD1 3.82Å; E262-F267 HydrophobicContact CG-CG 4.19Å; D264-F267 HydrophobicContact CB-CB 3.83Å; D264-F267 PolarHBondContact O-N 3.09Å; D264-F267 PolarHBondContact OD1-N 3.48Å; C265-F267 VanDerWaalsContact C-N 3.35Å; F267-A271 PolarHBondContact O-N 2.91Å
268R97.9Very high96.1Very high10 Ų1047.1 Ų47.14%0.03824%0.243CC..Hα-helixtrans-62-44.1174.8-70.3-159.9-54.7-73.80.5112.4P232 F233 E262 S263 D264 C265 E266 A271 L272 Y300 E304P232-R268 HydrophobicContact CB-CG 4.38Å; F233-R268 HydrophobicContact CE1-CB 4.04Å; F233-R268 HydrophobicContact CE1-CG 4.33Å; F233-R268 WeakPolarHBondContact CZ-O 3.45Å; E262-R268 HydrophobicContact CB-CG 3.89Å; E262-R268 HydrophobicContact CG-CG 4.06Å; E262-R268 VanDerWaalsContact O-CD 3.29Å; E262-R268 WeakPolarHBondContact O-CD 3.28Å; E262-R268 PolarHBondContact O-NH1 2.85Å; S263-R268 PolarHBondContact O-NH1 3.29Å; D264-R268 WeakPolarHBondContact O-CG 3.27Å; D264-R268 PolarHBondContact O-N 3.31Å; D264-R268 PolarHBondContact O-NH1 3.06Å; C265-R268 PolarHBondContact O-N 3.47Å; E266-R268 VanDerWaalsContact C-N 3.33Å; E266-R268 PolarHBondContact O-N 3.37Å; R268-A271 PolarHBondContact O-N 3.16Å; R268-L272 VanDerWaalsContact O-CB 3.26Å; R268-L272 WeakPolarHBondContact O-CB 3.34Å; R268-L272 PolarHBondContact O-N 3.48Å; R268-Y300 PolarHBondContact NE-OH 3.19Å; R268-E304 IonicContact CZ-OE2 3.92Å; R268-E304 IonicContact NE-OE2 3.32Å; R268-E304 PolarHBondContact NE-OE2 3.01Å; R268-E304 VanDerWaalsContact NH2-CD 3.34Å; R268-E304 IonicContact NH2-OE1 3.81Å; R268-E304 PolarHBondContact NH2-OE1 2.83Å; R268-E304 IonicContact NH2-OE2 2.81Å; R268-E304 PolarHBondContact NH2-OE2 3.29Å
269L98.4Very high97.1Very high20 Ų2039.8 Ų39.811%0.10520%0.199CC..Hα-helixtrans-58.9-48.4178.8-81.6167.1000111.3C265 E266 A271 L272 E273 A309 L312C265-L269 WeakPolarHBondContact O-CB 3.38Å; C265-L269 WeakPolarHBondContact O-CG 3.47Å; C265-L269 PolarHBondContact O-N 3.42Å; E266-L269 PolarHBondContact O-N 3.48Å; L269-A271 VanDerWaalsContact C-N 3.34Å; L269-A271 PolarHBondContact O-N 3.31Å; L269-L272 PolarHBondContact O-N 3.4Å; L269-L272 VanDerWaalsContact O-N 3.16Å; L269-E273 WeakPolarHBondContact O-CB 3.28Å; L269-E273 VanDerWaalsContact O-CG 3.29Å; L269-E273 WeakPolarHBondContact O-CG 3.38Å; L269-E273 PolarHBondContact O-N 3.33Å; L269-A309 HydrophobicContact CD2-CB 3.84Å; L269-A309 HydrophobicContact CG-CB 4.25Å; L269-L312 HydrophobicContact CD2-CD2 4.47Å
270V98.2Very high97.5Very high12 Ų1238.9 Ų38.97%0.07320%0.195CC..Hα-helixtrans-62.5-41.6179.5179.70000112.1L202 R203 H206 E266 L272 G274L202-V270 HydrophobicContact CD2-CB 3.89Å; L202-V270 HydrophobicContact CD2-CG1 3.95Å; L202-V270 HydrophobicContact CG-CB 4.32Å; L202-V270 HydrophobicContact CG-CG1 3.81Å; R203-V270 VanDerWaalsContact CZ-CG2 3.47Å; H206-V270 HydrophobicContact CB-CG1 3.81Å; H206-V270 PolarHBondContact CD2-O 3.2Å; E266-V270 WeakPolarHBondContact O-CG2 3.4Å; E266-V270 PolarHBondContact O-N 3.27Å; V270-L272 VanDerWaalsContact C-N 3.33Å; V270-G274 PolarHBondContact O-N 3.47Å
271A98.5Very high97.7Very high0 Ų030.9 Ų30.90%016%0.158CC..Hα-helixtrans-63.8-41.1176.400000111.6L202 P232 F233 F267 R268 L269 G274 L275L202-A271 HydrophobicContact CD1-CB 4.02Å; L202-A271 HydrophobicContact CD2-CB 4.28Å; P232-A271 HydrophobicContact CG-CB 4.01Å; F233-A271 HydrophobicContact CE2-CB 4.09Å; F233-A271 HydrophobicContact CZ-CB 3.71Å; F267-A271 PolarHBondContact O-N 2.91Å; R268-A271 PolarHBondContact O-N 3.16Å; L269-A271 VanDerWaalsContact C-N 3.34Å; L269-A271 PolarHBondContact O-N 3.31Å; A271-G274 PolarHBondContact O-N 3.41Å; A271-L275 PolarHBondContact O-N 3.08Å; A271-L275 VanDerWaalsContact O-N 3.1Å
272L98.7Very high97.9Very high0 Ų031.2 Ų31.20%017%0.165CC..Hα-helixtrans-72.1-37.6-178.7-171.761.9000112F233 R268 L269 V270 G274 L275 Y276 L297 Y300 A309 L312 C313F233-L272 HydrophobicContact CE1-CB 4.21Å; F233-L272 HydrophobicContact CZ-CB 3.71Å; F233-L272 HydrophobicContact CZ-CD1 4.22Å; R268-L272 VanDerWaalsContact O-CB 3.26Å; R268-L272 WeakPolarHBondContact O-CB 3.34Å; R268-L272 PolarHBondContact O-N 3.48Å; L269-L272 PolarHBondContact O-N 3.4Å; L269-L272 VanDerWaalsContact O-N 3.16Å; V270-L272 VanDerWaalsContact C-N 3.33Å; L272-G274 VanDerWaalsContact C-N 3.28Å; L272-G274 PolarHBondContact O-N 3.06Å; L272-L275 PolarHBondContact O-N 3.03Å; L272-Y276 WeakPolarHBondContact O-CB 3.27Å; L272-Y276 PolarHBondContact O-N 2.91Å; L272-L297 HydrophobicContact CD1-CD1 4.27Å; L272-L297 HydrophobicContact CD1-CD2 3.88Å; L272-Y300 HydrophobicContact CD2-CE1 4.12Å; L272-A309 VanDerWaalsContact CD2-O 3.23Å; L272-A309 WeakPolarHBondContact CD2-O 3.3Å; L272-L312 HydrophobicContact CB-CD2 4.07Å; L272-L312 HydrophobicContact CD2-CB 3.96Å; L272-L312 HydrophobicContact CD2-CD2 3.95Å; L272-L312 HydrophobicContact CD2-CG 3.88Å; L272-L312 HydrophobicContact CG-CD2 3.85Å; L272-L312 HydrophobicContact CG-CG 3.88Å; L272-C313 HydrophobicContact CD1-CB 4.44Å; L272-C313 HydrophobicContact CD2-CB 3.87Å
273E98.7Very high98Very high67 Ų6729.7 Ų29.731%0.31316%0.161SC..Hα-helixtrans-57.8-43.5168.9-74.8174.1165.700110R203 H206 L269 L275 Y276 Q277 L312R203-E273 IonicContact NH1-OE2 2.62Å; H206-E273 IonicContact CD2-OE2 2.77Å; H206-E273 IonicContact NE2-OE2 3.28Å; H206-E273 PolarHBondContact NE2-OE2 3.48Å; L269-E273 WeakPolarHBondContact O-CB 3.28Å; L269-E273 VanDerWaalsContact O-CG 3.29Å; L269-E273 WeakPolarHBondContact O-CG 3.38Å; L269-E273 PolarHBondContact O-N 3.33Å; E273-L275 PolarHBondContact O-N 2.64Å; E273-Y276 PolarHBondContact O-N 3.03Å; E273-Q277 WeakPolarHBondContact O-CB 3.4Å; E273-Q277 WeakPolarHBondContact O-CG 3.35Å; E273-Q277 PolarHBondContact O-N 3.44Å; E273-L312 HydrophobicContact CB-CD2 4.39Å; E273-L312 HydrophobicContact CG-CD2 3.58Å
274G98.7Very high98.1Very high0 Ų024.7 Ų24.70%013%0.126CC..Hα-helixtrans-56.8-48.3174.400000112.7C209 V270 A271 L272 Q277 L278C209-G274 WeakPolarHBondContact CB-O 3.32Å; V270-G274 PolarHBondContact O-N 3.47Å; A271-G274 PolarHBondContact O-N 3.41Å; L272-G274 VanDerWaalsContact C-N 3.28Å; L272-G274 PolarHBondContact O-N 3.06Å; G274-Q277 PolarHBondContact O-N 3.45Å; G274-L278 WeakPolarHBondContact O-CG 3.31Å; G274-L278 PolarHBondContact O-N 2.88Å
