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14-3-3-like protein GF14 nu

Is associated with a DNA binding complex that binds to the G box, a well-characterized cis-acting DNA regulatory element found in plant genes.

AlphaFold DB , UniProt , Accession Q96300, Species ARATH (Arabidopsis thaliana, Mouse-ear cress), Gene GRF7, Length 265 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
1M53.1Low86.5Confident191 Ų19183.3 Ų83.394%0.94143%0.433SS*.  0-390-68.8-172.7-168.100111.9S3 S4 R5M1-S3 VanDerWaalsContact C-N 3.34Å; M1-S3 PolarHBondContact O-N 3.08Å; M1-S4 PolarHBondContact O-N 3Å; M1-S4 VanDerWaalsContact O-N 3.15Å; M1-R5 PolarHBondContact O-N 2.76Å
2S61Low87.5Confident80 Ų8076.3 Ų76.356%0.55940%0.397SS*.Hα-helixtrans-56.3-41.1-178.692.20000114.1S4 R5 E6S2-S4 PolarHBondContact O-N 3.49Å; S2-R5 PolarHBondContact O-N 3.15Å; S2-E6 WeakPolarHBondContact O-CG 3.46Å; S2-E6 PolarHBondContact O-N 3.03Å; S2-E6 PolarHBondContact OG-OE1 3.28Å; S2-E6 VanDerWaalsContact OG-OE1 3.08Å
3S72.9Confident88.3Confident86 Ų8675.5 Ų75.560%0.60139%0.388SS*.Hα-helixtrans-62.7-30.2-178.392.10000113.3M1 E7M1-S3 VanDerWaalsContact C-N 3.34Å; M1-S3 PolarHBondContact O-N 3.08Å; S3-E7 WeakPolarHBondContact O-CB 3.49Å; S3-E7 PolarHBondContact O-N 3.29Å
4S89.8Confident89.1Confident58 Ų5876 Ų7641%0.40639%0.392SS..Hα-helixtrans-77.3-35.2176.4-175.70000111.6M1 S2 N8M1-S4 PolarHBondContact O-N 3Å; M1-S4 VanDerWaalsContact O-N 3.15Å; S2-S4 PolarHBondContact O-N 3.49Å; S4-N8 WeakPolarHBondContact O-CB 3.2Å; S4-N8 PolarHBondContact O-N 3.33Å; S4-N8 PolarHBondContact O-ND2 3.06Å; S4-N8 PolarHBondContact OG-ND2 3.01Å
5R94Very high89.7Confident30 Ų3071.3 Ų71.311%0.11337%0.369CS..Hα-helixtrans-65-50174.1-174.3173.6176.6158.9-14110.3M1 S2 E7 N8 V9 V31 T34 D38 E39 E44M1-R5 PolarHBondContact O-N 2.76Å; S2-R5 PolarHBondContact O-N 3.15Å; R5-E7 VanDerWaalsContact C-N 3.34Å; R5-E7 PolarHBondContact O-N 2.9Å; R5-N8 PolarHBondContact O-N 3.34Å; R5-V9 WeakPolarHBondContact O-CG2 3.5Å; R5-V9 PolarHBondContact O-N 2.98Å; R5-V31 HydrophobicContact CG-CG1 4.08Å; R5-V31 HydrophobicContact CG-CG2 4.49Å; R5-T34 WeakPolarHBondContact CD-OG1 3.42Å; R5-D38 PolarHBondContact NH1-O 2.66Å; R5-E39 PolarHBondContact NH2-O 2.66Å; R5-E44 IonicContact CZ-OE1 3.41Å; R5-E44 IonicContact CZ-OE2 3.66Å; R5-E44 IonicContact NE-OE1 2.77Å; R5-E44 PolarHBondContact NE-OE1 3.18Å; R5-E44 IonicContact NE-OE2 3.74Å; R5-E44 IonicContact NH2-OE1 2.7Å; R5-E44 PolarHBondContact NH2-OE1 3.49Å; R5-E44 IonicContact NH2-OE2 2.77Å; R5-E44 PolarHBondContact NH2-OE2 3.4Å
6E93.8Very high90.2Very high124 Ų12470.6 Ų70.658%0.57936%0.363SS*.Hα-helixtrans-58.3-43.5177-70.7166.1-143.500112.1S2 V9 Y10S2-E6 WeakPolarHBondContact O-CG 3.46Å; S2-E6 PolarHBondContact O-N 3.03Å; S2-E6 PolarHBondContact OG-OE1 3.28Å; S2-E6 VanDerWaalsContact OG-OE1 3.08Å; E6-V9 PolarHBondContact O-N 2.92Å; E6-Y10 WeakPolarHBondContact O-CB 3.29Å; E6-Y10 PolarHBondContact O-N 3.11Å
7E96.1Very high90.7Very high115 Ų11575.8 Ų75.854%0.53739%0.386SS..Hα-helixtrans-62.3-46.6175.7-177.6179.4-173.800112.1S3 R5 V9 Y10 L11S3-E7 WeakPolarHBondContact O-CB 3.49Å; S3-E7 PolarHBondContact O-N 3.29Å; R5-E7 VanDerWaalsContact C-N 3.34Å; R5-E7 PolarHBondContact O-N 2.9Å; E7-V9 VanDerWaalsContact C-N 3.34Å; E7-V9 PolarHBondContact O-N 2.69Å; E7-Y10 PolarHBondContact O-N 2.77Å; E7-L11 HydrophobicContact CG-CD1 4.03Å; E7-L11 WeakPolarHBondContact O-CB 3.19Å; E7-L11 WeakPolarHBondContact O-CG 3.12Å; E7-L11 PolarHBondContact O-N 3.24Å
8N97.3Very high91.1Very high14 Ų1475.1 Ų75.18%0.07539%0.393CS..Hα-helixtrans-65.4-37.3178-75.8-66.7000111.9S4 R5 Y10 L11 A12 F27 K30 V31S4-N8 WeakPolarHBondContact O-CB 3.2Å; S4-N8 PolarHBondContact O-N 3.33Å; S4-N8 PolarHBondContact O-ND2 3.06Å; S4-N8 PolarHBondContact OG-ND2 3.01Å; R5-N8 PolarHBondContact O-N 3.34Å; N8-Y10 VanDerWaalsContact C-N 3.35Å; N8-L11 PolarHBondContact O-N 3.38Å; N8-A12 WeakPolarHBondContact O-CB 3.32Å; N8-A12 PolarHBondContact O-N 2.91Å; N8-F27 HydrophobicContact CB-CB 4.4Å; N8-K30 VanDerWaalsContact OD1-CD 3.23Å; N8-K30 WeakPolarHBondContact OD1-CD 3.48Å; N8-V31 HydrophobicContact CB-CG2 3.56Å
9V97.3Very high91.4Very high15 Ų1578.7 Ų78.79%0.09141%0.408CS..Hα-helixtrans-63.6-42.5173.8172.40000110.8R5 E6 E7 A12 K13 V31 E44 L47R5-V9 WeakPolarHBondContact O-CG2 3.5Å; R5-V9 PolarHBondContact O-N 2.98Å; E6-V9 PolarHBondContact O-N 2.92Å; E7-V9 VanDerWaalsContact C-N 3.34Å; E7-V9 PolarHBondContact O-N 2.69Å; V9-A12 PolarHBondContact O-N 3.39Å; V9-K13 WeakPolarHBondContact O-CG 3.46Å; V9-K13 PolarHBondContact O-N 3.23Å; V9-V31 HydrophobicContact CG2-CG1 4.16Å; V9-V31 HydrophobicContact CG2-CG2 3.76Å; V9-E44 HydrophobicContact CG2-CG 3.83Å; V9-L47 HydrophobicContact CG1-CD1 4.05Å
10Y97.8Very high91.8Very high151 Ų15181.2 Ų81.259%0.59241%0.411SS*.Hα-helixtrans-63.5-44.6176.4-175.2-106.8000112E6 E7 N8 A12 K13 L14E6-Y10 WeakPolarHBondContact O-CB 3.29Å; E6-Y10 PolarHBondContact O-N 3.11Å; E7-Y10 PolarHBondContact O-N 2.77Å; N8-Y10 VanDerWaalsContact C-N 3.35Å; Y10-A12 VanDerWaalsContact C-N 3.35Å; Y10-A12 PolarHBondContact O-N 3.37Å; Y10-K13 PolarHBondContact O-N 3.45Å; Y10-L14 HydrophobicContact CD1-CD1 3.97Å; Y10-L14 HydrophobicContact CD1-CG 4.4Å; Y10-L14 HydrophobicContact CE1-CD1 3.54Å; Y10-L14 HydrophobicContact CE1-CG 4.09Å; Y10-L14 WeakPolarHBondContact O-CG 3.41Å; Y10-L14 PolarHBondContact O-N 3.26Å
11L98.3Very high92.1Very high52 Ų5279.8 Ų79.827%0.27240%0.401SS..Hα-helixtrans-63.7-38175.8-70.8170.5000112.2E7 N8 K13 L14 A15 F27E7-L11 HydrophobicContact CG-CD1 4.03Å; E7-L11 WeakPolarHBondContact O-CB 3.19Å; E7-L11 WeakPolarHBondContact O-CG 3.12Å; E7-L11 PolarHBondContact O-N 3.24Å; N8-L11 PolarHBondContact O-N 3.38Å; L11-K13 VanDerWaalsContact C-N 3.35Å; L11-K13 PolarHBondContact O-N 2.53Å; L11-L14 HydrophobicContact CD2-CD1 4.48Å; L11-L14 PolarHBondContact O-N 3Å; L11-A15 WeakPolarHBondContact O-CB 3.29Å; L11-A15 PolarHBondContact O-N 3.46Å; L11-F27 HydrophobicContact CB-CD1 3.84Å; L11-F27 HydrophobicContact CB-CD2 3.74Å; L11-F27 HydrophobicContact CB-CE1 3.86Å; L11-F27 HydrophobicContact CB-CE2 3.76Å; L11-F27 HydrophobicContact CB-CG 3.81Å; L11-F27 HydrophobicContact CB-CZ 3.82Å; L11-F27 HydrophobicContact CD1-CD1 3.97Å; L11-F27 HydrophobicContact CD1-CE1 3.58Å; L11-F27 HydrophobicContact CD1-CZ 4.06Å; L11-F27 HydrophobicContact CG-CE1 4.27Å; L11-F27 HydrophobicContact CG-CZ 4.35Å
12A98.5Very high94.2Very high0 Ų075 Ų750%038%0.377CS..Hα-helixtrans-61.7-42.2174.100000111.8N8 V9 Y10 A15 E16 M24 F27 M28N8-A12 WeakPolarHBondContact O-CB 3.32Å; N8-A12 PolarHBondContact O-N 2.91Å; V9-A12 PolarHBondContact O-N 3.39Å; Y10-A12 VanDerWaalsContact C-N 3.35Å; Y10-A12 PolarHBondContact O-N 3.37Å; A12-A15 PolarHBondContact O-N 3.34Å; A12-E16 PolarHBondContact O-N 3.39Å; A12-M24 HydrophobicContact CB-CG 4.1Å; A12-F27 HydrophobicContact CB-CB 4.04Å; A12-M28 HydrophobicContact CB-CG 3.82Å; A12-M28 HydrophobicContact CB-SD 3.53Å; A12-M28 VanDerWaalsContact CB-SD 3.53Å
13K98.4Very high96Very high65 Ų6574 Ų7428%0.28336%0.364SS..Hα-helixtrans-63.7-40.5174.5-69.2176.1-176.7-173.80111.9V9 Y10 L11 E16 Q17 E43 L47V9-K13 WeakPolarHBondContact O-CG 3.46Å; V9-K13 PolarHBondContact O-N 3.23Å; Y10-K13 PolarHBondContact O-N 3.45Å; L11-K13 VanDerWaalsContact C-N 3.35Å; L11-K13 PolarHBondContact O-N 2.53Å; K13-E16 PolarHBondContact O-N 3.17Å; K13-Q17 VanDerWaalsContact O-CG 3.31Å; K13-Q17 WeakPolarHBondContact O-CG 3.41Å; K13-Q17 PolarHBondContact O-N 3.24Å; K13-Q17 VanDerWaalsContact O-N 3.16Å; K13-E43 WeakPolarHBondContact CE-OE1 3.23Å; K13-E43 IonicContact NZ-OE1 3.48Å; K13-E43 PolarHBondContact NZ-OE1 3.41Å; K13-E43 IonicContact NZ-OE2 3.32Å; K13-E43 PolarHBondContact NZ-OE2 2.93Å; K13-L47 HydrophobicContact CG-CD1 4.07Å; K13-L47 HydrophobicContact CG-CD2 4.17Å