275L98.9Very high98.3Very high0 Ų021.8 Ų21.80%011%0.111CC..Hα-helixtrans-63.7-41.1176.4-64.4179.1000112.7V226 L229 V230 F233 A271 L272 E273 L278 C279 L288 V293 L297 T316V226-L275 HydrophobicContact CG1-CD2 4.46Å; L229-L275 HydrophobicContact CB-CD2 3.88Å; L229-L275 HydrophobicContact CB-CG 4.33Å; L229-L275 HydrophobicContact CD1-CD2 4.16Å; V230-L275 HydrophobicContact CG2-CD1 4.14Å; V230-L275 HydrophobicContact CG2-CD2 4.07Å; F233-L275 HydrophobicContact CD2-CD1 4.01Å; F233-L275 HydrophobicContact CE2-CD1 3.57Å; A271-L275 PolarHBondContact O-N 3.08Å; A271-L275 VanDerWaalsContact O-N 3.1Å; L272-L275 PolarHBondContact O-N 3.03Å; E273-L275 PolarHBondContact O-N 2.64Å; L275-L278 PolarHBondContact O-N 3Å; L275-C279 PolarHBondContact O-N 2.99Å; L275-C279 PolarHBondContact O-SG 3.17Å; L275-L288 HydrophobicContact CD2-CD2 3.85Å; L275-V293 HydrophobicContact CD1-CG1 4.29Å; L275-L297 HydrophobicContact CD1-CD1 4.23Å; L275-L297 HydrophobicContact CD1-CD2 4.1Å; L275-T316 HydrophobicContact CB-CG2 4.34Å
276Y98.8Very high98.3Very high69 Ų6923.9 Ų23.927%0.27112%0.123SC..Hα-helixtrans-61.7-44.7176.2179.6-108.1000111.3L272 E273 L278 C279 L312 R315 T316 L319L272-Y276 WeakPolarHBondContact O-CB 3.27Å; L272-Y276 PolarHBondContact O-N 2.91Å; E273-Y276 PolarHBondContact O-N 3.03Å; Y276-L278 VanDerWaalsContact C-N 3.34Å; Y276-L278 PolarHBondContact O-N 3.41Å; Y276-C279 VanDerWaalsContact O-CB 3.25Å; Y276-C279 WeakPolarHBondContact O-CB 3.46Å; Y276-C279 PolarHBondContact O-N 3.05Å; Y276-L312 HydrophobicContact CD1-CD1 4.05Å; Y276-L312 HydrophobicContact CD2-CD1 4.16Å; Y276-L312 HydrophobicContact CG-CD1 3.77Å; Y276-R315 HydrophobicContact CD2-CB 4.34Å; Y276-R315 HydrophobicContact CE2-CB 3.87Å; Y276-T316 WeakPolarHBondContact CB-OG1 3.31Å; Y276-T316 WeakPolarHBondContact CD2-OG1 3.35Å; Y276-L319 HydrophobicContact CD2-CD1 4.34Å; Y276-L319 HydrophobicContact CE2-CD1 3.92Å
277Q98.6Very high98.4Very high45 Ų4518.2 Ų18.221%0.2110%0.096CC..Hα-helixtrans-65.6-37.7178.5-66.3-63.1-26.100111.9C209 M210 H215 E273 G274 C279 N280C209-Q277 HydrophobicContact CB-CB 4.03Å; C209-Q277 VanDerWaalsContact O-CB 3.25Å; C209-Q277 WeakPolarHBondContact O-CB 3.36Å; M210-Q277 HydrophobicContact CE-CG 3.61Å; M210-Q277 HydrophobicContact CG-CG 4.27Å; M210-Q277 HydrophobicContact SD-CB 4.47Å; M210-Q277 HydrophobicContact SD-CG 3.51Å; M210-Q277 VanDerWaalsContact SD-CG 3.51Å; H215-Q277 PolarHBondContact CE1-O 3.22Å; E273-Q277 WeakPolarHBondContact O-CB 3.4Å; E273-Q277 WeakPolarHBondContact O-CG 3.35Å; E273-Q277 PolarHBondContact O-N 3.44Å; G274-Q277 PolarHBondContact O-N 3.45Å; Q277-C279 PolarHBondContact O-N 3.35Å; Q277-N280 WeakPolarHBondContact O-CB 3.49Å; Q277-N280 PolarHBondContact O-N 3.44Å
278L98.8Very high98.5Very high0 Ų017.6 Ų17.60%09%0.093CC..Hα-helixtrans-56.6-32.7171.2-73.8174.6000112.4C209 H215 I218 L229 G274 L275 Y276 N280 S281 G284 M287 L288C209-L278 HydrophobicContact CB-CD2 4.16Å; C209-L278 HydrophobicContact CB-CG 3.99Å; H215-L278 VanDerWaalsContact CE1-CA 3.45Å; H215-L278 WeakPolarHBondContact CE1-CA 3.47Å; H215-L278 PolarHBondContact ND1-O 2.81Å; I218-L278 HydrophobicContact CD1-CD2 3.74Å; L229-L278 HydrophobicContact CD1-CD1 4.03Å; G274-L278 WeakPolarHBondContact O-CG 3.31Å; G274-L278 PolarHBondContact O-N 2.88Å; L275-L278 PolarHBondContact O-N 3Å; Y276-L278 VanDerWaalsContact C-N 3.34Å; Y276-L278 PolarHBondContact O-N 3.41Å; L278-N280 PolarHBondContact O-N 3.44Å; L278-N280 VanDerWaalsContact O-N 3.15Å; L278-S281 PolarHBondContact O-N 2.88Å; L278-G284 VanDerWaalsContact O-CA 3.27Å; L278-G284 WeakPolarHBondContact O-CA 3.46Å; L278-M287 HydrophobicContact CD1-CE 3.93Å; L278-M287 HydrophobicContact CD2-CE 4.09Å; L278-L288 HydrophobicContact CB-CD1 3.89Å; L278-L288 HydrophobicContact CB-CG 4.49Å; L278-L288 HydrophobicContact CD1-CD2 4.1Å
279C98.6Very high98.5Very high0 Ų020.2 Ų20.20%010%0.103CC..THydrogen-bonded Turntrans-67.7-11176.7-600000113.8L275 Y276 Q277 S281 R285 L319L275-C279 PolarHBondContact O-N 2.99Å; L275-C279 PolarHBondContact O-SG 3.17Å; Y276-C279 VanDerWaalsContact O-CB 3.25Å; Y276-C279 WeakPolarHBondContact O-CB 3.46Å; Y276-C279 PolarHBondContact O-N 3.05Å; Q277-C279 PolarHBondContact O-N 3.35Å; C279-S281 PolarHBondContact O-N 2.99Å; C279-R285 HydrophobicContact CB-CG 3.98Å; C279-R285 WeakPolarHBondContact O-CD 3.21Å; C279-R285 VanDerWaalsContact O-CG 3.23Å; C279-R285 WeakPolarHBondContact O-CG 3.44Å; C279-R285 PolarHBondContact O-NH1 3.39Å; C279-L319 HydrophobicContact CB-CB 4.04Å; C279-L319 HydrophobicContact CB-CD1 3.54Å; C279-L319 HydrophobicContact CB-CG 4.43Å
280N98.2Very high98.5Very high14 Ų1422.4 Ų22.48%0.07512%0.12CC..THydrogen-bonded Turntrans-65.8-20.1177.7-167.630.3000113P212 Q277 L278 I331 L332 T333P212-N280 HydrophobicContact CB-CB 4.46Å; P212-N280 WeakPolarHBondContact CG-ND2 3.38Å; Q277-N280 WeakPolarHBondContact O-CB 3.49Å; Q277-N280 PolarHBondContact O-N 3.44Å; L278-N280 PolarHBondContact O-N 3.44Å; L278-N280 VanDerWaalsContact O-N 3.15Å; N280-I331 CarbonylContact O-C 3.25Å; N280-I331 VanDerWaalsContact O-CA 3.26Å; N280-I331 WeakPolarHBondContact O-CA 3.37Å; N280-L332 PolarHBondContact O-N 3.13Å; N280-L332 WeakPolarHBondContact OD1-CB 2.95Å; N280-L332 PolarHBondContact OD1-N 2.98Å; N280-T333 PolarHBondContact ND2-OG1 3.42Å; N280-T333 WeakPolarHBondContact OD1-CG2 3.46Å; N280-T333 PolarHBondContact OD1-N 3.24Å; N280-T333 VanDerWaalsContact OD1-N 3.09Å; N280-T333 PolarHBondContact OD1-OG1 3.3Å
281S98.4Very high98.4Very high3 Ų322 Ų222%0.02112%0.117CC..BIsolated β-bridgetrans-118.9153.3173.980.80000113.7H215 L278 C279 A283 G284 R285 D330H215-S281 VanDerWaalsContact CB-OG 3.28Å; H215-S281 WeakPolarHBondContact CB-OG 3.43Å; H215-S281 PolarHBondContact ND1-OG 3.3Å; L278-S281 PolarHBondContact O-N 2.88Å; C279-S281 PolarHBondContact O-N 2.99Å; S281-A283 VanDerWaalsContact C-N 3.27Å; S281-A283 PolarHBondContact O-N 3.43Å; S281-G284 PolarHBondContact O-N 2.82Å; S281-G284 VanDerWaalsContact O-N 3.13Å; S281-G284 PolarHBondContact OG-N 3.37Å; S281-R285 PolarHBondContact O-N 3.48Å; S281-D330 CarbonylContact C-O 3.54Å; S281-D330 WeakPolarHBondContact CA-O 3.12Å
282S98.3Very high98.4Very high34 Ų3422 Ų2224%0.23812%0.118CC..Hα-helixtrans-58-40.2175.369.20000112.2G284 R285 T286 E324 D330S282-G284 VanDerWaalsContact C-N 3.34Å; S282-G284 PolarHBondContact O-N 2.85Å; S282-R285 PolarHBondContact O-N 3.45Å; S282-T286 VanDerWaalsContact O-CB 3.25Å; S282-T286 WeakPolarHBondContact O-CB 3.43Å; S282-T286 PolarHBondContact O-N 3.03Å; S282-T286 PolarHBondContact O-OG1 2.93Å; S282-E324 WeakPolarHBondContact CA-OE2 3.35Å; S282-E324 WeakPolarHBondContact CB-OE2 3.37Å; S282-D330 VanDerWaalsContact CB-OD1 3.28Å; S282-D330 WeakPolarHBondContact CB-OD1 3.19Å; S282-D330 PolarHBondContact N-O 3.35Å; S282-D330 PolarHBondContact OG-OD1 2.91Å
283A98.2Very high98.4Very high18 Ų1822 Ų2215%0.14912%0.118CC..Hα-helixtrans-57.2-47.3174.800000111.4H215 S281 M287H215-A283 HydrophobicContact CB-CB 4.39Å; S281-A283 VanDerWaalsContact C-N 3.27Å; S281-A283 PolarHBondContact O-N 3.43Å; A283-M287 WeakPolarHBondContact O-CB 3.43Å; A283-M287 PolarHBondContact O-N 3.31Å
284G98.6Very high98.4Very high0 Ų021.8 Ų21.80%012%0.115CC..Hα-helixtrans-68.8-45.3179.600000112.6L278 S281 S282 T286 M287 L288L278-G284 VanDerWaalsContact O-CA 3.27Å; L278-G284 WeakPolarHBondContact O-CA 3.46Å; S281-G284 PolarHBondContact O-N 2.82Å; S281-G284 VanDerWaalsContact O-N 3.13Å; S281-G284 PolarHBondContact OG-N 3.37Å; S282-G284 VanDerWaalsContact C-N 3.34Å; S282-G284 PolarHBondContact O-N 2.85Å; G284-T286 PolarHBondContact O-N 3.28Å; G284-M287 WeakPolarHBondContact O-CB 3.11Å; G284-M287 PolarHBondContact O-N 3.25Å; G284-L288 VanDerWaalsContact O-CG 3.27Å; G284-L288 WeakPolarHBondContact O-CG 3.12Å; G284-L288 PolarHBondContact O-N 2.97Å
285R98.6Very high98.3Very high0 Ų024.4 Ų24.40%013%0.125CC..Hα-helixtrans-59.9-48.1175.7-67.3-174-60.4-959.6112.3C279 S281 S282 M287 L288 R289 E324 I327 C329C279-R285 HydrophobicContact CB-CG 3.98Å; C279-R285 WeakPolarHBondContact O-CD 3.21Å; C279-R285 VanDerWaalsContact O-CG 3.23Å; C279-R285 WeakPolarHBondContact O-CG 3.44Å; C279-R285 PolarHBondContact O-NH1 3.39Å; S281-R285 PolarHBondContact O-N 3.48Å; S282-R285 PolarHBondContact O-N 3.45Å; R285-M287 VanDerWaalsContact C-N 3.32Å; R285-M287 PolarHBondContact O-N 3.37Å; R285-L288 PolarHBondContact O-N 3.26Å; R285-R289 WeakPolarHBondContact O-CB 3.27Å; R285-R289 WeakPolarHBondContact O-CG 3.27Å; R285-R289 PolarHBondContact O-N 3.4Å; R285-E324 VanDerWaalsContact CB-OE1 3.31Å; R285-E324 WeakPolarHBondContact CB-OE1 3.34Å; R285-E324 IonicContact CZ-OE1 3.18Å; R285-E324 IonicContact CZ-OE2 3.91Å; R285-E324 IonicContact NE-OE1 2.68Å; R285-E324 PolarHBondContact NE-OE1 3.28Å; R285-E324 IonicContact NE-OE2 3.05Å; R285-E324 PolarHBondContact NE-OE2 2.97Å; R285-E324 IonicContact NH2-OE1 2.72Å; R285-E324 IonicContact NH2-OE2 2.76Å; R285-E324 PolarHBondContact NH2-OE2 2.88Å; R285-I327 VanDerWaalsContact NE-CD1 3.32Å; R285-C329 PolarHBondContact NH2-O 2.98Å
286T98.4Very high98.2Very high72 Ų7224.4 Ų24.444%0.44213%0.125SC..Hα-helixtrans-60.8-43.2178.1-57.70000111.2S282 G284 S290S282-T286 VanDerWaalsContact O-CB 3.25Å; S282-T286 WeakPolarHBondContact O-CB 3.43Å; S282-T286 PolarHBondContact O-N 3.03Å; S282-T286 PolarHBondContact O-OG1 2.93Å; G284-T286 PolarHBondContact O-N 3.28Å; T286-S290 VanDerWaalsContact O-CB 3.31Å; T286-S290 WeakPolarHBondContact O-CB 3.48Å; T286-S290 PolarHBondContact O-N 3.1Å
287M98.3Very high98.2Very high6 Ų621.1 Ų21.13%0.0311%0.113CC..Hα-helixtrans-58.4-51.9174.6179-178.867.700111.6I218 V219 K222 V226 L278 A283 G284 R285 S290 M291I218-M287 HydrophobicContact CB-SD 4.47Å; I218-M287 HydrophobicContact CG2-CE 3.98Å; I218-M287 HydrophobicContact CG2-SD 4Å; V219-M287 HydrophobicContact CB-SD 4.48Å; V219-M287 HydrophobicContact CG2-CB 4.36Å; V219-M287 HydrophobicContact CG2-SD 4.07Å; K222-M287 HydrophobicContact CB-CG 3.78Å; K222-M287 HydrophobicContact CB-SD 3.48Å; K222-M287 WeakPolarHBondContact CB-SD 3.34Å; K222-M287 HydrophobicContact CD-CG 3.69Å; K222-M287 HydrophobicContact CD-SD 4.43Å; K222-M287 HydrophobicContact CG-CG 4.36Å; V226-M287 HydrophobicContact CG2-CE 3.75Å; V226-M287 HydrophobicContact CG2-SD 4.06Å; L278-M287 HydrophobicContact CD1-CE 3.93Å; L278-M287 HydrophobicContact CD2-CE 4.09Å; A283-M287 WeakPolarHBondContact O-CB 3.43Å; A283-M287 PolarHBondContact O-N 3.31Å; G284-M287 WeakPolarHBondContact O-CB 3.11Å; G284-M287 PolarHBondContact O-N 3.25Å; R285-M287 VanDerWaalsContact C-N 3.32Å; R285-M287 PolarHBondContact O-N 3.37Å; M287-S290 PolarHBondContact O-N 3Å; M287-S290 PolarHBondContact O-OG 2.75Å; M287-M291 WeakPolarHBondContact O-CG 3.46Å; M287-M291 PolarHBondContact O-N 3.32Å
288L98.7Very high98.2Very high0 Ų021.4 Ų21.40%011%0.112CC..Hα-helixtrans-65-41.6-178.4-65.6178.2000112.5V226 L275 L278 G284 R285 S290 M291 G292 V293 L320V226-L288 HydrophobicContact CG1-CD2 3.7Å; V226-L288 HydrophobicContact CG2-CD2 4.27Å; L275-L288 HydrophobicContact CD2-CD2 3.85Å; L278-L288 HydrophobicContact CB-CD1 3.89Å; L278-L288 HydrophobicContact CB-CG 4.49Å; L278-L288 HydrophobicContact CD1-CD2 4.1Å; G284-L288 VanDerWaalsContact O-CG 3.27Å; G284-L288 WeakPolarHBondContact O-CG 3.12Å; G284-L288 PolarHBondContact O-N 2.97Å; R285-L288 PolarHBondContact O-N 3.26Å; L288-S290 VanDerWaalsContact C-N 3.34Å; L288-S290 PolarHBondContact O-N 3.12Å; L288-M291 PolarHBondContact O-N 3.24Å; L288-G292 PolarHBondContact O-N 2.62Å; L288-V293 HydrophobicContact CB-CB 4.18Å; L288-V293 HydrophobicContact CB-CG2 4.08Å; L288-V293 HydrophobicContact CD2-CG2 3.89Å; L288-V293 WeakPolarHBondContact O-CB 3.44Å; L288-V293 VanDerWaalsContact O-CG2 3.29Å; L288-V293 WeakPolarHBondContact O-CG2 3.45Å; L288-V293 PolarHBondContact O-N 3.28Å; L288-L320 HydrophobicContact CB-CD2 3.66Å; L288-L320 HydrophobicContact CD1-CD2 4.07Å
289R98.3Very high98.1Very high64 Ų6421.7 Ų21.724%0.24211%0.113CC..Hα-helixtrans-59.9-44.5172.9-70.9-169.5-145.695.7-0.3111.3R285 M291 G292 L320 Q322 E324R285-R289 WeakPolarHBondContact O-CB 3.27Å; R285-R289 WeakPolarHBondContact O-CG 3.27Å; R285-R289 PolarHBondContact O-N 3.4Å; R289-M291 PolarHBondContact O-N 2.85Å; R289-M291 VanDerWaalsContact O-N 3.1Å; R289-G292 PolarHBondContact O-N 3.44Å; R289-L320 WeakPolarHBondContact CD-O 3.46Å; R289-L320 HydrophobicContact CG-CD2 4.28Å; R289-L320 PolarHBondContact NE-O 3Å; R289-Q322 PolarHBondContact NE-O 2.91Å; R289-Q322 PolarHBondContact NH2-O 3.5Å; R289-E324 IonicContact CZ-OE1 3.17Å; R289-E324 IonicContact NH1-OE1 3.05Å; R289-E324 PolarHBondContact NH1-OE1 3.27Å; R289-E324 IonicContact NH2-OE1 3.14Å; R289-E324 PolarHBondContact NH2-OE1 3.12Å