14L98.6Very high97.2Very high83 Ų8370 Ų7044%0.43534%0.335SS..Hα-helixtrans-65.1-41.6174.2-68.2-179.7000112Y10 L11 E16 Q17 A18Y10-L14 HydrophobicContact CD1-CD1 3.97Å; Y10-L14 HydrophobicContact CD1-CG 4.4Å; Y10-L14 HydrophobicContact CE1-CD1 3.54Å; Y10-L14 HydrophobicContact CE1-CG 4.09Å; Y10-L14 WeakPolarHBondContact O-CG 3.41Å; Y10-L14 PolarHBondContact O-N 3.26Å; L11-L14 HydrophobicContact CD2-CD1 4.48Å; L11-L14 PolarHBondContact O-N 3Å; L14-E16 VanDerWaalsContact C-N 3.35Å; L14-Q17 PolarHBondContact O-N 3.09Å; L14-A18 WeakPolarHBondContact O-CB 3.34Å; L14-A18 PolarHBondContact O-N 3.12Å
15A98.5Very high97.6Very high6 Ų668 Ų685%0.0532%0.321CS..Hα-helixtrans-64.5-38.8177.900000111.9L11 A12 A18 E19 R20 E23 M24 F27L11-A15 WeakPolarHBondContact O-CB 3.29Å; L11-A15 PolarHBondContact O-N 3.46Å; A12-A15 PolarHBondContact O-N 3.34Å; A15-A18 CarbonylContact O-C 3.51Å; A15-A18 PolarHBondContact O-N 3.41Å; A15-E19 PolarHBondContact O-N 3.42Å; A15-E19 VanDerWaalsContact O-N 3.08Å; A15-R20 PolarHBondContact O-N 3.32Å; A15-E23 HydrophobicContact CB-CB 4.38Å; A15-M24 HydrophobicContact CB-CB 3.86Å; A15-M24 HydrophobicContact CB-CG 4.44Å; A15-F27 HydrophobicContact CB-CD2 4.3Å; A15-F27 HydrophobicContact CB-CE2 4.29Å
16E98.3Very high97.8Very high60 Ų6071.9 Ų71.928%0.2834%0.34SS..Hα-helixtrans-58.8-50.3172.4-176.6-179.3-150.600111.5A12 K13 L14 A18 E19 M24A12-E16 PolarHBondContact O-N 3.39Å; K13-E16 PolarHBondContact O-N 3.17Å; L14-E16 VanDerWaalsContact C-N 3.35Å; E16-A18 PolarHBondContact O-N 3.04Å; E16-E19 PolarHBondContact O-N 3.47Å; E16-M24 HydrophobicContact CB-CE 3.89Å; E16-M24 HydrophobicContact CB-SD 3.86Å; E16-M24 HydrophobicContact CG-CE 4.23Å; E16-M24 HydrophobicContact CG-SD 4.36Å
17Q97.9Very high98Very high159 Ų15967.5 Ų67.574%0.74332%0.319SS*.Hα-helixtrans-64.5-26.3179.2-65.1-64.5-24.500113.2K13 L14K13-Q17 VanDerWaalsContact O-CG 3.31Å; K13-Q17 WeakPolarHBondContact O-CG 3.41Å; K13-Q17 PolarHBondContact O-N 3.24Å; K13-Q17 VanDerWaalsContact O-N 3.16Å; L14-Q17 PolarHBondContact O-N 3.09Å
18A98.1Very high98.1Very high62 Ų6262 Ų6251%0.51229%0.293SS..THydrogen-bonded Turntrans-91.63.7175.600000113.3L14 A15 E16 R20L14-A18 WeakPolarHBondContact O-CB 3.34Å; L14-A18 PolarHBondContact O-N 3.12Å; A15-A18 CarbonylContact O-C 3.51Å; A15-A18 PolarHBondContact O-N 3.41Å; E16-A18 PolarHBondContact O-N 3.04Å; A18-R20 HydrophobicContact CB-CG 3.98Å; A18-R20 WeakPolarHBondContact O-CG 3.48Å; A18-R20 PolarHBondContact O-N 3.25Å; A18-R20 VanDerWaalsContact O-N 3.17Å
19E97.8Very high98.1Very high144 Ų14463.6 Ų63.667%0.67330%0.3SS*.THydrogen-bonded Turntrans54.528.3-175.1-59.1-176.6-145.100113.9A15 E16 Y21A15-E19 PolarHBondContact O-N 3.42Å; A15-E19 VanDerWaalsContact O-N 3.08Å; E16-E19 PolarHBondContact O-N 3.47Å; E19-Y21 HydrophobicContact CB-CE2 3.92Å; E19-Y21 HydrophobicContact CG-CE2 4.42Å; E19-Y21 WeakPolarHBondContact O-CD2 3.21Å; E19-Y21 PolarHBondContact O-N 2.81Å
20R98.5Very high98Very high129 Ų12967.5 Ų67.549%0.48732%0.316SS..  trans-95.464.1178.6-57.3-161.574.3-155.2-9.4110.7A15 A18 E22 E23 M24A15-R20 PolarHBondContact O-N 3.32Å; A18-R20 HydrophobicContact CB-CG 3.98Å; A18-R20 WeakPolarHBondContact O-CG 3.48Å; A18-R20 PolarHBondContact O-N 3.25Å; A18-R20 VanDerWaalsContact O-N 3.17Å; R20-E22 VanDerWaalsContact C-N 3.28Å; R20-E22 PolarHBondContact O-N 2.73Å; R20-E23 HydrophobicContact CB-CB 4.39Å; R20-E23 HydrophobicContact CB-CG 4.4Å; R20-E23 IonicContact CZ-OE1 2.78Å; R20-E23 IonicContact CZ-OE2 2.85Å; R20-E23 IonicContact NE-OE1 3.85Å; R20-E23 IonicContact NE-OE2 3.79Å; R20-E23 IonicContact NH1-OE1 3.89Å; R20-E23 PolarHBondContact NH1-OE1 3.41Å; R20-E23 IonicContact NH1-OE2 2.75Å; R20-E23 PolarHBondContact NH1-OE2 3.42Å; R20-E23 VanDerWaalsContact NH2-CD 3.33Å; R20-E23 IonicContact NH2-OE1 3.61Å; R20-E23 PolarHBondContact NH2-OE1 3.1Å; R20-E23 IonicContact NH2-OE2 2.66Å; R20-E23 PolarHBondContact O-N 2.94Å; R20-M24 PolarHBondContact O-N 2.63Å
21Y98.4Very high97.8Very high51 Ų5160.3 Ų60.320%0.229%0.288CS..Hα-helixtrans-63.8-28.6-170.8-57.1-72.4000114.1E19 M24 V25 N54 V55E19-Y21 HydrophobicContact CB-CE2 3.92Å; E19-Y21 HydrophobicContact CG-CE2 4.42Å; E19-Y21 WeakPolarHBondContact O-CD2 3.21Å; E19-Y21 PolarHBondContact O-N 2.81Å; Y21-M24 HydrophobicContact CD1-SD 4.13Å; Y21-M24 WeakPolarHBondContact O-CB 3.44Å; Y21-M24 PolarHBondContact O-N 3Å; Y21-V25 WeakPolarHBondContact O-CG2 3.27Å; Y21-V25 PolarHBondContact O-N 2.83Å; Y21-N54 HydrophobicContact CD1-CB 3.5Å; Y21-N54 HydrophobicContact CD2-CB 3.62Å; Y21-N54 HydrophobicContact CE1-CB 3.85Å; Y21-N54 VanDerWaalsContact CE1-CG 3.49Å; Y21-N54 WeakPolarHBondContact CE1-ND2 3.13Å; Y21-N54 HydrophobicContact CE2-CB 3.96Å; Y21-N54 HydrophobicContact CG-CB 3.36Å; Y21-V55 VanDerWaalsContact C-CG2 3.45Å; Y21-V55 WeakPolarHBondContact O-CG2 3.5Å
22E97.9Very high97.7Very high92 Ų9257.9 Ų57.943%0.4328%0.275SS..Hα-helixtrans-62.4-41.9172.6-67.485170.800111.8R20 V25 E26 V55R20-E22 VanDerWaalsContact C-N 3.28Å; R20-E22 PolarHBondContact O-N 2.73Å; E22-V25 PolarHBondContact O-N 3.24Å; E22-E26 PolarHBondContact O-N 3.4Å; E22-V55 HydrophobicContact CG-CG1 4.39Å; E22-V55 HydrophobicContact CG-CG2 4.22Å
23E98.2Very high97.4Very high59 Ų5962.6 Ų62.628%0.27630%0.296SS..Hα-helixtrans-70.2-38.1175-61-170.3163.700111A15 R20 V25 E26 F27A15-E23 HydrophobicContact CB-CB 4.38Å; R20-E23 HydrophobicContact CB-CB 4.39Å; R20-E23 HydrophobicContact CB-CG 4.4Å; R20-E23 IonicContact CZ-OE1 2.78Å; R20-E23 IonicContact CZ-OE2 2.85Å; R20-E23 IonicContact NE-OE1 3.85Å; R20-E23 IonicContact NE-OE2 3.79Å; R20-E23 IonicContact NH1-OE1 3.89Å; R20-E23 PolarHBondContact NH1-OE1 3.41Å; R20-E23 IonicContact NH1-OE2 2.75Å; R20-E23 PolarHBondContact NH1-OE2 3.42Å; R20-E23 VanDerWaalsContact NH2-CD 3.33Å; R20-E23 IonicContact NH2-OE1 3.61Å; R20-E23 PolarHBondContact NH2-OE1 3.1Å; R20-E23 IonicContact NH2-OE2 2.66Å; R20-E23 PolarHBondContact O-N 2.94Å; E23-V25 VanDerWaalsContact C-N 3.27Å; E23-V25 PolarHBondContact O-N 2.59Å; E23-E26 WeakPolarHBondContact O-CB 3.47Å; E23-E26 PolarHBondContact O-N 2.95Å; E23-E26 VanDerWaalsContact O-N 3.1Å; E23-F27 HydrophobicContact CB-CD2 4.49Å; E23-F27 HydrophobicContact CB-CE2 3.95Å; E23-F27 WeakPolarHBondContact O-CD2 3.48Å; E23-F27 WeakPolarHBondContact O-CG 3.4Å; E23-F27 PolarHBondContact O-N 3.32Å
24M98.2Very high97Very high0 Ų061.4 Ų61.40%029%0.294CS..Hα-helixtrans-57.1-42.1174.5-166.1-171.5-179.300111.5A12 A15 E16 R20 Y21 F27 M28 L47 V50 A51A12-M24 HydrophobicContact CB-CG 4.1Å; A15-M24 HydrophobicContact CB-CB 3.86Å; A15-M24 HydrophobicContact CB-CG 4.44Å; E16-M24 HydrophobicContact CB-CE 3.89Å; E16-M24 HydrophobicContact CB-SD 3.86Å; E16-M24 HydrophobicContact CG-CE 4.23Å; E16-M24 HydrophobicContact CG-SD 4.36Å; R20-M24 PolarHBondContact O-N 2.63Å; Y21-M24 HydrophobicContact CD1-SD 4.13Å; Y21-M24 WeakPolarHBondContact O-CB 3.44Å; Y21-M24 PolarHBondContact O-N 3Å; M24-F27 PolarHBondContact O-N 2.86Å; M24-M28 WeakPolarHBondContact O-CB 3.33Å; M24-M28 WeakPolarHBondContact O-CG 3.41Å; M24-M28 PolarHBondContact O-N 3.44Å; M24-L47 HydrophobicContact CE-CB 4Å; M24-L47 HydrophobicContact CE-CD2 3.5Å; M24-L47 HydrophobicContact CE-CG 4.37Å; M24-L47 WeakPolarHBondContact CE-O 3.34Å; M24-V50 HydrophobicContact CE-CB 4.36Å; M24-V50 HydrophobicContact CE-CG1 4.24Å; M24-V50 HydrophobicContact SD-CG1 4.44Å; M24-A51 HydrophobicContact CB-CB 3.99Å; M24-A51 HydrophobicContact CE-CB 4.2Å; M24-A51 HydrophobicContact CG-CB 3.61Å; M24-A51 HydrophobicContact SD-CB 3.6Å
25V98.4Very high96Very high17 Ų1757.7 Ų57.710%0.10327%0.274CS..Hα-helixtrans-58.7-51.3173.2166.70000110Y21 E22 E23 F27 M28 E29 A51 Y52 V55Y21-V25 WeakPolarHBondContact O-CG2 3.27Å; Y21-V25 PolarHBondContact O-N 2.83Å; E22-V25 PolarHBondContact O-N 3.24Å; E23-V25 VanDerWaalsContact C-N 3.27Å; E23-V25 PolarHBondContact O-N 2.59Å; V25-F27 VanDerWaalsContact C-N 3.3Å; V25-F27 PolarHBondContact O-N 3.48Å; V25-M28 PolarHBondContact O-N 3.42Å; V25-M28 VanDerWaalsContact O-N 3.12Å; V25-E29 HydrophobicContact CG1-CG 4.04Å; V25-E29 VanDerWaalsContact O-CG 3.28Å; V25-E29 WeakPolarHBondContact O-CG 2.91Å; V25-E29 PolarHBondContact O-N 3.38Å; V25-A51 HydrophobicContact CG2-CB 3.79Å; V25-Y52 HydrophobicContact CG1-CD1 4.27Å; V25-Y52 HydrophobicContact CG1-CD2 4.39Å; V25-Y52 HydrophobicContact CG1-CE1 3.72Å; V25-Y52 HydrophobicContact CG1-CE2 3.87Å; V25-Y52 HydrophobicContact CG2-CD1 4.14Å; V25-Y52 HydrophobicContact CG2-CD2 4.1Å; V25-Y52 HydrophobicContact CG2-CE1 4.42Å; V25-Y52 HydrophobicContact CG2-CE2 4.38Å; V25-Y52 HydrophobicContact CG2-CG 3.98Å; V25-V55 HydrophobicContact CG2-CB 4.5Å; V25-V55 HydrophobicContact CG2-CG2 3.83Å
26E97.9Very high94.7Very high112 Ų11263.3 Ų63.352%0.52330%0.304SS..Hα-helixtrans-56.5-41.4-179.6-67.6-179.2-169.300113.3E22 E23 K30E22-E26 PolarHBondContact O-N 3.4Å; E23-E26 WeakPolarHBondContact O-CB 3.47Å; E23-E26 PolarHBondContact O-N 2.95Å; E23-E26 VanDerWaalsContact O-N 3.1Å; E26-K30 WeakPolarHBondContact O-CG 3.35Å; E26-K30 PolarHBondContact O-N 3.49Å
27F97.9Very high93.3Very high31 Ų3164.7 Ų64.714%0.13632%0.317CS..Hα-helixtrans-68-44.9176.2-61.7-51.7000111.7N8 L11 A12 A15 E23 M24 V25 E29 K30 V31N8-F27 HydrophobicContact CB-CB 4.4Å; L11-F27 HydrophobicContact CB-CD1 3.84Å; L11-F27 HydrophobicContact CB-CD2 3.74Å; L11-F27 HydrophobicContact CB-CE1 3.86Å; L11-F27 HydrophobicContact CB-CE2 3.76Å; L11-F27 HydrophobicContact CB-CG 3.81Å; L11-F27 HydrophobicContact CB-CZ 3.82Å; L11-F27 HydrophobicContact CD1-CD1 3.97Å; L11-F27 HydrophobicContact CD1-CE1 3.58Å; L11-F27 HydrophobicContact CD1-CZ 4.06Å; L11-F27 HydrophobicContact CG-CE1 4.27Å; L11-F27 HydrophobicContact CG-CZ 4.35Å; A12-F27 HydrophobicContact CB-CB 4.04Å; A15-F27 HydrophobicContact CB-CD2 4.3Å; A15-F27 HydrophobicContact CB-CE2 4.29Å; E23-F27 HydrophobicContact CB-CD2 4.49Å; E23-F27 HydrophobicContact CB-CE2 3.95Å; E23-F27 WeakPolarHBondContact O-CD2 3.48Å; E23-F27 WeakPolarHBondContact O-CG 3.4Å; E23-F27 PolarHBondContact O-N 3.32Å; M24-F27 PolarHBondContact O-N 2.86Å; V25-F27 VanDerWaalsContact C-N 3.3Å; V25-F27 PolarHBondContact O-N 3.48Å; F27-E29 PolarHBondContact O-N 3.27Å; F27-K30 WeakPolarHBondContact O-CB 3.48Å; F27-K30 PolarHBondContact O-N 3.41Å; F27-V31 WeakPolarHBondContact O-CG2 3.35Å; F27-V31 PolarHBondContact O-N 3Å; F27-V31 VanDerWaalsContact O-N 3.12Å
28M97.8Very high92.4Very high0 Ų062.4 Ų62.40%031%0.309CS..Hα-helixtrans-71.1-27.9-179.2-68.6-52.4-53.700113.2A12 M24 V25 K30 V31 A32 E44 L47 L48A12-M28 HydrophobicContact CB-CG 3.82Å; A12-M28 HydrophobicContact CB-SD 3.53Å; A12-M28 VanDerWaalsContact CB-SD 3.53Å; M24-M28 WeakPolarHBondContact O-CB 3.33Å; M24-M28 WeakPolarHBondContact O-CG 3.41Å; M24-M28 PolarHBondContact O-N 3.44Å; V25-M28 PolarHBondContact O-N 3.42Å; V25-M28 VanDerWaalsContact O-N 3.12Å; M28-K30 VanDerWaalsContact C-N 3.32Å; M28-V31 HydrophobicContact CE-CB 4.14Å; M28-V31 HydrophobicContact CE-CG1 4.1Å; M28-V31 PolarHBondContact O-N 3.25Å; M28-V31 HydrophobicContact SD-CG2 4.36Å; M28-A32 WeakPolarHBondContact O-CB 3.32Å; M28-A32 PolarHBondContact O-N 3.06Å; M28-E44 HydrophobicContact CE-CB 4.23Å; M28-E44 WeakPolarHBondContact CE-O 3.41Å; M28-L47 HydrophobicContact CE-CB 3.92Å; M28-L47 HydrophobicContact CG-CB 4.29Å; M28-L47 HydrophobicContact SD-CB 3.78Å; M28-L47 HydrophobicContact SD-CD1 4.36Å; M28-L48 HydrophobicContact CB-CB 4.39Å; M28-L48 HydrophobicContact CB-CD1 3.68Å; M28-L48 HydrophobicContact CE-CB 4.06Å
29E96.8Very high92.1Very high47 Ų4762.1 Ų62.122%0.2230%0.297CS..Hα-helixtrans-62.9-40.1169.6-66-153.9172.300111.5V25 F27 V31 A32 K33 Y52 L106V25-E29 HydrophobicContact CG1-CG 4.04Å; V25-E29 VanDerWaalsContact O-CG 3.28Å; V25-E29 WeakPolarHBondContact O-CG 2.91Å; V25-E29 PolarHBondContact O-N 3.38Å; F27-E29 PolarHBondContact O-N 3.27Å; E29-V31 VanDerWaalsContact C-N 3.35Å; E29-A32 PolarHBondContact O-N 3.18Å; E29-K33 WeakPolarHBondContact O-CD 3.36Å; E29-K33 VanDerWaalsContact O-CG 3.27Å; E29-K33 WeakPolarHBondContact O-CG 3.35Å; E29-K33 PolarHBondContact O-N 2.83Å; E29-K33 IonicContact OE2-NZ 3.09Å; E29-K33 PolarHBondContact OE2-NZ 3Å; E29-K33 VanDerWaalsContact OE2-NZ 3.09Å; E29-Y52 VanDerWaalsContact CD-OH 3.3Å; E29-Y52 HydrophobicContact CG-CE2 4.48Å; E29-Y52 VanDerWaalsContact CG-OH 3.24Å; E29-Y52 WeakPolarHBondContact CG-OH 3.37Å; E29-Y52 PolarHBondContact OE1-OH 3.26Å; E29-L106 HydrophobicContact CB-CD1 4.14Å; E29-L106 HydrophobicContact CG-CD1 3.81Å
30K95.1Very high92Very high98 Ų9855.5 Ų55.543%0.42627%0.266SS..Hα-helixtrans-64.4-42.7176.7-67.7165.1-174.3165.80110.4N8 E26 F27 M28 K33 T34N8-K30 VanDerWaalsContact OD1-CD 3.23Å; N8-K30 WeakPolarHBondContact OD1-CD 3.48Å; E26-K30 WeakPolarHBondContact O-CG 3.35Å; E26-K30 PolarHBondContact O-N 3.49Å; F27-K30 WeakPolarHBondContact O-CB 3.48Å; F27-K30 PolarHBondContact O-N 3.41Å; M28-K30 VanDerWaalsContact C-N 3.32Å; K30-K33 PolarHBondContact O-N 2.87Å; K30-T34 WeakPolarHBondContact O-CG2 3.02Å
31V95.6Very high91.8Very high0 Ų052.9 Ų52.90%027%0.265CS..Hα-helixtrans-61-49.1174.7175.30000110.8R5 N8 V9 F27 M28 E29 K33 T34 L40 E44R5-V31 HydrophobicContact CG-CG1 4.08Å; R5-V31 HydrophobicContact CG-CG2 4.49Å; N8-V31 HydrophobicContact CB-CG2 3.56Å; V9-V31 HydrophobicContact CG2-CG1 4.16Å; V9-V31 HydrophobicContact CG2-CG2 3.76Å; F27-V31 WeakPolarHBondContact O-CG2 3.35Å; F27-V31 PolarHBondContact O-N 3Å; F27-V31 VanDerWaalsContact O-N 3.12Å; M28-V31 HydrophobicContact CE-CB 4.14Å; M28-V31 HydrophobicContact CE-CG1 4.1Å; M28-V31 PolarHBondContact O-N 3.25Å; M28-V31 HydrophobicContact SD-CG2 4.36Å; E29-V31 VanDerWaalsContact C-N 3.35Å; V31-K33 VanDerWaalsContact C-N 3.25Å; V31-K33 PolarHBondContact O-N 3.48Å; V31-T34 PolarHBondContact O-N 3.27Å; V31-T34 PolarHBondContact O-OG1 3.06Å; V31-L40 HydrophobicContact CG1-CD2 3.74Å; V31-E44 HydrophobicContact CG1-CG 4.36Å
32A95.2Very high91.6Very high0 Ų054.1 Ų54.10%028%0.278CS..Hα-helixtrans-59.9-32.3179.800000113.1M28 E29 T34 V35 L106 L111M28-A32 WeakPolarHBondContact O-CB 3.32Å; M28-A32 PolarHBondContact O-N 3.06Å; E29-A32 PolarHBondContact O-N 3.18Å; A32-T34 PolarHBondContact O-N 3.43Å; A32-V35 WeakPolarHBondContact O-CG2 3.46Å; A32-L106 HydrophobicContact CB-CD1 4.22Å; A32-L106 HydrophobicContact CB-CD2 4Å; A32-L111 HydrophobicContact CB-CD2 4.15Å
33K92.7Very high91.4Very high100 Ų10054.7 Ų54.744%0.43528%0.28SS..THydrogen-bonded Turntrans-76.6-2.9176.4-70.2165.5-172.9158.90114E29 K30 V31 L106E29-K33 WeakPolarHBondContact O-CD 3.36Å; E29-K33 VanDerWaalsContact O-CG 3.27Å; E29-K33 WeakPolarHBondContact O-CG 3.35Å; E29-K33 PolarHBondContact O-N 2.83Å; E29-K33 IonicContact OE2-NZ 3.09Å; E29-K33 PolarHBondContact OE2-NZ 3Å; E29-K33 VanDerWaalsContact OE2-NZ 3.09Å; K30-K33 PolarHBondContact O-N 2.87Å; V31-K33 VanDerWaalsContact C-N 3.25Å; V31-K33 PolarHBondContact O-N 3.48Å; K33-L106 HydrophobicContact CD-CD2 4.43Å; K33-L106 HydrophobicContact CG-CD2 3.81Å
34T88.6Confident91.4Very high40 Ų4052.6 Ų52.625%0.24527%0.271CS..THydrogen-bonded Turntrans-98.1-0.1175.866.30000114.1R5 K30 V31 A32 D36 T37R5-T34 WeakPolarHBondContact CD-OG1 3.42Å; K30-T34 WeakPolarHBondContact O-CG2 3.02Å; V31-T34 PolarHBondContact O-N 3.27Å; V31-T34 PolarHBondContact O-OG1 3.06Å; A32-T34 PolarHBondContact O-N 3.43Å; T34-D36 PolarHBondContact O-N 3.36Å; T34-D36 VanDerWaalsContact O-N 3.11Å; T34-T37 PolarHBondContact O-N 3.1Å; T34-T37 PolarHBondContact O-OG1 3.36Å