290S97.2Very high98Very high67 Ų6721.7 Ų21.747%0.46911%0.113SC..Hα-helixtrans-62.3-18.7-17978.40000114.3K222 T286 M287 L288K222-S290 PolarHBondContact NZ-OG 3Å; T286-S290 VanDerWaalsContact O-CB 3.31Å; T286-S290 WeakPolarHBondContact O-CB 3.48Å; T286-S290 PolarHBondContact O-N 3.1Å; M287-S290 PolarHBondContact O-N 3Å; M287-S290 PolarHBondContact O-OG 2.75Å; L288-S290 VanDerWaalsContact C-N 3.34Å; L288-S290 PolarHBondContact O-N 3.12Å
291M97.9Very high98Very high2 Ų223.8 Ų23.81%0.0112%0.122CC..THydrogen-bonded Turntrans-101.1-1.2178.6-61.1-179.579.500112.7K222 V226 C248 W251 M287 L288 R289 V293K222-M291 HydrophobicContact CB-SD 3.87Å; K222-M291 HydrophobicContact CD-CG 4.15Å; K222-M291 HydrophobicContact CD-SD 3.77Å; K222-M291 HydrophobicContact CG-CE 4.25Å; K222-M291 HydrophobicContact CG-SD 3.76Å; V226-M291 HydrophobicContact CB-CE 4.06Å; V226-M291 HydrophobicContact CB-SD 3.75Å; V226-M291 HydrophobicContact CG1-CE 4.3Å; V226-M291 HydrophobicContact CG1-SD 3.81Å; V226-M291 HydrophobicContact CG2-SD 4.06Å; C248-M291 HydrophobicContact CB-CB 4.41Å; C248-M291 PolarHBondContact N-O 2.97Å; C248-M291 VanDerWaalsContact N-O 3.11Å; W251-M291 HydrophobicContact CH2-CB 3.66Å; W251-M291 HydrophobicContact CH2-CE 4Å; W251-M291 HydrophobicContact CH2-SD 4.42Å; W251-M291 HydrophobicContact CZ2-CB 4.42Å; W251-M291 HydrophobicContact CZ2-CE 3.6Å; W251-M291 HydrophobicContact CZ3-CB 4.08Å; W251-M291 WeakPolarHBondContact CZ3-O 3.39Å; M287-M291 WeakPolarHBondContact O-CG 3.46Å; M287-M291 PolarHBondContact O-N 3.32Å; L288-M291 PolarHBondContact O-N 3.24Å; R289-M291 PolarHBondContact O-N 2.85Å; R289-M291 VanDerWaalsContact O-N 3.1Å; M291-V293 HydrophobicContact CB-CG2 4.23Å
292G97.7Very high97.9Very high2 Ų229.6 Ų29.62%0.02115%0.147CC..THydrogen-bonded Turntrans73.724.1-179.100000114.5Q246 L288 R289 Y294 Y295Q246-G292 WeakPolarHBondContact O-CA 3.45Å; Q246-G292 PolarHBondContact O-N 2.91Å; L288-G292 PolarHBondContact O-N 2.62Å; R289-G292 PolarHBondContact O-N 3.44Å; G292-Y294 PolarHBondContact O-N 2.73Å; G292-Y295 PolarHBondContact O-N 2.8Å; G292-Y295 VanDerWaalsContact O-N 3.1Å
293V98.4Very high97.9Very high0 Ų033.4 Ų33.40%016%0.156CC..Hα-helixtrans-56.1-37.1-177.71740000112.3V226 V230 W251 L275 L288 M291 Y295 I296 L297 L320V226-V293 HydrophobicContact CG1-CG2 4.17Å; V230-V293 HydrophobicContact CG2-CG1 4.32Å; V230-V293 HydrophobicContact CG2-CG2 4.04Å; W251-V293 HydrophobicContact CH2-CG2 3.55Å; W251-V293 HydrophobicContact CZ3-CG2 3.76Å; L275-V293 HydrophobicContact CD1-CG1 4.29Å; L288-V293 HydrophobicContact CB-CB 4.18Å; L288-V293 HydrophobicContact CB-CG2 4.08Å; L288-V293 HydrophobicContact CD2-CG2 3.89Å; L288-V293 WeakPolarHBondContact O-CB 3.44Å; L288-V293 VanDerWaalsContact O-CG2 3.29Å; L288-V293 WeakPolarHBondContact O-CG2 3.45Å; L288-V293 PolarHBondContact O-N 3.28Å; M291-V293 HydrophobicContact CB-CG2 4.23Å; V293-Y295 VanDerWaalsContact C-N 3.27Å; V293-Y295 PolarHBondContact O-N 2.77Å; V293-I296 PolarHBondContact O-N 3.25Å; V293-L297 HydrophobicContact CG1-CD1 3.87Å; V293-L297 HydrophobicContact CG1-CG 4.02Å; V293-L297 PolarHBondContact O-N 3.08Å; V293-L320 HydrophobicContact CB-CD1 4.26Å; V293-L320 HydrophobicContact CG1-CD1 3.94Å
294Y98.2Very high97.8Very high62 Ų6232.9 Ų32.924%0.24315%0.151CC..Hα-helixtrans-49.7-47.1176.1163.2-110.6000112.5G292 I296 L297 R298 V317 I321G292-Y294 PolarHBondContact O-N 2.73Å; Y294-I296 PolarHBondContact O-N 3.33Å; Y294-L297 PolarHBondContact O-N 3.36Å; Y294-R298 WeakPolarHBondContact O-CB 3.37Å; Y294-R298 PolarHBondContact O-N 3.33Å; Y294-V317 HydrophobicContact CD2-CG1 3.81Å; Y294-V317 HydrophobicContact CD2-CG2 4.44Å; Y294-V317 HydrophobicContact CE2-CG1 3.6Å; Y294-I321 HydrophobicContact CD2-CD1 4.41Å; Y294-I321 HydrophobicContact CD2-CG1 3.84Å; Y294-I321 HydrophobicContact CE2-CD1 3.69Å; Y294-I321 HydrophobicContact CE2-CG1 3.5Å
295Y97.3Very high97.8Very high54 Ų5439 Ų3921%0.21219%0.188CC..Hα-helixtrans-66.2-40.6-176.2-57.5-68.4000111.5F239 E243 Q246 I247 G292 V293 R298 E299F239-Y295 WeakPolarHBondContact CE1-O 3.46Å; E243-Y295 HydrophobicContact CB-CD1 3.98Å; E243-Y295 HydrophobicContact CB-CE1 4.14Å; E243-Y295 HydrophobicContact CB-CG 4.32Å; E243-Y295 HydrophobicContact CG-CD1 3.7Å; E243-Y295 HydrophobicContact CG-CE1 3.56Å; Q246-Y295 HydrophobicContact CB-CD2 4.21Å; Q246-Y295 HydrophobicContact CB-CE2 3.48Å; Q246-Y295 VanDerWaalsContact CB-CE2 3.48Å; Q246-Y295 HydrophobicContact CG-CE2 4.17Å; I247-Y295 HydrophobicContact CG1-CD2 4.01Å; I247-Y295 HydrophobicContact CG1-CG 4.36Å; G292-Y295 PolarHBondContact O-N 2.8Å; G292-Y295 VanDerWaalsContact O-N 3.1Å; V293-Y295 VanDerWaalsContact C-N 3.27Å; V293-Y295 PolarHBondContact O-N 2.77Å; Y295-R298 PolarHBondContact O-N 2.96Å; Y295-E299 PolarHBondContact O-N 2.83Å
296I97.7Very high97.8Very high1 Ų141.5 Ų41.51%0.00520%0.202CC..Hα-helixtrans-63.1-47.3176.2-56-59.7000110.6V230 F233 I234 F239 I247 W251 L255 V293 Y294 R298 E299 Y300V230-I296 HydrophobicContact CG1-CB 4.23Å; V230-I296 HydrophobicContact CG1-CG1 4.21Å; V230-I296 HydrophobicContact CG1-CG2 3.81Å; F233-I296 HydrophobicContact CB-CG2 3.96Å; I234-I296 HydrophobicContact CG1-CG2 4.13Å; F239-I296 HydrophobicContact CE1-CD1 4.2Å; F239-I296 HydrophobicContact CZ-CD1 4.07Å; I247-I296 HydrophobicContact CD1-CD1 4.06Å; I247-I296 HydrophobicContact CG2-CD1 4.27Å; W251-I296 HydrophobicContact CE3-CG1 3.95Å; W251-I296 HydrophobicContact CZ3-CG1 4.34Å; L255-I296 HydrophobicContact CD1-CD1 4.16Å; L255-I296 HydrophobicContact CD2-CD1 4.21Å; V293-I296 PolarHBondContact O-N 3.25Å; Y294-I296 PolarHBondContact O-N 3.33Å; I296-R298 VanDerWaalsContact C-N 3.32Å; I296-R298 PolarHBondContact O-N 3.1Å; I296-E299 PolarHBondContact O-N 2.98Å; I296-Y300 WeakPolarHBondContact O-CB 3.33Å; I296-Y300 PolarHBondContact O-N 2.92Å