35V78Confident91.3Very high4 Ų453.1 Ų53.12%0.02427%0.273CS..THydrogen-bonded Turntrans-68.5-6.8-175.4-67.40000115.4A32 T37 D38 L40 H110 L111 T114A32-V35 WeakPolarHBondContact O-CG2 3.46Å; V35-T37 PolarHBondContact O-N 2.85Å; V35-D38 VanDerWaalsContact CA-O 3.29Å; V35-D38 WeakPolarHBondContact CA-O 3.47Å; V35-D38 PolarHBondContact O-N 2.85Å; V35-L40 HydrophobicContact CG1-CD2 3.5Å; V35-L40 HydrophobicContact CG1-CG 3.71Å; V35-H110 HydrophobicContact CG2-CB 3.68Å; V35-L111 HydrophobicContact CG1-CD2 4.22Å; V35-L111 HydrophobicContact CG2-CD2 4.38Å; V35-T114 HydrophobicContact CG2-CG2 4.22Å
36D72Confident91.2Very high124 Ų12456 Ų5666%0.66329%0.288SS*.THydrogen-bonded Turntrans-58.5-16.2172.6-56.7-11.5000112.2T34 H110T34-D36 PolarHBondContact O-N 3.36Å; T34-D36 VanDerWaalsContact O-N 3.11Å; D36-H110 IonicContact OD1-ND1 3.45Å; D36-H110 PolarHBondContact OD1-ND1 2.84Å
37T68Low91.2Very high90 Ų9051.2 Ų51.255%0.55227%0.266SS*.THydrogen-bonded Turntrans-101.4-41.7172.664.90000113.9T34 V35T34-T37 PolarHBondContact O-N 3.1Å; T34-T37 PolarHBondContact O-OG1 3.36Å; V35-T37 PolarHBondContact O-N 2.85Å
38D79Confident91.2Very high110 Ų11049.8 Ų49.859%0.58826%0.259SS*.SBendtrans-153.1134.8-174.6-62.5-67.9000111.2R5 V35R5-D38 PolarHBondContact NH1-O 2.66Å; V35-D38 VanDerWaalsContact CA-O 3.29Å; V35-D38 WeakPolarHBondContact CA-O 3.47Å; V35-D38 PolarHBondContact O-N 2.85Å
39E92.2Very high91.2Very high56 Ų5651.3 Ų51.326%0.26227%0.27SS..PPolyproline II helixtrans-52.4156.2174.9-73.9-173.5-129.100112.6R5 T41 T114 S116 S120R5-E39 PolarHBondContact NH2-O 2.66Å; E39-T41 PolarHBondContact O-N 2.85Å; E39-T114 VanDerWaalsContact CG-O 3.29Å; E39-T114 WeakPolarHBondContact CG-O 3.36Å; E39-T114 VanDerWaalsContact OE1-O 3.09Å; E39-S116 WeakPolarHBondContact OE1-CB 3.25Å; E39-S116 PolarHBondContact OE1-N 2.8Å; E39-S116 PolarHBondContact OE1-OG 3.31Å; E39-S116 PolarHBondContact OE2-N 3.39Å; E39-S120 PolarHBondContact OE2-OG 3.46Å
40L94.9Very high91.2Very high5 Ų551.3 Ų51.33%0.02627%0.273CS..PPolyproline II helixtrans-64.7131.4169.1-60.7-173.3000110.4V31 V35 E44 R45 L48 L111V31-L40 HydrophobicContact CG1-CD2 3.74Å; V35-L40 HydrophobicContact CG1-CD2 3.5Å; V35-L40 HydrophobicContact CG1-CG 3.71Å; L40-E44 HydrophobicContact CB-CB 4.12Å; L40-E44 HydrophobicContact CD2-CB 4.2Å; L40-R45 HydrophobicContact CB-CB 4.43Å; L40-L48 HydrophobicContact CD1-CD2 4.09Å; L40-L111 HydrophobicContact CD1-CD2 3.65Å; L40-L111 HydrophobicContact CG-CD2 3.96Å
41T94.6Very high91.4Very high75 Ų7546.6 Ų46.646%0.4625%0.253SS..PPolyproline II helixtrans-60.7162.4166.662.60000110.5E39 E43 E44 R45E39-T41 PolarHBondContact O-N 2.85Å; T41-E43 PolarHBondContact O-N 3.34Å; T41-E44 WeakPolarHBondContact CB-OE2 3.33Å; T41-E44 WeakPolarHBondContact CG2-OE2 3.43Å; T41-E44 PolarHBondContact N-OE2 3.43Å; T41-E44 PolarHBondContact O-N 3.39Å; T41-E44 WeakPolarHBondContact OG1-CB 3.41Å; T41-E44 VanDerWaalsContact OG1-CD 3.26Å; T41-E44 WeakPolarHBondContact OG1-CG 3.28Å; T41-E44 PolarHBondContact OG1-N 3.12Å; T41-E44 PolarHBondContact OG1-OE2 2.89Å; T41-R45 WeakPolarHBondContact O-CB 3.17Å; T41-R45 PolarHBondContact O-N 3.25Å
42V93.7Very high91.5Very high76 Ų7646.8 Ų46.846%0.46125%0.253SS..Hα-helixtrans-56.8-41176.7177.40000111.2R45 N46V42-R45 PolarHBondContact O-N 2.9Å; V42-N46 WeakPolarHBondContact O-CB 3.24Å; V42-N46 VanDerWaalsContact O-CG 3.26Å; V42-N46 PolarHBondContact O-N 2.97Å; V42-N46 PolarHBondContact O-ND2 3.05Å
43E95.7Very high91.6Very high104 Ų10453.4 Ų53.449%0.48628%0.282SS..Hα-helixtrans-63.6-48.9177.6-171.8179.9-147.500111.7K13 T41 R45 N46 L47K13-E43 WeakPolarHBondContact CE-OE1 3.23Å; K13-E43 IonicContact NZ-OE1 3.48Å; K13-E43 PolarHBondContact NZ-OE1 3.41Å; K13-E43 IonicContact NZ-OE2 3.32Å; K13-E43 PolarHBondContact NZ-OE2 2.93Å; T41-E43 PolarHBondContact O-N 3.34Å; E43-R45 VanDerWaalsContact C-N 3.31Å; E43-R45 PolarHBondContact O-N 3.21Å; E43-N46 PolarHBondContact O-N 3.35Å; E43-L47 HydrophobicContact CG-CD1 4.32Å; E43-L47 WeakPolarHBondContact O-CG 3.13Å; E43-L47 PolarHBondContact O-N 3.36Å
44E96.6Very high91.9Very high16 Ų1651.5 Ų51.58%0.07528%0.277CS..Hα-helixtrans-62.8-38.9178.4-69.6165138.500112R5 V9 M28 V31 L40 T41 N46 L47 L48R5-E44 IonicContact CZ-OE1 3.41Å; R5-E44 IonicContact CZ-OE2 3.66Å; R5-E44 IonicContact NE-OE1 2.77Å; R5-E44 PolarHBondContact NE-OE1 3.18Å; R5-E44 IonicContact NE-OE2 3.74Å; R5-E44 IonicContact NH2-OE1 2.7Å; R5-E44 PolarHBondContact NH2-OE1 3.49Å; R5-E44 IonicContact NH2-OE2 2.77Å; R5-E44 PolarHBondContact NH2-OE2 3.4Å; V9-E44 HydrophobicContact CG2-CG 3.83Å; M28-E44 HydrophobicContact CE-CB 4.23Å; M28-E44 WeakPolarHBondContact CE-O 3.41Å; V31-E44 HydrophobicContact CG1-CG 4.36Å; L40-E44 HydrophobicContact CB-CB 4.12Å; L40-E44 HydrophobicContact CD2-CB 4.2Å; T41-E44 WeakPolarHBondContact CB-OE2 3.33Å; T41-E44 WeakPolarHBondContact CG2-OE2 3.43Å; T41-E44 PolarHBondContact N-OE2 3.43Å; T41-E44 PolarHBondContact O-N 3.39Å; T41-E44 WeakPolarHBondContact OG1-CB 3.41Å; T41-E44 VanDerWaalsContact OG1-CD 3.26Å; T41-E44 WeakPolarHBondContact OG1-CG 3.28Å; T41-E44 PolarHBondContact OG1-N 3.12Å; T41-E44 PolarHBondContact OG1-OE2 2.89Å; E44-N46 VanDerWaalsContact C-N 3.33Å; E44-N46 PolarHBondContact O-N 3.2Å; E44-L47 PolarHBondContact O-N 2.96Å; E44-L48 PolarHBondContact O-N 3.36Å
45R96.7Very high92.3Very high10 Ų1050.1 Ų50.14%0.03827%0.268CS..Hα-helixtrans-62.6-42.1176.3-159.9-168.2-49.5149.59111.4L40 T41 V42 E43 S49 E119 F123 Y124L40-R45 HydrophobicContact CB-CB 4.43Å; T41-R45 WeakPolarHBondContact O-CB 3.17Å; T41-R45 PolarHBondContact O-N 3.25Å; V42-R45 PolarHBondContact O-N 2.9Å; E43-R45 VanDerWaalsContact C-N 3.31Å; E43-R45 PolarHBondContact O-N 3.21Å; R45-S49 PolarHBondContact O-N 2.95Å; R45-S49 VanDerWaalsContact O-N 3.1Å; R45-E119 IonicContact NH1-OE1 2.73Å; R45-E119 PolarHBondContact NH1-OE1 3.31Å; R45-E119 VanDerWaalsContact NH1-OE1 3.09Å; R45-F123 HydrophobicContact CG-CD1 3.61Å; R45-F123 HydrophobicContact CG-CE1 3.4Å; R45-F123 VanDerWaalsContact CG-CE1 3.4Å; R45-F123 HydrophobicContact CG-CE2 4.4Å; R45-F123 HydrophobicContact CG-CG 4.21Å; R45-F123 HydrophobicContact CG-CZ 3.81Å; R45-Y124 HydrophobicContact CG-CE1 3.63Å
46N95.6Very high93.3Very high79 Ų7950 Ų5042%0.42227%0.267SS..Hα-helixtrans-66.8-43.6176.3-73.8-19.2000111.5V42 E43 E44 L48 S49 V50V42-N46 WeakPolarHBondContact O-CB 3.24Å; V42-N46 VanDerWaalsContact O-CG 3.26Å; V42-N46 PolarHBondContact O-N 2.97Å; V42-N46 PolarHBondContact O-ND2 3.05Å; E43-N46 PolarHBondContact O-N 3.35Å; E44-N46 VanDerWaalsContact C-N 3.33Å; E44-N46 PolarHBondContact O-N 3.2Å; N46-L48 PolarHBondContact O-N 2.87Å; N46-S49 WeakPolarHBondContact O-CB 3.38Å; N46-S49 PolarHBondContact O-N 3.33Å; N46-V50 WeakPolarHBondContact O-CG2 3.34Å; N46-V50 PolarHBondContact O-N 2.87Å
47L98.1Very high94.6Very high11 Ų1145.4 Ų45.46%0.05825%0.25CC..Hα-helixtrans-58.5-45.8175.5-72.3169.7000111.7V9 K13 M24 M28 E43 E44 S49 V50 A51V9-L47 HydrophobicContact CG1-CD1 4.05Å; K13-L47 HydrophobicContact CG-CD1 4.07Å; K13-L47 HydrophobicContact CG-CD2 4.17Å; M24-L47 HydrophobicContact CE-CB 4Å; M24-L47 HydrophobicContact CE-CD2 3.5Å; M24-L47 HydrophobicContact CE-CG 4.37Å; M24-L47 WeakPolarHBondContact CE-O 3.34Å; M28-L47 HydrophobicContact CE-CB 3.92Å; M28-L47 HydrophobicContact CG-CB 4.29Å; M28-L47 HydrophobicContact SD-CB 3.78Å; M28-L47 HydrophobicContact SD-CD1 4.36Å; E43-L47 HydrophobicContact CG-CD1 4.32Å; E43-L47 WeakPolarHBondContact O-CG 3.13Å; E43-L47 PolarHBondContact O-N 3.36Å; E44-L47 PolarHBondContact O-N 2.96Å; L47-S49 VanDerWaalsContact C-N 3.3Å; L47-S49 PolarHBondContact O-N 3.37Å; L47-V50 PolarHBondContact O-N 2.98Å; L47-A51 WeakPolarHBondContact O-CB 3.25Å; L47-A51 PolarHBondContact O-N 3.44Å
48L98.2Very high96Very high0 Ų043.5 Ų43.50%024%0.243CC..Hα-helixtrans-58.1-45176.3-178.371.4000111.2M28 L40 E44 N46 A51 Y52 I103 L111M28-L48 HydrophobicContact CB-CB 4.39Å; M28-L48 HydrophobicContact CB-CD1 3.68Å; M28-L48 HydrophobicContact CE-CB 4.06Å; L40-L48 HydrophobicContact CD1-CD2 4.09Å; E44-L48 PolarHBondContact O-N 3.36Å; N46-L48 PolarHBondContact O-N 2.87Å; L48-A51 PolarHBondContact O-N 2.98Å; L48-Y52 HydrophobicContact CD1-CD2 3.84Å; L48-Y52 HydrophobicContact CD1-CE2 3.62Å; L48-Y52 HydrophobicContact CG-CD2 4.32Å; L48-Y52 HydrophobicContact CG-CE2 4.48Å; L48-Y52 PolarHBondContact O-N 3.09Å; L48-I103 HydrophobicContact CD2-CD1 4.21Å; L48-I103 HydrophobicContact CG-CD1 4.4Å; L48-L111 HydrophobicContact CD2-CD1 3.5Å; L48-L111 VanDerWaalsContact CD2-CD1 3.5Å
49S97.4Very high96.9Very high33 Ų3341.8 Ų41.823%0.23123%0.228CC..Hα-helixtrans-63.2-46.8178.5-171.60000112.6R45 N46 L47 K53 M127R45-S49 PolarHBondContact O-N 2.95Å; R45-S49 VanDerWaalsContact O-N 3.1Å; N46-S49 WeakPolarHBondContact O-CB 3.38Å; N46-S49 PolarHBondContact O-N 3.33Å; L47-S49 VanDerWaalsContact C-N 3.3Å; L47-S49 PolarHBondContact O-N 3.37Å; S49-K53 WeakPolarHBondContact O-CB 3.29Å; S49-K53 PolarHBondContact O-N 2.95Å; S49-M127 VanDerWaalsContact CA-CE 3.48Å; S49-M127 WeakPolarHBondContact OG-CE 3.43Å
50V97.7Very high97.2Very high46 Ų4640.7 Ų40.728%0.27922%0.222SC..Hα-helixtrans-61.5-45.1178.2169.80000110.9M24 N46 L47 K53 N54M24-V50 HydrophobicContact CE-CB 4.36Å; M24-V50 HydrophobicContact CE-CG1 4.24Å; M24-V50 HydrophobicContact SD-CG1 4.44Å; N46-V50 WeakPolarHBondContact O-CG2 3.34Å; N46-V50 PolarHBondContact O-N 2.87Å; L47-V50 PolarHBondContact O-N 2.98Å; V50-K53 PolarHBondContact O-N 3.22Å; V50-N54 WeakPolarHBondContact CG1-ND2 3.46Å; V50-N54 PolarHBondContact O-N 2.63Å; V50-N54 VanDerWaalsContact O-N 3.08Å; V50-N54 PolarHBondContact O-ND2 3.43Å
51A98.4Very high97.4Very high0 Ų042.6 Ų42.60%024%0.238CC..Hα-helixtrans-56.2-59.6179.700000111.3M24 V25 L47 L48 K53 N54 V55M24-A51 HydrophobicContact CB-CB 3.99Å; M24-A51 HydrophobicContact CE-CB 4.2Å; M24-A51 HydrophobicContact CG-CB 3.61Å; M24-A51 HydrophobicContact SD-CB 3.6Å; V25-A51 HydrophobicContact CG2-CB 3.79Å; L47-A51 WeakPolarHBondContact O-CB 3.25Å; L47-A51 PolarHBondContact O-N 3.44Å; L48-A51 PolarHBondContact O-N 2.98Å; A51-K53 PolarHBondContact O-N 2.92Å; A51-N54 PolarHBondContact O-N 3.37Å; A51-V55 WeakPolarHBondContact O-CG2 3.24Å; A51-V55 PolarHBondContact O-N 3.34Å
52Y98.6Very high97.5Very high3 Ų341.2 Ų41.21%0.01223%0.232CC..Hα-helixtrans-68.1-35.9-177.8-81.6-87.2000112.6V25 E29 L48 N54 V55 I56 I99 I103 L106 Y131V25-Y52 HydrophobicContact CG1-CD1 4.27Å; V25-Y52 HydrophobicContact CG1-CD2 4.39Å; V25-Y52 HydrophobicContact CG1-CE1 3.72Å; V25-Y52 HydrophobicContact CG1-CE2 3.87Å; V25-Y52 HydrophobicContact CG2-CD1 4.14Å; V25-Y52 HydrophobicContact CG2-CD2 4.1Å; V25-Y52 HydrophobicContact CG2-CE1 4.42Å; V25-Y52 HydrophobicContact CG2-CE2 4.38Å; V25-Y52 HydrophobicContact CG2-CG 3.98Å; E29-Y52 VanDerWaalsContact CD-OH 3.3Å; E29-Y52 HydrophobicContact CG-CE2 4.48Å; E29-Y52 VanDerWaalsContact CG-OH 3.24Å; E29-Y52 WeakPolarHBondContact CG-OH 3.37Å; E29-Y52 PolarHBondContact OE1-OH 3.26Å; L48-Y52 HydrophobicContact CD1-CD2 3.84Å; L48-Y52 HydrophobicContact CD1-CE2 3.62Å; L48-Y52 HydrophobicContact CG-CD2 4.32Å; L48-Y52 HydrophobicContact CG-CE2 4.48Å; L48-Y52 PolarHBondContact O-N 3.09Å; Y52-N54 VanDerWaalsContact C-N 3.31Å; Y52-N54 PolarHBondContact O-N 3Å; Y52-V55 PolarHBondContact O-N 3.38Å; Y52-I56 WeakPolarHBondContact O-CB 3.44Å; Y52-I56 VanDerWaalsContact O-CG2 3.23Å; Y52-I56 WeakPolarHBondContact O-CG2 3.3Å; Y52-I56 PolarHBondContact O-N 3.26Å; Y52-I99 HydrophobicContact CD1-CG2 3.98Å; Y52-I99 HydrophobicContact CE1-CG2 4.45Å; Y52-I103 HydrophobicContact CD1-CB 3.85Å; Y52-I103 HydrophobicContact CD1-CG2 4.23Å; Y52-I103 HydrophobicContact CD2-CB 4.38Å; Y52-I103 HydrophobicContact CD2-CD1 3.97Å; Y52-I103 HydrophobicContact CD2-CG1 4.38Å; Y52-I103 HydrophobicContact CE1-CB 3.67Å; Y52-I103 HydrophobicContact CE1-CG2 4.31Å; Y52-I103 HydrophobicContact CE2-CB 4.19Å; Y52-I103 HydrophobicContact CE2-CD1 3.82Å; Y52-I103 HydrophobicContact CE2-CG1 4.43Å; Y52-I103 HydrophobicContact CG-CB 4.2Å; Y52-I103 HydrophobicContact CG-CG1 4.44Å; Y52-L106 HydrophobicContact CE2-CD1 4.36Å; Y52-L106 WeakPolarHBondContact OH-CD1 3.46Å; Y52-Y131 VanDerWaalsContact C-OH 3.29Å; Y52-Y131 WeakPolarHBondContact CB-OH 3.47Å
53K97.7Very high97.8Very high139 Ų13939.5 Ų39.560%0.60422%0.217SC*.Hα-helixtrans-60.7-40.3178.9-177.1179.7178.1-174.30111.8S49 V50 A51 G57 Y131S49-K53 WeakPolarHBondContact O-CB 3.29Å; S49-K53 PolarHBondContact O-N 2.95Å; V50-K53 PolarHBondContact O-N 3.22Å; A51-K53 PolarHBondContact O-N 2.92Å; K53-G57 WeakPolarHBondContact O-CA 3.06Å; K53-G57 PolarHBondContact O-N 2.99Å; K53-Y131 PolarHBondContact N-OH 3.37Å
54N98Very high97.9Very high60 Ų6039.9 Ų39.932%0.32121%0.214SC..Hα-helixtrans-69.2-47.5177.7-81.1-71000111.7Y21 V50 A51 Y52 G57 A58Y21-N54 HydrophobicContact CD1-CB 3.5Å; Y21-N54 HydrophobicContact CD2-CB 3.62Å; Y21-N54 HydrophobicContact CE1-CB 3.85Å; Y21-N54 VanDerWaalsContact CE1-CG 3.49Å; Y21-N54 WeakPolarHBondContact CE1-ND2 3.13Å; Y21-N54 HydrophobicContact CE2-CB 3.96Å; Y21-N54 HydrophobicContact CG-CB 3.36Å; V50-N54 WeakPolarHBondContact CG1-ND2 3.46Å; V50-N54 PolarHBondContact O-N 2.63Å; V50-N54 VanDerWaalsContact O-N 3.08Å; V50-N54 PolarHBondContact O-ND2 3.43Å; A51-N54 PolarHBondContact O-N 3.37Å; Y52-N54 VanDerWaalsContact C-N 3.31Å; Y52-N54 PolarHBondContact O-N 3Å; N54-G57 PolarHBondContact O-N 2.94Å; N54-A58 PolarHBondContact O-N 2.91Å
55V98.4Very high98Very high12 Ų1244 Ų447%0.07324%0.235CC..Hα-helixtrans-61-50.2179.6178.70000111.3Y21 E22 V25 A51 Y52 G57 R59 I99Y21-V55 VanDerWaalsContact C-CG2 3.45Å; Y21-V55 WeakPolarHBondContact O-CG2 3.5Å; E22-V55 HydrophobicContact CG-CG1 4.39Å; E22-V55 HydrophobicContact CG-CG2 4.22Å; V25-V55 HydrophobicContact CG2-CB 4.5Å; V25-V55 HydrophobicContact CG2-CG2 3.83Å; A51-V55 WeakPolarHBondContact O-CG2 3.24Å; A51-V55 PolarHBondContact O-N 3.34Å; Y52-V55 PolarHBondContact O-N 3.38Å; V55-G57 VanDerWaalsContact C-N 3.32Å; V55-G57 PolarHBondContact O-N 3.02Å; V55-R59 PolarHBondContact O-N 3.47Å; V55-I99 HydrophobicContact CG1-CD1 3.7Å; V55-I99 HydrophobicContact CG1-CG1 4.06Å; V55-I99 HydrophobicContact CG1-CG2 4.43Å
56I98.3Very high98.1Very high1 Ų145 Ų451%0.00524%0.241CC..Hα-helixtrans-67.5-34.6179.1-160.473.8000111.4Y52 R59 R60 L96 I99 Y131 Y134Y52-I56 WeakPolarHBondContact O-CB 3.44Å; Y52-I56 VanDerWaalsContact O-CG2 3.23Å; Y52-I56 WeakPolarHBondContact O-CG2 3.3Å; Y52-I56 PolarHBondContact O-N 3.26Å; I56-R59 PolarHBondContact O-N 2.69Å; I56-R60 HydrophobicContact CG1-CG 4.24Å; I56-R60 WeakPolarHBondContact O-CB 3.28Å; I56-R60 VanDerWaalsContact O-CG 3.28Å; I56-R60 WeakPolarHBondContact O-CG 3.29Å; I56-R60 PolarHBondContact O-N 3.06Å; I56-L96 HydrophobicContact CD1-CD2 3.55Å; I56-L96 HydrophobicContact CG1-CD2 4.23Å; I56-I99 HydrophobicContact CB-CG2 4.12Å; I56-I99 HydrophobicContact CD1-CB 3.82Å; I56-I99 HydrophobicContact CD1-CD1 4.27Å; I56-I99 HydrophobicContact CD1-CG2 3.65Å; I56-I99 HydrophobicContact CG1-CG2 4.44Å; I56-Y131 HydrophobicContact CB-CE1 4.07Å; I56-Y131 HydrophobicContact CG1-CE1 4.13Å; I56-Y131 HydrophobicContact CG2-CE1 3.97Å; I56-Y134 HydrophobicContact CG1-CD2 3.86Å; I56-Y134 HydrophobicContact CG1-CE2 4.39Å; I56-Y134 HydrophobicContact CG1-CG 4.44Å; I56-Y134 HydrophobicContact CG2-CD2 4.29Å; I56-Y134 HydrophobicContact CG2-CE2 3.98Å