297L98.5Very high97.7Very high0 Ų044.5 Ų44.50%021%0.209CC..Hα-helixtrans-66.6-32.5-179.6-69.5-173.5000112.8F233 L272 L275 V293 Y294 Y300 H301 C313 T316 V317 L320F233-L297 HydrophobicContact CB-CD2 4.36Å; F233-L297 HydrophobicContact CD2-CD2 3.76Å; F233-L297 HydrophobicContact CE2-CD2 4.26Å; F233-L297 HydrophobicContact CG-CD2 3.98Å; L272-L297 HydrophobicContact CD1-CD1 4.27Å; L272-L297 HydrophobicContact CD1-CD2 3.88Å; L275-L297 HydrophobicContact CD1-CD1 4.23Å; L275-L297 HydrophobicContact CD1-CD2 4.1Å; V293-L297 HydrophobicContact CG1-CD1 3.87Å; V293-L297 HydrophobicContact CG1-CG 4.02Å; V293-L297 PolarHBondContact O-N 3.08Å; Y294-L297 PolarHBondContact O-N 3.36Å; L297-Y300 HydrophobicContact CD2-CD1 4.18Å; L297-Y300 PolarHBondContact O-N 3.09Å; L297-H301 VanDerWaalsContact O-CB 3.29Å; L297-H301 WeakPolarHBondContact O-CB 3.48Å; L297-H301 PolarHBondContact O-N 3Å; L297-C313 PolarHBondContact O-SG 3.21Å; L297-T316 HydrophobicContact CD1-CG2 3.61Å; L297-V317 HydrophobicContact CB-CG2 3.75Å; L297-L320 HydrophobicContact CD1-CD1 4.28Å
298R97.2Very high97.7Very high50 Ų5049.2 Ų49.219%0.18923%0.234CC..Hα-helixtrans-61.2-48.5174.2-175.6-168.671.7-1621.8111.9D238 E243 Y294 Y295 I296 H301 K302D238-R298 PolarHBondContact O-NH2 3.42Å; E243-R298 VanDerWaalsContact CD-NH2 3.35Å; E243-R298 IonicContact OE1-CZ 3.37Å; E243-R298 IonicContact OE1-NH1 2.65Å; E243-R298 PolarHBondContact OE1-NH1 3.22Å; E243-R298 IonicContact OE1-NH2 3.22Å; E243-R298 PolarHBondContact OE1-NH2 3.07Å; E243-R298 IonicContact OE2-CZ 3.89Å; E243-R298 IonicContact OE2-NH1 3.88Å; E243-R298 IonicContact OE2-NH2 2.99Å; E243-R298 PolarHBondContact OE2-NH2 3.29Å; Y294-R298 WeakPolarHBondContact O-CB 3.37Å; Y294-R298 PolarHBondContact O-N 3.33Å; Y295-R298 PolarHBondContact O-N 2.96Å; I296-R298 VanDerWaalsContact C-N 3.32Å; I296-R298 PolarHBondContact O-N 3.1Å; R298-H301 PolarHBondContact O-N 3.13Å; R298-K302 PolarHBondContact O-N 3.32Å
299E96.5Very high97.7Very high7 Ų749.2 Ų49.23%0.03323%0.234CC..Hα-helixtrans-70-36.1178.3-61.8-48.7118.900111.6D238 F239 Y295 I296 K302 W303D238-E299 PolarHBondContact N-OE2 3.14Å; D238-E299 VanDerWaalsContact N-OE2 3.12Å; F239-E299 HydrophobicContact CD1-CG 4.28Å; F239-E299 HydrophobicContact CE1-CB 4.48Å; F239-E299 HydrophobicContact CE1-CG 3.63Å; F239-E299 HydrophobicContact CE2-CG 3.97Å; F239-E299 HydrophobicContact CZ-CB 3.97Å; F239-E299 HydrophobicContact CZ-CG 3.45Å; F239-E299 VanDerWaalsContact CZ-CG 3.45Å; Y295-E299 PolarHBondContact O-N 2.83Å; I296-E299 PolarHBondContact O-N 2.98Å; E299-K302 PolarHBondContact O-N 3.09Å; E299-K302 WeakPolarHBondContact OE1-CE 3.39Å; E299-K302 IonicContact OE1-NZ 2.73Å; E299-K302 PolarHBondContact OE1-NZ 3.32Å; E299-K302 IonicContact OE2-NZ 2.83Å; E299-K302 PolarHBondContact OE2-NZ 2.93Å; E299-W303 PolarHBondContact O-N 3.49Å
300Y97.9Very high97.7Very high0 Ų051.1 Ų51.10%024%0.241CC..Hα-helixtrans-60.3-44.4171.3166.6-112.7000112.6F233 R268 L272 I296 L297 K302 W303 E304 C313F233-Y300 HydrophobicContact CB-CD1 4.46Å; F233-Y300 HydrophobicContact CB-CD2 4.27Å; F233-Y300 HydrophobicContact CB-CG 3.97Å; F233-Y300 AromaticContact CD1-CD1 3.75Å; F233-Y300 HydrophobicContact CD1-CD1 3.75Å; F233-Y300 AromaticContact CD1-CD2 3.79Å; F233-Y300 HydrophobicContact CD1-CD2 3.79Å; F233-Y300 AromaticContact CD1-CE1 3.66Å; F233-Y300 HydrophobicContact CD1-CE1 3.66Å; F233-Y300 AromaticContact CD1-CE2 3.71Å; F233-Y300 HydrophobicContact CD1-CE2 3.71Å; F233-Y300 AromaticContact CD1-CG 3.79Å; F233-Y300 HydrophobicContact CD1-CG 3.79Å; F233-Y300 AromaticContact CD1-CZ 3.61Å; F233-Y300 HydrophobicContact CE1-CD1 4.37Å; F233-Y300 AromaticContact CE1-CE1 3.88Å; F233-Y300 HydrophobicContact CE1-CE1 3.88Å; F233-Y300 HydrophobicContact CE1-CE2 4.28Å; F233-Y300 AromaticContact CE1-CZ 3.8Å; F233-Y300 HydrophobicContact CG-CD1 4.26Å; F233-Y300 HydrophobicContact CG-CD2 4.48Å; F233-Y300 HydrophobicContact CG-CG 4.19Å; R268-Y300 PolarHBondContact NE-OH 3.19Å; L272-Y300 HydrophobicContact CD2-CE1 4.12Å; I296-Y300 WeakPolarHBondContact O-CB 3.33Å; I296-Y300 PolarHBondContact O-N 2.92Å; L297-Y300 HydrophobicContact CD2-CD1 4.18Å; L297-Y300 PolarHBondContact O-N 3.09Å; Y300-K302 VanDerWaalsContact C-N 3.26Å; Y300-K302 PolarHBondContact O-N 3.31Å; Y300-W303 HydrophobicContact CD2-CE3 4.08Å; Y300-W303 HydrophobicContact CE2-CE3 4.06Å; Y300-W303 HydrophobicContact CE2-CZ3 4.12Å; Y300-W303 PolarHBondContact O-N 3.1Å; Y300-E304 HydrophobicContact CE2-CB 4.06Å; Y300-E304 HydrophobicContact CE2-CG 4.39Å; Y300-E304 WeakPolarHBondContact CE2-OE2 3.31Å; Y300-E304 PolarHBondContact O-N 3.36Å; Y300-E304 PolarHBondContact OH-OE2 2.82Å; Y300-C313 HydrophobicContact CD1-CB 4.38Å; Y300-C313 HydrophobicContact CE1-CB 4.18Å
301H97.9Very high97.7Very high58 Ų5850.6 Ų50.627%0.26923%0.233SC..Hα-helixtrans-58.1-36.3178.4176.4-88000112.6L297 R298 W303 R310L297-H301 VanDerWaalsContact O-CB 3.29Å; L297-H301 WeakPolarHBondContact O-CB 3.48Å; L297-H301 PolarHBondContact O-N 3Å; R298-H301 PolarHBondContact O-N 3.13Å; H301-W303 VanDerWaalsContact C-N 3.33Å; H301-R310 WeakPolarHBondContact CD2-CG 3.09Å; H301-R310 WeakPolarHBondContact NE2-CG 3.33Å
302K97Very high97.8Very high125 Ų12550.9 Ų50.954%0.54324%0.235SC..Hα-helixtrans-67.4-33.5175.3-63.9172.8-173.21700112.7R298 E299 Y300R298-K302 PolarHBondContact O-N 3.32Å; E299-K302 PolarHBondContact O-N 3.09Å; E299-K302 WeakPolarHBondContact OE1-CE 3.39Å; E299-K302 IonicContact OE1-NZ 2.73Å; E299-K302 PolarHBondContact OE1-NZ 3.32Å; E299-K302 IonicContact OE2-NZ 2.83Å; E299-K302 PolarHBondContact OE2-NZ 2.93Å; Y300-K302 VanDerWaalsContact C-N 3.26Å; Y300-K302 PolarHBondContact O-N 3.31Å
303W96.8Very high97.8Very high113 Ų11350.8 Ų50.843%0.42823%0.234SC..Hα-helixtrans-83-33.2-177.6175.589.8000112.7R261 E299 Y300 H301R261-W303 HydrophobicContact CB-CH2 4.08Å; R261-W303 HydrophobicContact CB-CZ2 4.2Å; R261-W303 HydrophobicContact CB-CZ3 4.25Å; R261-W303 VanDerWaalsContact CD-CD2 3.5Å; E299-W303 PolarHBondContact O-N 3.49Å; Y300-W303 HydrophobicContact CD2-CE3 4.08Å; Y300-W303 HydrophobicContact CE2-CE3 4.06Å; Y300-W303 HydrophobicContact CE2-CZ3 4.12Å; Y300-W303 PolarHBondContact O-N 3.1Å; H301-W303 VanDerWaalsContact C-N 3.33Å
304E97.7Very high97.8Very high7 Ų756.5 Ų56.53%0.03326%0.26CS..  trans-67.6137.2-174.2-176.255.5-98.800112.9R268 Y300 N306 A309 R310R268-E304 IonicContact CZ-OE2 3.92Å; R268-E304 IonicContact NE-OE2 3.32Å; R268-E304 PolarHBondContact NE-OE2 3.01Å; R268-E304 VanDerWaalsContact NH2-CD 3.34Å; R268-E304 IonicContact NH2-OE1 3.81Å; R268-E304 PolarHBondContact NH2-OE1 2.83Å; R268-E304 IonicContact NH2-OE2 2.81Å; R268-E304 PolarHBondContact NH2-OE2 3.29Å; Y300-E304 HydrophobicContact CE2-CB 4.06Å; Y300-E304 HydrophobicContact CE2-CG 4.39Å; Y300-E304 WeakPolarHBondContact CE2-OE2 3.31Å; Y300-E304 PolarHBondContact O-N 3.36Å; Y300-E304 PolarHBondContact OH-OE2 2.82Å; E304-N306 WeakPolarHBondContact OE1-CB 3.2Å; E304-N306 PolarHBondContact OE1-N 3.35Å; E304-A309 HydrophobicContact CG-CB 3.78Å; E304-R310 HydrophobicContact CG-CB 4.32Å
305T97.3Very high97.8Very high129 Ų12960.1 Ų60.179%0.79127%0.274SS*.  trans-114.8-24.2-178.757.90000112.8K307T305-K307 PolarHBondContact O-N 2.88Å
306N98.2Very high97.9Very high53 Ų5357.6 Ų57.628%0.28326%0.264SS..  trans-67.5125.4172.5179.4-76.3000109.6C265 E304 D308 A309 R310C265-N306 VanDerWaalsContact SG-CB 3.55Å; E304-N306 WeakPolarHBondContact OE1-CB 3.2Å; E304-N306 PolarHBondContact OE1-N 3.35Å; N306-D308 PolarHBondContact OD1-N 2.76Å; N306-A309 HydrophobicContact CB-CB 4.11Å; N306-A309 PolarHBondContact OD1-N 2.7Å; N306-R310 WeakPolarHBondContact O-CB 3.36Å; N306-R310 PolarHBondContact O-N 3.47Å
307K97.9Very high97.9Very high135 Ų13558.5 Ų58.559%0.58727%0.269SS*.Hα-helixtrans-61.1-47.9-175.9178.5176.1174.3170.10112.2T305 A309 R310 D311T305-K307 PolarHBondContact O-N 2.88Å; K307-A309 VanDerWaalsContact C-N 3.34Å; K307-A309 PolarHBondContact O-N 2.85Å; K307-R310 PolarHBondContact O-N 3.29Å; K307-D311 VanDerWaalsContact CE-OD2 3.26Å; K307-D311 WeakPolarHBondContact CE-OD2 3.3Å; K307-D311 WeakPolarHBondContact O-CB 3.43Å; K307-D311 VanDerWaalsContact O-CG 3.23Å; K307-D311 PolarHBondContact O-N 2.93Å
308D97.6Very high97.9Very high104 Ų10460 Ų6056%0.55628%0.284SS*.Hα-helixtrans-66.1-40.5-174.4-57.9-35.2000111.1N306 R310 L312N306-D308 PolarHBondContact OD1-N 2.76Å; D308-R310 VanDerWaalsContact C-N 3.34Å; D308-R310 PolarHBondContact O-N 2.92Å; D308-L312 WeakPolarHBondContact O-CB 3.33Å; D308-L312 PolarHBondContact O-N 2.87Å
309A98.3Very high97.9Very high0 Ų058.9 Ų58.90%028%0.282CS..Hα-helixtrans-64.4-39.3174.900000112L269 L272 E304 N306 K307 C313L269-A309 HydrophobicContact CD2-CB 3.84Å; L269-A309 HydrophobicContact CG-CB 4.25Å; L272-A309 VanDerWaalsContact CD2-O 3.23Å; L272-A309 WeakPolarHBondContact CD2-O 3.3Å; E304-A309 HydrophobicContact CG-CB 3.78Å; N306-A309 HydrophobicContact CB-CB 4.11Å; N306-A309 PolarHBondContact OD1-N 2.7Å; K307-A309 VanDerWaalsContact C-N 3.34Å; K307-A309 PolarHBondContact O-N 2.85Å; A309-C313 VanDerWaalsContact O-CB 3.28Å; A309-C313 WeakPolarHBondContact O-CB 3.29Å; A309-C313 PolarHBondContact O-N 3.34Å
310R98Very high98Very high105 Ų10558.8 Ų58.840%0.39628%0.282SS..Hα-helixtrans-68.8-46.7177.8-166.9178.467.8-170.51.1112.1H301 E304 N306 K307 D308 L312 C313 E314H301-R310 WeakPolarHBondContact CD2-CG 3.09Å; H301-R310 WeakPolarHBondContact NE2-CG 3.33Å; E304-R310 HydrophobicContact CG-CB 4.32Å; N306-R310 WeakPolarHBondContact O-CB 3.36Å; N306-R310 PolarHBondContact O-N 3.47Å; K307-R310 PolarHBondContact O-N 3.29Å; D308-R310 VanDerWaalsContact C-N 3.34Å; D308-R310 PolarHBondContact O-N 2.92Å; R310-L312 VanDerWaalsContact C-N 3.32Å; R310-L312 PolarHBondContact O-N 3.23Å; R310-C313 WeakPolarHBondContact O-CB 3.41Å; R310-C313 PolarHBondContact O-N 3.07Å; R310-C313 VanDerWaalsContact O-N 3.09Å; R310-E314 PolarHBondContact O-N 3.45Å
311D98.4Very high97.9Very high55 Ų5563.7 Ų63.729%0.29431%0.307SS..Hα-helixtrans-64.2-37.6179.2-66.9-1.5000111K307 R315K307-D311 VanDerWaalsContact CE-OD2 3.26Å; K307-D311 WeakPolarHBondContact CE-OD2 3.3Å; K307-D311 WeakPolarHBondContact O-CB 3.43Å; K307-D311 VanDerWaalsContact O-CG 3.23Å; K307-D311 PolarHBondContact O-N 2.93Å; D311-R315 WeakPolarHBondContact O-CG 3.47Å; D311-R315 PolarHBondContact O-N 2.96Å
312L98.7Very high97.8Very high9 Ų964.4 Ų64.45%0.04731%0.31CS..Hα-helixtrans-66.9-40.4171.5-177.861.5000111.9L269 L272 E273 Y276 D308 R310 R315 T316L269-L312 HydrophobicContact CD2-CD2 4.47Å; L272-L312 HydrophobicContact CB-CD2 4.07Å; L272-L312 HydrophobicContact CD2-CB 3.96Å; L272-L312 HydrophobicContact CD2-CD2 3.95Å; L272-L312 HydrophobicContact CD2-CG 3.88Å; L272-L312 HydrophobicContact CG-CD2 3.85Å; L272-L312 HydrophobicContact CG-CG 3.88Å; E273-L312 HydrophobicContact CB-CD2 4.39Å; E273-L312 HydrophobicContact CG-CD2 3.58Å; Y276-L312 HydrophobicContact CD1-CD1 4.05Å; Y276-L312 HydrophobicContact CD2-CD1 4.16Å; Y276-L312 HydrophobicContact CG-CD1 3.77Å; D308-L312 WeakPolarHBondContact O-CB 3.33Å; D308-L312 PolarHBondContact O-N 2.87Å; R310-L312 VanDerWaalsContact C-N 3.32Å; R310-L312 PolarHBondContact O-N 3.23Å; L312-R315 PolarHBondContact O-N 3.21Å; L312-T316 PolarHBondContact O-N 2.83Å; L312-T316 PolarHBondContact O-OG1 3.41Å
313C98.7Very high97.7Very high0 Ų061.2 Ų61.20%030%0.302CS..Hα-helixtrans-62.8-44178.1-171.10000111.4L272 L297 Y300 A309 R310 R315 T316 V317L272-C313 HydrophobicContact CD1-CB 4.44Å; L272-C313 HydrophobicContact CD2-CB 3.87Å; L297-C313 PolarHBondContact O-SG 3.21Å; Y300-C313 HydrophobicContact CD1-CB 4.38Å; Y300-C313 HydrophobicContact CE1-CB 4.18Å; A309-C313 VanDerWaalsContact O-CB 3.28Å; A309-C313 WeakPolarHBondContact O-CB 3.29Å; A309-C313 PolarHBondContact O-N 3.34Å; R310-C313 WeakPolarHBondContact O-CB 3.41Å; R310-C313 PolarHBondContact O-N 3.07Å; R310-C313 VanDerWaalsContact O-N 3.09Å; C313-R315 VanDerWaalsContact C-N 3.34Å; C313-R315 PolarHBondContact O-N 3.43Å; C313-T316 PolarHBondContact O-N 3.47Å; C313-V317 WeakPolarHBondContact O-CB 3.36Å; C313-V317 WeakPolarHBondContact O-CG2 3.22Å; C313-V317 PolarHBondContact O-N 3.22Å
314E98.3Very high97.7Very high120 Ų12057.9 Ų57.956%0.56129%0.29SS*.Hα-helixtrans-58.3-44.8176.7-174.6174-173.400111.7R310 V317 G318R310-E314 PolarHBondContact O-N 3.45Å; E314-V317 PolarHBondContact O-N 3.28Å; E314-G318 PolarHBondContact O-N 3.1Å
315R98Very high97.6Very high138 Ų13864.7 Ų64.752%0.52132%0.323SS..Hα-helixtrans-62-44.6175.3-72-175.9-69.2176.1-0.2112.6Y276 D311 L312 C313 G318 L319Y276-R315 HydrophobicContact CD2-CB 4.34Å; Y276-R315 HydrophobicContact CE2-CB 3.87Å; D311-R315 WeakPolarHBondContact O-CG 3.47Å; D311-R315 PolarHBondContact O-N 2.96Å; L312-R315 PolarHBondContact O-N 3.21Å; C313-R315 VanDerWaalsContact C-N 3.34Å; C313-R315 PolarHBondContact O-N 3.43Å; R315-G318 PolarHBondContact O-N 3.16Å; R315-L319 PolarHBondContact O-N 3.22Å