57G98.1Very high98.2Very high28 Ų2841.9 Ų41.929%0.28923%0.225SC..Hα-helixtrans-60.1-49.2178.100000112.4K53 N54 V55 R59 R60 A61K53-G57 WeakPolarHBondContact O-CA 3.06Å; K53-G57 PolarHBondContact O-N 2.99Å; N54-G57 PolarHBondContact O-N 2.94Å; V55-G57 VanDerWaalsContact C-N 3.32Å; V55-G57 PolarHBondContact O-N 3.02Å; G57-R59 VanDerWaalsContact C-N 3.35Å; G57-R59 PolarHBondContact O-N 2.99Å; G57-R60 PolarHBondContact O-N 3.23Å; G57-A61 WeakPolarHBondContact O-CB 3.24Å; G57-A61 PolarHBondContact O-N 3.3Å
58A97.9Very high98.2Very high50 Ų5043.5 Ų43.541%0.41324%0.238SC..Hα-helixtrans-62-40.9177.900000112.4N54 S62N54-A58 PolarHBondContact O-N 2.91Å; A58-S62 PolarHBondContact O-N 3.18Å; A58-S62 PolarHBondContact O-OG 2.65Å
59R98.3Very high98.2Very high73 Ų7346.8 Ų46.828%0.27526%0.255SS..Hα-helixtrans-69.9-39.9177.5-69.6-59.4-172.2-87.6-0.9113V55 I56 G57 A61 S62 W63 E95 L96 I99V55-R59 PolarHBondContact O-N 3.47Å; I56-R59 PolarHBondContact O-N 2.69Å; G57-R59 VanDerWaalsContact C-N 3.35Å; G57-R59 PolarHBondContact O-N 2.99Å; R59-A61 PolarHBondContact O-N 3.29Å; R59-S62 WeakPolarHBondContact O-CB 3.5Å; R59-S62 PolarHBondContact O-N 3.26Å; R59-W63 WeakPolarHBondContact O-CB 3.36Å; R59-W63 PolarHBondContact O-N 3.03Å; R59-E95 IonicContact CZ-OE2 2.9Å; R59-E95 IonicContact NE-OE2 3.31Å; R59-E95 PolarHBondContact NE-OE2 2.86Å; R59-E95 IonicContact NH2-OE2 3.09Å; R59-E95 PolarHBondContact NH2-OE2 3.33Å; R59-L96 HydrophobicContact CB-CD2 3.5Å; R59-L96 VanDerWaalsContact CB-CD2 3.5Å; R59-L96 HydrophobicContact CB-CG 4.04Å; R59-I99 HydrophobicContact CB-CD1 4.32Å; R59-I99 HydrophobicContact CG-CD1 3.81Å
60R98.4Very high98.2Very high33 Ų3345.6 Ų45.613%0.12525%0.246CC..Hα-helixtrans-63.9-40.5174.6-74.7173.966-133.48111.8I56 G57 W63 R64 L96 Y134 E137I56-R60 HydrophobicContact CG1-CG 4.24Å; I56-R60 WeakPolarHBondContact O-CB 3.28Å; I56-R60 VanDerWaalsContact O-CG 3.28Å; I56-R60 WeakPolarHBondContact O-CG 3.29Å; I56-R60 PolarHBondContact O-N 3.06Å; G57-R60 PolarHBondContact O-N 3.23Å; R60-W63 PolarHBondContact O-N 2.9Å; R60-R64 WeakPolarHBondContact O-CG 3.31Å; R60-R64 PolarHBondContact O-N 3.33Å; R60-L96 HydrophobicContact CG-CD2 3.74Å; R60-Y134 VanDerWaalsContact CZ-CD1 3.49Å; R60-Y134 VanDerWaalsContact CZ-CE1 3.45Å; R60-E137 IonicContact CZ-OE1 2.61Å; R60-E137 IonicContact CZ-OE2 3.58Å; R60-E137 VanDerWaalsContact CZ-OE2 3.31Å; R60-E137 IonicContact NE-OE1 2.72Å; R60-E137 IonicContact NE-OE2 2.75Å; R60-E137 PolarHBondContact NE-OE2 3.32Å; R60-E137 VanDerWaalsContact NH2-CD 3.26Å; R60-E137 IonicContact NH2-OE1 3.58Å; R60-E137 PolarHBondContact NH2-OE1 2.9Å; R60-E137 IonicContact NH2-OE2 3.97Å; R60-E137 PolarHBondContact NH2-OE2 2.99Å
61A98.4Very high98.2Very high45 Ų4549.6 Ų49.637%0.37226%0.261SS..Hα-helixtrans-61.4-45.6174.400000111.5G57 R59 W63 R64 I65G57-A61 WeakPolarHBondContact O-CB 3.24Å; G57-A61 PolarHBondContact O-N 3.3Å; R59-A61 PolarHBondContact O-N 3.29Å; A61-W63 PolarHBondContact O-N 3.48Å; A61-R64 PolarHBondContact O-N 3.39Å; A61-I65 WeakPolarHBondContact O-CG1 3.41Å; A61-I65 PolarHBondContact O-N 3.4Å; A61-I65 VanDerWaalsContact O-N 3.12Å
62S98.4Very high98.2Very high47 Ų4755.1 Ų55.133%0.32929%0.285SS..Hα-helixtrans-59.4-46.9176-56.90000111.4A58 R59 R64 I65 I66A58-S62 PolarHBondContact O-N 3.18Å; A58-S62 PolarHBondContact O-OG 2.65Å; R59-S62 WeakPolarHBondContact O-CB 3.5Å; R59-S62 PolarHBondContact O-N 3.26Å; S62-R64 PolarHBondContact O-N 3.3Å; S62-I65 PolarHBondContact O-N 3.03Å; S62-I66 WeakPolarHBondContact O-CG1 3.43Å; S62-I66 PolarHBondContact O-N 2.91Å
63W98.7Very high98.1Very high40 Ų4056.1 Ų56.115%0.15229%0.29CS..Hα-helixtrans-58.7-47.9177.9-178.781.8000112R59 R60 A61 I65 I66 S67 I92 E93 L96 E137 F138R59-W63 WeakPolarHBondContact O-CB 3.36Å; R59-W63 PolarHBondContact O-N 3.03Å; R60-W63 PolarHBondContact O-N 2.9Å; A61-W63 PolarHBondContact O-N 3.48Å; W63-I65 VanDerWaalsContact C-N 3.32Å; W63-I65 PolarHBondContact O-N 3.16Å; W63-I66 PolarHBondContact O-N 2.91Å; W63-S67 WeakPolarHBondContact O-CB 3.46Å; W63-S67 PolarHBondContact O-N 3.49Å; W63-S67 PolarHBondContact O-OG 3.08Å; W63-S67 VanDerWaalsContact O-OG 3.04Å; W63-I92 HydrophobicContact CB-CG2 3.79Å; W63-E93 VanDerWaalsContact NE1-CG 3.35Å; W63-E93 PolarHBondContact NE1-OE1 3.26Å; W63-L96 HydrophobicContact CB-CD1 3.83Å; W63-L96 HydrophobicContact CG-CD1 3.98Å; W63-E137 WeakPolarHBondContact CH2-O 3.46Å; W63-F138 HydrophobicContact CD2-CB 4.15Å; W63-F138 VanDerWaalsContact CE2-CB 3.44Å; W63-F138 HydrophobicContact CH2-CB 3.93Å; W63-F138 HydrophobicContact CZ2-CB 3.34Å
64R98.3Very high98.1Very high111 Ų11153.5 Ų53.542%0.41928%0.28SS..Hα-helixtrans-58.1-42.4177.5-72.9-175.1-175.51002.7112.9R60 A61 S62 S68 E137R60-R64 WeakPolarHBondContact O-CG 3.31Å; R60-R64 PolarHBondContact O-N 3.33Å; A61-R64 PolarHBondContact O-N 3.39Å; S62-R64 PolarHBondContact O-N 3.3Å; R64-S68 WeakPolarHBondContact O-CB 3.43Å; R64-S68 PolarHBondContact O-N 3.31Å; R64-E137 IonicContact NH2-OE2 3.29Å
65I98.5Very high98Very high103 Ų10355.3 Ų55.353%0.52830%0.297SS..Hα-helixtrans-62.8-49.4178.7-68.3165.7000110A61 S62 W63 S68 I69A61-I65 WeakPolarHBondContact O-CG1 3.41Å; A61-I65 PolarHBondContact O-N 3.4Å; A61-I65 VanDerWaalsContact O-N 3.12Å; S62-I65 PolarHBondContact O-N 3.03Å; W63-I65 VanDerWaalsContact C-N 3.32Å; W63-I65 PolarHBondContact O-N 3.16Å; I65-S68 PolarHBondContact O-N 3.43Å; I65-I69 HydrophobicContact CG2-CD1 3.91Å; I65-I69 WeakPolarHBondContact O-CG1 3.34Å; I65-I69 PolarHBondContact O-N 3Å
66I98.5Very high98Very high30 Ų3062.7 Ų62.715%0.15432%0.324CS..Hα-helixtrans-64.6-44.5-178.9-63.7-53.3000111.1S62 W63 S68 I69 E70 I85 Y88 R89 I92S62-I66 WeakPolarHBondContact O-CG1 3.43Å; S62-I66 PolarHBondContact O-N 2.91Å; W63-I66 PolarHBondContact O-N 2.91Å; I66-S68 VanDerWaalsContact C-N 3.28Å; I66-S68 PolarHBondContact O-N 3.32Å; I66-I69 HydrophobicContact CD1-CD1 4.4Å; I66-I69 PolarHBondContact O-N 3.22Å; I66-I69 VanDerWaalsContact O-N 3.13Å; I66-E70 PolarHBondContact O-N 3.2Å; I66-I85 HydrophobicContact CG2-CG2 3.81Å; I66-Y88 HydrophobicContact CD1-CD1 3.97Å; I66-Y88 HydrophobicContact CD1-CE1 3.99Å; I66-Y88 HydrophobicContact CG1-CD1 4.03Å; I66-Y88 HydrophobicContact CG1-CE1 4.1Å; I66-Y88 HydrophobicContact CG2-CD1 4.34Å; I66-R89 HydrophobicContact CG2-CB 3.85Å; I66-R89 HydrophobicContact CG2-CG 4.31Å; I66-I92 HydrophobicContact CB-CD1 4.26Å; I66-I92 HydrophobicContact CG1-CD1 3.66Å
67S98Very high97.9Very high14 Ų1464.9 Ų64.910%0.09835%0.347CS..Hα-helixtrans-59.8-37.3174.8-60.80000112.3W63 E70 Q71 R89W63-S67 WeakPolarHBondContact O-CB 3.46Å; W63-S67 PolarHBondContact O-N 3.49Å; W63-S67 PolarHBondContact O-OG 3.08Å; W63-S67 VanDerWaalsContact O-OG 3.04Å; S67-E70 WeakPolarHBondContact O-CB 3.38Å; S67-E70 PolarHBondContact O-N 2.87Å; S67-Q71 WeakPolarHBondContact O-CG 3.46Å; S67-Q71 PolarHBondContact O-N 3.23Å; S67-Q71 VanDerWaalsContact O-N 3.11Å; S67-R89 WeakPolarHBondContact OG-CD 3.4Å
68S98.1Very high97.8Very high45 Ų4566.6 Ų66.632%0.31535%0.349SS..Hα-helixtrans-68.4-37.3175.2-176.10000112.7R64 I65 I66 K72R64-S68 WeakPolarHBondContact O-CB 3.43Å; R64-S68 PolarHBondContact O-N 3.31Å; I65-S68 PolarHBondContact O-N 3.43Å; I66-S68 VanDerWaalsContact C-N 3.28Å; I66-S68 PolarHBondContact O-N 3.32Å; S68-K72 WeakPolarHBondContact O-CG 3.34Å; S68-K72 PolarHBondContact O-N 3.27Å
69I98.4Very high97.7Very high70 Ų7070 Ų7036%0.35936%0.361SS..Hα-helixtrans-67.7-42.4175.8-66.3166.8000110.2I65 I66 Q71 K72 E73 I85I65-I69 HydrophobicContact CG2-CD1 3.91Å; I65-I69 WeakPolarHBondContact O-CG1 3.34Å; I65-I69 PolarHBondContact O-N 3Å; I66-I69 HydrophobicContact CD1-CD1 4.4Å; I66-I69 PolarHBondContact O-N 3.22Å; I66-I69 VanDerWaalsContact O-N 3.13Å; I69-Q71 PolarHBondContact O-N 3.44Å; I69-K72 PolarHBondContact O-N 3.04Å; I69-E73 HydrophobicContact CG2-CG 4.4Å; I69-E73 PolarHBondContact O-N 3.38Å; I69-I85 HydrophobicContact CG2-CD1 3.92Å
70E97.9Very high97.6Very high8 Ų873.1 Ų73.14%0.03738%0.383CS..Hα-helixtrans-54.3-53.1174.9-170.4-177.5157.700111.4I66 S67 K72 E73 E74 I85 K86 R89I66-E70 PolarHBondContact O-N 3.2Å; S67-E70 WeakPolarHBondContact O-CB 3.38Å; S67-E70 PolarHBondContact O-N 2.87Å; E70-K72 VanDerWaalsContact C-N 3.25Å; E70-K72 PolarHBondContact O-N 3.17Å; E70-E73 PolarHBondContact O-N 3.46Å; E70-E73 VanDerWaalsContact O-N 3.14Å; E70-E74 WeakPolarHBondContact O-CB 3.07Å; E70-E74 WeakPolarHBondContact O-CG 3.35Å; E70-E74 PolarHBondContact O-N 3.43Å; E70-I85 HydrophobicContact CB-CG2 3.58Å; E70-I85 HydrophobicContact CG-CG2 4.05Å; E70-K86 HydrophobicContact CG-CG 4.34Å; E70-K86 WeakPolarHBondContact OE1-CE 3.12Å; E70-K86 WeakPolarHBondContact OE1-CG 3.49Å; E70-R89 IonicContact OE1-CZ 2.69Å; E70-R89 IonicContact OE1-NH1 3.33Å; E70-R89 PolarHBondContact OE1-NH1 3.17Å; E70-R89 IonicContact OE1-NH2 3.78Å; E70-R89 VanDerWaalsContact OE2-CD 3.3Å; E70-R89 WeakPolarHBondContact OE2-CD 3.24Å; E70-R89 IonicContact OE2-CZ 3.95Å; E70-R89 VanDerWaalsContact OE2-CZ 3.29Å; E70-R89 IonicContact OE2-NE 2.77Å; E70-R89 IonicContact OE2-NH1 3.74Å; E70-R89 PolarHBondContact OE2-NH1 3.1Å
71Q97Very high97.5Very high129 Ų12976.4 Ų76.460%0.60340%0.399SS*.Hα-helixtrans-57.7-38.4179-72.6173.7-4.400112.3S67 I69 S75S67-Q71 WeakPolarHBondContact O-CG 3.46Å; S67-Q71 PolarHBondContact O-N 3.23Å; S67-Q71 VanDerWaalsContact O-N 3.11Å; I69-Q71 PolarHBondContact O-N 3.44Å; Q71-S75 WeakPolarHBondContact O-CB 3.42Å; Q71-S75 PolarHBondContact O-N 2.82Å
72K97.7Very high97.5Very high116 Ų11674.6 Ų74.650%0.50438%0.384SS..Hα-helixtrans-67.6-43.7177.2-73.9170.7-176.3169.80111.9S68 I69 E70 S75 R76S68-K72 WeakPolarHBondContact O-CG 3.34Å; S68-K72 PolarHBondContact O-N 3.27Å; I69-K72 PolarHBondContact O-N 3.04Å; E70-K72 VanDerWaalsContact C-N 3.25Å; E70-K72 PolarHBondContact O-N 3.17Å; K72-S75 PolarHBondContact O-N 3.09Å; K72-S75 PolarHBondContact O-OG 3.13Å; K72-R76 WeakPolarHBondContact O-CG 3.4Å; K72-R76 PolarHBondContact O-N 3.05Å
73E98Very high97.5Very high24 Ų2475.6 Ų75.611%0.11239%0.391CS..Hα-helixtrans-70.8-35.5178.5-67.7-61.4115.700111.9I69 E70 S75 R76 G77 N78 H81 V82 I85I69-E73 HydrophobicContact CG2-CG 4.4Å; I69-E73 PolarHBondContact O-N 3.38Å; E70-E73 PolarHBondContact O-N 3.46Å; E70-E73 VanDerWaalsContact O-N 3.14Å; E73-S75 PolarHBondContact O-N 3.42Å; E73-R76 PolarHBondContact O-N 2.96Å; E73-R76 VanDerWaalsContact O-N 3.14Å; E73-R76 IonicContact OE1-CZ 3.39Å; E73-R76 IonicContact OE1-NH1 3.44Å; E73-R76 PolarHBondContact OE1-NH1 2.95Å; E73-G77 PolarHBondContact O-N 3.19Å; E73-N78 HydrophobicContact CB-CB 4.44Å; E73-N78 PolarHBondContact O-N 3.33Å; E73-N78 VanDerWaalsContact O-N 3.16Å; E73-N78 PolarHBondContact OE2-ND2 2.82Å; E73-H81 IonicContact OE2-CG 3.7Å; E73-H81 IonicContact OE2-ND1 2.99Å; E73-H81 PolarHBondContact OE2-ND1 3.5Å; E73-H81 VanDerWaalsContact OE2-ND1 3.15Å; E73-V82 HydrophobicContact CB-CG2 3.92Å; E73-I85 HydrophobicContact CB-CD1 4.02Å; E73-I85 HydrophobicContact CG-CD1 3.75Å
74E96.7Very high97.5Very high84 Ų8479.1 Ų79.139%0.39341%0.411SS..Hα-helixtrans-59.3-45170.4-76.7-174155.900111.2E70 R76 G77 V82 K86E70-E74 WeakPolarHBondContact O-CB 3.07Å; E70-E74 WeakPolarHBondContact O-CG 3.35Å; E70-E74 PolarHBondContact O-N 3.43Å; E74-R76 PolarHBondContact O-N 3.23Å; E74-R76 VanDerWaalsContact O-N 3.13Å; E74-G77 PolarHBondContact O-N 2.86Å; E74-V82 HydrophobicContact CB-CG2 4.23Å; E74-V82 HydrophobicContact CG-CB 4.19Å; E74-V82 HydrophobicContact CG-CG1 3.53Å; E74-V82 HydrophobicContact CG-CG2 3.52Å; E74-K86 WeakPolarHBondContact OE1-CE 3.32Å; E74-K86 IonicContact OE1-NZ 3.89Å; E74-K86 PolarHBondContact OE1-NZ 3.23Å
75S97Very high97.5Very high98 Ų9875.1 Ų75.169%0.68540%0.398SS*.Hα-helixtrans-63.6-19.2177.676.40000114.2Q71 K72 E73Q71-S75 WeakPolarHBondContact O-CB 3.42Å; Q71-S75 PolarHBondContact O-N 2.82Å; K72-S75 PolarHBondContact O-N 3.09Å; K72-S75 PolarHBondContact O-OG 3.13Å; E73-S75 PolarHBondContact O-N 3.42Å
76R97Very high97.5Very high167 Ų16774.2 Ų74.263%0.6339%0.39SS*.THydrogen-bonded Turntrans-93.3-8.3177.1-68.3168.5177.8177.7-5.4113K72 E73 E74 N78K72-R76 WeakPolarHBondContact O-CG 3.4Å; K72-R76 PolarHBondContact O-N 3.05Å; E73-R76 PolarHBondContact O-N 2.96Å; E73-R76 VanDerWaalsContact O-N 3.14Å; E73-R76 IonicContact OE1-CZ 3.39Å; E73-R76 IonicContact OE1-NH1 3.44Å; E73-R76 PolarHBondContact OE1-NH1 2.95Å; E74-R76 PolarHBondContact O-N 3.23Å; E74-R76 VanDerWaalsContact O-N 3.13Å; R76-N78 VanDerWaalsContact C-N 3.32Å
77G96Very high97.5Very high48 Ų4878.4 Ų78.450%0.49541%0.413SS..THydrogen-bonded Turntrans71.324.9-174.900000113.8E73 E74 D79E73-G77 PolarHBondContact O-N 3.19Å; E74-G77 PolarHBondContact O-N 2.86Å; G77-D79 VanDerWaalsContact C-N 3.26Å; G77-D79 PolarHBondContact O-N 3.22Å; G77-D79 VanDerWaalsContact O-N 3.07Å
78N95.8Very high97.5Very high63 Ų6383.9 Ų83.934%0.33743%0.432SS..  trans-85.163.8-179.8-71.4-17.7000111.2E73 R76 D80 H81 V82E73-N78 HydrophobicContact CB-CB 4.44Å; E73-N78 PolarHBondContact O-N 3.33Å; E73-N78 VanDerWaalsContact O-N 3.16Å; E73-N78 PolarHBondContact OE2-ND2 2.82Å; R76-N78 VanDerWaalsContact C-N 3.32Å; N78-D80 VanDerWaalsContact C-N 3.27Å; N78-D80 PolarHBondContact O-N 3.49Å; N78-D80 VanDerWaalsContact O-N 3.14Å; N78-H81 HydrophobicContact CB-CB 4.22Å; N78-H81 PolarHBondContact O-N 3.02Å; N78-V82 WeakPolarHBondContact O-CG2 3.24Å; N78-V82 PolarHBondContact O-N 2.96Å
79D95.6Very high97.5Very high123 Ų12384.8 Ų84.866%0.65843%0.429SS*.Hα-helixtrans-53.9-38.5-169.5-66.9-24.9000114G77 V82 S83G77-D79 VanDerWaalsContact C-N 3.26Å; G77-D79 PolarHBondContact O-N 3.22Å; G77-D79 VanDerWaalsContact O-N 3.07Å; D79-V82 PolarHBondContact O-N 3.37Å; D79-S83 PolarHBondContact O-N 2.85Å
80D96.5Very high97.5Very high137 Ų13782.7 Ų82.773%0.73342%0.424SS*.Hα-helixtrans-62.6-43.8177.4-70.9-19.4000112N78 S83 I84N78-D80 VanDerWaalsContact C-N 3.27Å; N78-D80 PolarHBondContact O-N 3.49Å; N78-D80 VanDerWaalsContact O-N 3.14Å; D80-S83 PolarHBondContact O-N 2.87Å; D80-I84 WeakPolarHBondContact O-CG1 3.49Å; D80-I84 PolarHBondContact O-N 2.97Å
81H97.7Very high97.6Very high103 Ų10388.1 Ų88.148%0.47745%0.448SS..Hα-helixtrans-68-41175.8-70.9175.1000111.2E73 N78 S83 I84 I85E73-H81 IonicContact OE2-CG 3.7Å; E73-H81 IonicContact OE2-ND1 2.99Å; E73-H81 PolarHBondContact OE2-ND1 3.5Å; E73-H81 VanDerWaalsContact OE2-ND1 3.15Å; N78-H81 HydrophobicContact CB-CB 4.22Å; N78-H81 PolarHBondContact O-N 3.02Å; H81-S83 VanDerWaalsContact C-N 3.27Å; H81-S83 PolarHBondContact O-N 3.43Å; H81-I84 PolarHBondContact O-N 2.96Å; H81-I84 VanDerWaalsContact O-N 3.16Å; H81-I85 HydrophobicContact CB-CD1 4.38Å; H81-I85 WeakPolarHBondContact O-CD1 3.28Å; H81-I85 WeakPolarHBondContact O-CG1 3.17Å; H81-I85 PolarHBondContact O-N 2.97Å
82V98.3Very high97.6Very high7 Ų782.3 Ų82.34%0.04242%0.421CS..Hα-helixtrans-57.5-42.8178.4171.40000110.6E73 E74 N78 D79 I84 I85 K86E73-V82 HydrophobicContact CB-CG2 3.92Å; E74-V82 HydrophobicContact CB-CG2 4.23Å; E74-V82 HydrophobicContact CG-CB 4.19Å; E74-V82 HydrophobicContact CG-CG1 3.53Å; E74-V82 HydrophobicContact CG-CG2 3.52Å; N78-V82 WeakPolarHBondContact O-CG2 3.24Å; N78-V82 PolarHBondContact O-N 2.96Å; D79-V82 PolarHBondContact O-N 3.37Å; V82-I84 PolarHBondContact O-N 3.28Å; V82-I85 PolarHBondContact O-N 3.08Å; V82-K86 HydrophobicContact CG1-CD 3.99Å; V82-K86 HydrophobicContact CG1-CG 4.45Å; V82-K86 WeakPolarHBondContact O-CB 3.49Å; V82-K86 WeakPolarHBondContact O-CG 3.4Å; V82-K86 PolarHBondContact O-N 3.46Å
83S97.9Very high97.7Very high68 Ų6878.7 Ų78.748%0.47641%0.406SS..Hα-helixtrans-60-46.6176.6-167.40000112.1D79 D80 H81 I85 K86 D87D79-S83 PolarHBondContact O-N 2.85Å; D80-S83 PolarHBondContact O-N 2.87Å; H81-S83 VanDerWaalsContact C-N 3.27Å; H81-S83 PolarHBondContact O-N 3.43Å; S83-I85 VanDerWaalsContact C-N 3.32Å; S83-I85 PolarHBondContact O-N 2.93Å; S83-K86 PolarHBondContact O-N 3.41Å; S83-D87 PolarHBondContact O-N 3.36Å; S83-D87 VanDerWaalsContact O-N 3.15Å