316T98.6Very high97.5Very high0 Ų064.6 Ų64.60%031%0.313CS..Hα-helixtrans-61.4-47.5176.8-56.20000111L275 Y276 L297 L312 C313 G318 L319 L320L275-T316 HydrophobicContact CB-CG2 4.34Å; Y276-T316 WeakPolarHBondContact CB-OG1 3.31Å; Y276-T316 WeakPolarHBondContact CD2-OG1 3.35Å; L297-T316 HydrophobicContact CD1-CG2 3.61Å; L312-T316 PolarHBondContact O-N 2.83Å; L312-T316 PolarHBondContact O-OG1 3.41Å; C313-T316 PolarHBondContact O-N 3.47Å; T316-G318 VanDerWaalsContact C-N 3.33Å; T316-G318 PolarHBondContact O-N 3.31Å; T316-L319 PolarHBondContact O-N 3.07Å; T316-L320 HydrophobicContact CG2-CD1 4.27Å; T316-L320 WeakPolarHBondContact O-CG 3.45Å; T316-L320 PolarHBondContact O-N 3.15Å; T316-L320 VanDerWaalsContact O-N 3.15Å
317V98.3Very high97.2Very high21 Ų2163.2 Ų63.213%0.12731%0.305CS..Hα-helixtrans-60.9-42.3177163.90000111.3Y294 L297 C313 E314 L319 L320 I321Y294-V317 HydrophobicContact CD2-CG1 3.81Å; Y294-V317 HydrophobicContact CD2-CG2 4.44Å; Y294-V317 HydrophobicContact CE2-CG1 3.6Å; L297-V317 HydrophobicContact CB-CG2 3.75Å; C313-V317 WeakPolarHBondContact O-CB 3.36Å; C313-V317 WeakPolarHBondContact O-CG2 3.22Å; C313-V317 PolarHBondContact O-N 3.22Å; E314-V317 PolarHBondContact O-N 3.28Å; V317-L319 PolarHBondContact O-N 2.98Å; V317-L320 PolarHBondContact O-N 2.95Å; V317-I321 HydrophobicContact CG1-CD1 3.6Å; V317-I321 HydrophobicContact CG1-CG1 4.16Å; V317-I321 WeakPolarHBondContact O-CG1 3.29Å; V317-I321 PolarHBondContact O-N 3.32Å
318G97.6Very high97Very high30 Ų3061.8 Ų61.831%0.30931%0.312SS..Hα-helixtrans-57-36177.200000113.3E314 R315 T316 Q322E314-G318 PolarHBondContact O-N 3.1Å; R315-G318 PolarHBondContact O-N 3.16Å; T316-G318 VanDerWaalsContact C-N 3.33Å; T316-G318 PolarHBondContact O-N 3.31Å; G318-Q322 PolarHBondContact O-NE2 3.48Å
319L97.8Very high96.8Very high28 Ų2857.6 Ų57.615%0.14729%0.291CS..Hα-helixtrans-75.4-33.4174.4-68172.7000112.9Y276 C279 R315 T316 V317 L332Y276-L319 HydrophobicContact CD2-CD1 4.34Å; Y276-L319 HydrophobicContact CE2-CD1 3.92Å; C279-L319 HydrophobicContact CB-CB 4.04Å; C279-L319 HydrophobicContact CB-CD1 3.54Å; C279-L319 HydrophobicContact CB-CG 4.43Å; R315-L319 PolarHBondContact O-N 3.22Å; T316-L319 PolarHBondContact O-N 3.07Å; V317-L319 PolarHBondContact O-N 2.98Å; L319-L332 HydrophobicContact CD1-CD1 4.12Å; L319-L332 HydrophobicContact CD2-CD1 3.86Å
320L98.2Very high96.7Very high5 Ų562.2 Ų62.23%0.02632%0.316CS..Hα-helixtrans-78.2-24-178.1-66.9179.5000113.8L288 R289 V293 L297 T316 V317L288-L320 HydrophobicContact CB-CD2 3.66Å; L288-L320 HydrophobicContact CD1-CD2 4.07Å; R289-L320 WeakPolarHBondContact CD-O 3.46Å; R289-L320 HydrophobicContact CG-CD2 4.28Å; R289-L320 PolarHBondContact NE-O 3Å; V293-L320 HydrophobicContact CB-CD1 4.26Å; V293-L320 HydrophobicContact CG1-CD1 3.94Å; L297-L320 HydrophobicContact CD1-CD1 4.28Å; T316-L320 HydrophobicContact CG2-CD1 4.27Å; T316-L320 WeakPolarHBondContact O-CG 3.45Å; T316-L320 PolarHBondContact O-N 3.15Å; T316-L320 VanDerWaalsContact O-N 3.15Å; V317-L320 PolarHBondContact O-N 2.95Å
321I97.2Very high96.6Very high103 Ų10358.3 Ų58.353%0.52830%0.302SS..Hα-helixtrans-72.5-33.4175.6-69.1167.2000111.4Y294 V317Y294-I321 HydrophobicContact CD2-CD1 4.41Å; Y294-I321 HydrophobicContact CD2-CG1 3.84Å; Y294-I321 HydrophobicContact CE2-CD1 3.69Å; Y294-I321 HydrophobicContact CE2-CG1 3.5Å; V317-I321 HydrophobicContact CG1-CD1 3.6Å; V317-I321 HydrophobicContact CG1-CG1 4.16Å; V317-I321 WeakPolarHBondContact O-CG1 3.29Å; V317-I321 PolarHBondContact O-N 3.32Å
322Q96.2Very high96.5Very high73 Ų7357.6 Ų57.634%0.34130%0.299SS..SBendtrans-75.2148.7-177.6-68.5170.971.700111.9R289 G318 E326 I327R289-Q322 PolarHBondContact NE-O 2.91Å; R289-Q322 PolarHBondContact NH2-O 3.5Å; G318-Q322 PolarHBondContact O-NE2 3.48Å; Q322-E326 WeakPolarHBondContact CA-OE2 3.29Å; Q322-E326 HydrophobicContact CB-CB 4.38Å; Q322-I327 HydrophobicContact CB-CD1 3.93Å; Q322-I327 HydrophobicContact CB-CG1 3.77Å
323T95Very high96.1Very high58 Ų5861.4 Ų61.436%0.35632%0.322SS..  trans-81.1167.3171.284.50000111.9E325 E326 I327T323-E325 VanDerWaalsContact C-N 3.26Å; T323-E325 VanDerWaalsContact CB-OE2 3.22Å; T323-E325 WeakPolarHBondContact CB-OE2 3.37Å; T323-E325 PolarHBondContact O-N 3.44Å; T323-E325 PolarHBondContact OG1-N 2.84Å; T323-E325 PolarHBondContact OG1-OE2 2.78Å; T323-E326 PolarHBondContact N-OE2 3.28Å; T323-E326 PolarHBondContact O-N 3.21Å; T323-E326 PolarHBondContact OG1-N 3.3Å; T323-I327 WeakPolarHBondContact O-CG1 3.4Å; T323-I327 PolarHBondContact O-N 3.41Å; T323-I327 VanDerWaalsContact O-N 3.08Å
324E96Very high95.5Very high42 Ų4263.7 Ų63.720%0.19634%0.338CS..Hα-helixtrans-68.2-29.3175.5-65.5-56131.200112S282 R285 R289 S328S282-E324 WeakPolarHBondContact CA-OE2 3.35Å; S282-E324 WeakPolarHBondContact CB-OE2 3.37Å; R285-E324 VanDerWaalsContact CB-OE1 3.31Å; R285-E324 WeakPolarHBondContact CB-OE1 3.34Å; R285-E324 IonicContact CZ-OE1 3.18Å; R285-E324 IonicContact CZ-OE2 3.91Å; R285-E324 IonicContact NE-OE1 2.68Å; R285-E324 PolarHBondContact NE-OE1 3.28Å; R285-E324 IonicContact NE-OE2 3.05Å; R285-E324 PolarHBondContact NE-OE2 2.97Å; R285-E324 IonicContact NH2-OE1 2.72Å; R285-E324 IonicContact NH2-OE2 2.76Å; R285-E324 PolarHBondContact NH2-OE2 2.88Å; R289-E324 IonicContact CZ-OE1 3.17Å; R289-E324 IonicContact NH1-OE1 3.05Å; R289-E324 PolarHBondContact NH1-OE1 3.27Å; R289-E324 IonicContact NH2-OE1 3.14Å; R289-E324 PolarHBondContact NH2-OE1 3.12Å; E324-S328 WeakPolarHBondContact O-CA 3.49Å; E324-S328 PolarHBondContact O-N 2.67Å
325E94.8Very high94.5Very high151 Ų15159.7 Ų59.771%0.70632%0.323SS*.Hα-helixtrans-67.7-39.2173.6-59.674.9-163.700112T323T323-E325 VanDerWaalsContact C-N 3.26Å; T323-E325 VanDerWaalsContact CB-OE2 3.22Å; T323-E325 WeakPolarHBondContact CB-OE2 3.37Å; T323-E325 PolarHBondContact O-N 3.44Å; T323-E325 PolarHBondContact OG1-N 2.84Å; T323-E325 PolarHBondContact OG1-OE2 2.78Å
326E94.8Very high93.4Very high126 Ų12657 Ų5759%0.58932%0.322SS*.Hα-helixtrans-68.2-42.2176.5-69.2175150.900111.8Q322 T323Q322-E326 WeakPolarHBondContact CA-OE2 3.29Å; Q322-E326 HydrophobicContact CB-CB 4.38Å; T323-E326 PolarHBondContact N-OE2 3.28Å; T323-E326 PolarHBondContact O-N 3.21Å; T323-E326 PolarHBondContact OG1-N 3.3Å
327I93.7Very high91.8Very high24 Ų2460.1 Ų60.112%0.12334%0.344CS..Hα-helixtrans-71.8-36.5178.1-66.6173.3000111.1R285 Q322 T323 C329 L332R285-I327 VanDerWaalsContact NE-CD1 3.32Å; Q322-I327 HydrophobicContact CB-CD1 3.93Å; Q322-I327 HydrophobicContact CB-CG1 3.77Å; T323-I327 WeakPolarHBondContact O-CG1 3.4Å; T323-I327 PolarHBondContact O-N 3.41Å; T323-I327 VanDerWaalsContact O-N 3.08Å; I327-C329 HydrophobicContact CG2-CB 4.18Å; I327-C329 PolarHBondContact O-N 3.01Å; I327-L332 HydrophobicContact CG2-CD2 3.56Å
328S92.8Very high89.9Confident105 Ų10566.1 Ų66.173%0.73437%0.37SS*.  trans51.930175.5-144.50000114.9E324E324-S328 WeakPolarHBondContact O-CA 3.49Å; E324-S328 PolarHBondContact O-N 2.67Å
329C93.6Very high87.7Confident17 Ų1772.4 Ų72.412%0.11539%0.392CS..  trans-148.9127.8-175.71710000109.8R285 I327 I331 L332 C335R285-C329 PolarHBondContact NH2-O 2.98Å; I327-C329 HydrophobicContact CG2-CB 4.18Å; I327-C329 PolarHBondContact O-N 3.01Å; C329-I331 PolarHBondContact SG-O 3.49Å; C329-L332 HydrophobicContact CB-CD2 4.29Å; C329-C335 HydrophobicContact CB-CB 4.03Å; C329-C335 WeakPolarHBondContact CB-SG 3.49Å; C329-C335 WeakPolarHBondContact SG-CB 3.3Å; C329-C335 CovalentContact SG-SG 2.03Å; C329-C335 PolarHBondContact SG-SG 3.35Å
330D95.8Very high85.5Confident96 Ų9677.7 Ų77.751%0.51342%0.42SS..SBendtrans-68.2-60.7177.3-17626.4000110.6S281 S282S281-D330 CarbonylContact C-O 3.54Å; S281-D330 WeakPolarHBondContact CA-O 3.12Å; S282-D330 VanDerWaalsContact CB-OD1 3.28Å; S282-D330 WeakPolarHBondContact CB-OD1 3.19Å; S282-D330 PolarHBondContact N-O 3.35Å; S282-D330 PolarHBondContact OG-OD1 2.91Å
331I96.5Very high83Confident23 Ų2384.9 Ų84.912%0.11847%0.471CS..BIsolated β-bridgetrans-113.2112.7179.6-60.9176.9000110.2P212 L213 N280 C329 T333 S334 C335P212-I331 HydrophobicContact CB-CD1 4.17Å; P212-I331 HydrophobicContact CB-CG1 4.21Å; P212-I331 HydrophobicContact CB-CG2 3.89Å; P212-I331 HydrophobicContact CG-CD1 4.43Å; P212-I331 HydrophobicContact CG-CG2 3.83Å; L213-I331 HydrophobicContact CD2-CD1 3.66Å; N280-I331 CarbonylContact O-C 3.25Å; N280-I331 VanDerWaalsContact O-CA 3.26Å; N280-I331 WeakPolarHBondContact O-CA 3.37Å; C329-I331 PolarHBondContact SG-O 3.49Å; I331-T333 VanDerWaalsContact C-N 3.32Å; I331-T333 WeakPolarHBondContact CG2-OG1 3.3Å; I331-T333 PolarHBondContact O-N 3.47Å; I331-S334 WeakPolarHBondContact CB-OG 3.49Å; I331-S334 PolarHBondContact O-N 3.06Å; I331-S334 VanDerWaalsContact O-N 3.12Å; I331-S334 PolarHBondContact O-OG 3.01Å; I331-C335 PolarHBondContact O-N 2.87Å; I331-C335 PolarHBondContact O-SG 3.19Å
332L95.4Very high82.3Confident41 Ų4184 Ų8422%0.21547%0.468CS..Hα-helixtrans-59.8-43.1-171.7-56.7174.7000111.9N280 L319 I327 C329 S334 C335 V336N280-L332 PolarHBondContact O-N 3.13Å; N280-L332 WeakPolarHBondContact OD1-CB 2.95Å; N280-L332 PolarHBondContact OD1-N 2.98Å; L319-L332 HydrophobicContact CD1-CD1 4.12Å; L319-L332 HydrophobicContact CD2-CD1 3.86Å; I327-L332 HydrophobicContact CG2-CD2 3.56Å; C329-L332 HydrophobicContact CB-CD2 4.29Å; L332-S334 VanDerWaalsContact C-N 3.27Å; L332-S334 PolarHBondContact O-N 3.48Å; L332-C335 PolarHBondContact O-N 3.41Å; L332-C335 VanDerWaalsContact O-N 3.17Å; L332-V336 WeakPolarHBondContact O-CG2 3.44Å; L332-V336 PolarHBondContact O-N 2.9Å; L332-V336 VanDerWaalsContact O-N 3.14Å
333T91.2Very high81.6Confident88 Ų8884.5 Ų84.554%0.5447%0.474SS..Hα-helixtrans-63.5-27.1-179.747.80000114.2N280 I331 S337N280-T333 PolarHBondContact ND2-OG1 3.42Å; N280-T333 WeakPolarHBondContact OD1-CG2 3.46Å; N280-T333 PolarHBondContact OD1-N 3.24Å; N280-T333 VanDerWaalsContact OD1-N 3.09Å; N280-T333 PolarHBondContact OD1-OG1 3.3Å; I331-T333 VanDerWaalsContact C-N 3.32Å; I331-T333 WeakPolarHBondContact CG2-OG1 3.3Å; I331-T333 PolarHBondContact O-N 3.47Å; T333-S337 PolarHBondContact O-OG 3.42Å
334S85.8Confident80.8Confident49 Ų4986 Ų8634%0.34348%0.481SS..Hα-helixtrans-81.1-31.7174.754.30000112.4I331 L332 S337 E338I331-S334 WeakPolarHBondContact CB-OG 3.49Å; I331-S334 PolarHBondContact O-N 3.06Å; I331-S334 VanDerWaalsContact O-N 3.12Å; I331-S334 PolarHBondContact O-OG 3.01Å; L332-S334 VanDerWaalsContact C-N 3.27Å; L332-S334 PolarHBondContact O-N 3.48Å; S334-S337 PolarHBondContact O-OG 3.49Å; S334-E338 PolarHBondContact O-N 2.97Å
335C77.6Confident79.9Confident36 Ų3688.6 Ų88.624%0.24350%0.498CS..Hα-helixtrans-72-33.1178.7-60.60000112.6C329 I331 L332 E338 Q339C329-C335 HydrophobicContact CB-CB 4.03Å; C329-C335 WeakPolarHBondContact CB-SG 3.49Å; C329-C335 WeakPolarHBondContact SG-CB 3.3Å; C329-C335 CovalentContact SG-SG 2.03Å; C329-C335 PolarHBondContact SG-SG 3.35Å; I331-C335 PolarHBondContact O-N 2.87Å; I331-C335 PolarHBondContact O-SG 3.19Å; L332-C335 PolarHBondContact O-N 3.41Å; L332-C335 VanDerWaalsContact O-N 3.17Å; C335-E338 PolarHBondContact O-N 3.21Å; C335-Q339 PolarHBondContact O-N 3.36Å
336V74.4Confident79Confident82 Ų8284.7 Ų84.750%0.49749%0.485SS..Hα-helixtrans-66.6-42.6175.4177.10000111L332 E338 Q339 D340L332-V336 WeakPolarHBondContact O-CG2 3.44Å; L332-V336 PolarHBondContact O-N 2.9Å; L332-V336 VanDerWaalsContact O-N 3.14Å; V336-E338 PolarHBondContact O-N 3.41Å; V336-Q339 PolarHBondContact O-N 3.37Å; V336-Q339 VanDerWaalsContact O-N 3.11Å; V336-D340 PolarHBondContact O-N 3.35Å
337S64.5Low78Confident65 Ų6581.9 Ų81.946%0.45548%0.478SS..Hα-helixtrans-63.3-25.917850.30000113.9T333 S334 S341T333-S337 PolarHBondContact O-OG 3.42Å; S334-S337 PolarHBondContact O-OG 3.49Å; S337-S341 PolarHBondContact O-OG 2.7Å
338E59.5Low76.8Confident147 Ų14786.1 Ų86.169%0.68750%0.503SS*.Hα-helixtrans-80.1-21.4176.6-72179-175.300113.3S334 C335 V336S334-E338 PolarHBondContact O-N 2.97Å; C335-E338 PolarHBondContact O-N 3.21Å; V336-E338 PolarHBondContact O-N 3.41Å
339Q51Low75.6Confident161 Ų16184.6 Ų84.675%0.75249%0.485SS*.Hα-helixtrans-86.9-26.3177.2-69.2-178.1-100113C335 V336C335-Q339 PolarHBondContact O-N 3.36Å; V336-Q339 PolarHBondContact O-N 3.37Å; V336-Q339 VanDerWaalsContact O-N 3.11Å
340D51.4Low74.1Confident140 Ų14090.3 Ų90.375%0.74952%0.516SS*.  trans-88.7-2.6177.9-71.1-24.8000113.6V336V336-D340 PolarHBondContact O-N 3.35Å
341S46.2Very low72.1Confident155 Ų15589.7 Ų89.7100%1.08452%0.517SS*.  trans-1020176.1-58.70000111.2S337S337-S341 PolarHBondContact O-OG 2.7Å

Retrieved 341 of 341 residues in 175.1 ms (Link to these results)

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