84I98.4Very high97.7Very high114 Ų11482.2 Ų82.259%0.58543%0.429SS*.Hα-helixtrans-62.7-41.6178.7-63.6167.2000110.9D80 H81 V82 D87 Y88D80-I84 WeakPolarHBondContact O-CG1 3.49Å; D80-I84 PolarHBondContact O-N 2.97Å; H81-I84 PolarHBondContact O-N 2.96Å; H81-I84 VanDerWaalsContact O-N 3.16Å; V82-I84 PolarHBondContact O-N 3.28Å; I84-D87 PolarHBondContact O-N 2.92Å; I84-Y88 PolarHBondContact O-N 3.42Å; I84-Y88 VanDerWaalsContact O-N 3.15Å
85I98.6Very high97.8Very high27 Ų2781.1 Ų81.114%0.13842%0.424CS..Hα-helixtrans-66.3-41.7180-65.8159.9000110.5I66 I69 E70 E73 H81 V82 S83 D87 Y88 R89I66-I85 HydrophobicContact CG2-CG2 3.81Å; I69-I85 HydrophobicContact CG2-CD1 3.92Å; E70-I85 HydrophobicContact CB-CG2 3.58Å; E70-I85 HydrophobicContact CG-CG2 4.05Å; E73-I85 HydrophobicContact CB-CD1 4.02Å; E73-I85 HydrophobicContact CG-CD1 3.75Å; H81-I85 HydrophobicContact CB-CD1 4.38Å; H81-I85 WeakPolarHBondContact O-CD1 3.28Å; H81-I85 WeakPolarHBondContact O-CG1 3.17Å; H81-I85 PolarHBondContact O-N 2.97Å; V82-I85 PolarHBondContact O-N 3.08Å; S83-I85 VanDerWaalsContact C-N 3.32Å; S83-I85 PolarHBondContact O-N 2.93Å; I85-D87 PolarHBondContact O-N 2.83Å; I85-Y88 PolarHBondContact O-N 2.84Å; I85-R89 WeakPolarHBondContact O-CB 3.43Å; I85-R89 PolarHBondContact O-N 2.75Å
86K98.2Very high97.9Very high83 Ų8376.5 Ų76.536%0.36139%0.392SS..Hα-helixtrans-58.8-45.1176.3-81.4175.3179.1166.80112E70 E74 V82 S83 Y88 R89 G90E70-K86 HydrophobicContact CG-CG 4.34Å; E70-K86 WeakPolarHBondContact OE1-CE 3.12Å; E70-K86 WeakPolarHBondContact OE1-CG 3.49Å; E74-K86 WeakPolarHBondContact OE1-CE 3.32Å; E74-K86 IonicContact OE1-NZ 3.89Å; E74-K86 PolarHBondContact OE1-NZ 3.23Å; V82-K86 HydrophobicContact CG1-CD 3.99Å; V82-K86 HydrophobicContact CG1-CG 4.45Å; V82-K86 WeakPolarHBondContact O-CB 3.49Å; V82-K86 WeakPolarHBondContact O-CG 3.4Å; V82-K86 PolarHBondContact O-N 3.46Å; S83-K86 PolarHBondContact O-N 3.41Å; K86-Y88 VanDerWaalsContact C-N 3.33Å; K86-Y88 PolarHBondContact O-N 3.21Å; K86-R89 PolarHBondContact O-N 3.09Å; K86-G90 PolarHBondContact O-N 2.85Å
87D98.3Very high97.9Very high119 Ų11969.3 Ų69.364%0.63637%0.366SS*.Hα-helixtrans-61.4-43.2177.1-71.1-17.6000111.4S83 I84 I85 G90 K91S83-D87 PolarHBondContact O-N 3.36Å; S83-D87 VanDerWaalsContact O-N 3.15Å; I84-D87 PolarHBondContact O-N 2.92Å; I85-D87 PolarHBondContact O-N 2.83Å; D87-G90 PolarHBondContact O-N 3.29Å; D87-K91 PolarHBondContact O-N 3.08Å; D87-K91 VanDerWaalsContact O-N 3.16Å
88Y98.6Very high98.1Very high129 Ų12974.9 Ų74.951%0.50638%0.377SS..Hα-helixtrans-68.6-40.2178-168.1-114000112.6I66 I84 I85 K86 G90 K91 I92I66-Y88 HydrophobicContact CD1-CD1 3.97Å; I66-Y88 HydrophobicContact CD1-CE1 3.99Å; I66-Y88 HydrophobicContact CG1-CD1 4.03Å; I66-Y88 HydrophobicContact CG1-CE1 4.1Å; I66-Y88 HydrophobicContact CG2-CD1 4.34Å; I84-Y88 PolarHBondContact O-N 3.42Å; I84-Y88 VanDerWaalsContact O-N 3.15Å; I85-Y88 PolarHBondContact O-N 2.84Å; K86-Y88 VanDerWaalsContact C-N 3.33Å; K86-Y88 PolarHBondContact O-N 3.21Å; Y88-G90 VanDerWaalsContact C-N 3.32Å; Y88-G90 PolarHBondContact O-N 2.92Å; Y88-K91 WeakPolarHBondContact O-CB 3.4Å; Y88-K91 PolarHBondContact O-N 3.26Å; Y88-I92 HydrophobicContact CD1-CD1 4.15Å; Y88-I92 HydrophobicContact CE1-CD1 3.9Å; Y88-I92 PolarHBondContact O-N 3.39Å
89R98.4Very high98.2Very high64 Ų6473.2 Ų73.224%0.24237%0.368CS..Hα-helixtrans-58.5-45.2172.7-168.5-169.569.8-156.3-7.5110.7I66 S67 E70 I85 K86 K91 I92 E93I66-R89 HydrophobicContact CG2-CB 3.85Å; I66-R89 HydrophobicContact CG2-CG 4.31Å; S67-R89 WeakPolarHBondContact OG-CD 3.4Å; E70-R89 IonicContact OE1-CZ 2.69Å; E70-R89 IonicContact OE1-NH1 3.33Å; E70-R89 PolarHBondContact OE1-NH1 3.17Å; E70-R89 IonicContact OE1-NH2 3.78Å; E70-R89 VanDerWaalsContact OE2-CD 3.3Å; E70-R89 WeakPolarHBondContact OE2-CD 3.24Å; E70-R89 IonicContact OE2-CZ 3.95Å; E70-R89 VanDerWaalsContact OE2-CZ 3.29Å; E70-R89 IonicContact OE2-NE 2.77Å; E70-R89 IonicContact OE2-NH1 3.74Å; E70-R89 PolarHBondContact OE2-NH1 3.1Å; I85-R89 WeakPolarHBondContact O-CB 3.43Å; I85-R89 PolarHBondContact O-N 2.75Å; K86-R89 PolarHBondContact O-N 3.09Å; R89-K91 VanDerWaalsContact C-N 3.26Å; R89-K91 PolarHBondContact O-N 3.3Å; R89-I92 WeakPolarHBondContact O-CA 3.39Å; R89-I92 WeakPolarHBondContact O-CB 3.4Å; R89-I92 PolarHBondContact O-N 3.1Å; R89-E93 WeakPolarHBondContact CD-OE1 3.4Å; R89-E93 HydrophobicContact CG-CG 4.45Å; R89-E93 WeakPolarHBondContact CG-OE1 3.4Å; R89-E93 IonicContact CZ-OE1 3.6Å; R89-E93 IonicContact NE-OE1 3.43Å; R89-E93 PolarHBondContact NE-OE1 3.35Å; R89-E93 WeakPolarHBondContact O-CG 3.38Å; R89-E93 PolarHBondContact O-N 3.27Å
90G98.4Very high98.3Very high25 Ų2567.3 Ų67.326%0.25834%0.337SS..Hα-helixtrans-59.4-34.3177.500000113.4K86 D87 Y88 E93 T94K86-G90 PolarHBondContact O-N 2.85Å; D87-G90 PolarHBondContact O-N 3.29Å; Y88-G90 VanDerWaalsContact C-N 3.32Å; Y88-G90 PolarHBondContact O-N 2.92Å; G90-E93 PolarHBondContact O-N 3Å; G90-T94 PolarHBondContact O-N 3.41Å; G90-T94 PolarHBondContact O-OG1 3.08Å
91K98.6Very high98.4Very high123 Ų12364.5 Ų64.554%0.53532%0.322SS..Hα-helixtrans-63.5-45.8171.3-174.2-178.3175-175.10111.8D87 Y88 R89 E93 T94 E95D87-K91 PolarHBondContact O-N 3.08Å; D87-K91 VanDerWaalsContact O-N 3.16Å; Y88-K91 WeakPolarHBondContact O-CB 3.4Å; Y88-K91 PolarHBondContact O-N 3.26Å; R89-K91 VanDerWaalsContact C-N 3.26Å; R89-K91 PolarHBondContact O-N 3.3Å; K91-E93 VanDerWaalsContact C-N 3.34Å; K91-E93 PolarHBondContact O-N 3.39Å; K91-T94 WeakPolarHBondContact O-CB 3.31Å; K91-T94 PolarHBondContact O-N 3.29Å; K91-E95 WeakPolarHBondContact CE-OE1 3.24Å; K91-E95 WeakPolarHBondContact O-CG 3.5Å; K91-E95 PolarHBondContact O-N 3.5Å; K91-E95 VanDerWaalsContact O-N 3.1Å
92I98.6Very high98.4Very high7 Ų760.5 Ų60.54%0.03631%0.308CS..Hα-helixtrans-63.7-41.6177.7-61.6171000110.8W63 I66 Y88 R89 T94 E95 L96W63-I92 HydrophobicContact CB-CG2 3.79Å; I66-I92 HydrophobicContact CB-CD1 4.26Å; I66-I92 HydrophobicContact CG1-CD1 3.66Å; Y88-I92 HydrophobicContact CD1-CD1 4.15Å; Y88-I92 HydrophobicContact CE1-CD1 3.9Å; Y88-I92 PolarHBondContact O-N 3.39Å; R89-I92 WeakPolarHBondContact O-CA 3.39Å; R89-I92 WeakPolarHBondContact O-CB 3.4Å; R89-I92 PolarHBondContact O-N 3.1Å; I92-T94 VanDerWaalsContact C-N 3.3Å; I92-T94 PolarHBondContact O-N 3.39Å; I92-E95 WeakPolarHBondContact O-CB 3.48Å; I92-E95 PolarHBondContact O-N 3.44Å; I92-E95 VanDerWaalsContact O-N 3.17Å; I92-L96 HydrophobicContact CG2-CD1 4.21Å; I92-L96 HydrophobicContact CG2-CG 4.44Å; I92-L96 WeakPolarHBondContact O-CG 3.47Å; I92-L96 PolarHBondContact O-N 3.45Å
93E98.7Very high98.4Very high40 Ų4060.2 Ų60.219%0.18731%0.306CS..Hα-helixtrans-61.1-39.1176.3-70.8171.2-179.400111.8W63 R89 G90 K91 E95 L96 S97 F138W63-E93 VanDerWaalsContact NE1-CG 3.35Å; W63-E93 PolarHBondContact NE1-OE1 3.26Å; R89-E93 WeakPolarHBondContact CD-OE1 3.4Å; R89-E93 HydrophobicContact CG-CG 4.45Å; R89-E93 WeakPolarHBondContact CG-OE1 3.4Å; R89-E93 IonicContact CZ-OE1 3.6Å; R89-E93 IonicContact NE-OE1 3.43Å; R89-E93 PolarHBondContact NE-OE1 3.35Å; R89-E93 WeakPolarHBondContact O-CG 3.38Å; R89-E93 PolarHBondContact O-N 3.27Å; G90-E93 PolarHBondContact O-N 3Å; K91-E93 VanDerWaalsContact C-N 3.34Å; K91-E93 PolarHBondContact O-N 3.39Å; E93-E95 VanDerWaalsContact C-N 3.35Å; E93-L96 PolarHBondContact O-N 2.7Å; E93-S97 WeakPolarHBondContact O-CB 3.44Å; E93-S97 PolarHBondContact O-N 3.3Å; E93-S97 PolarHBondContact O-OG 3.45Å; E93-F138 HydrophobicContact CB-CD2 3.83Å; E93-F138 HydrophobicContact CB-CE2 3.97Å; E93-F138 HydrophobicContact CG-CB 4.36Å; E93-F138 HydrophobicContact CG-CD2 3.67Å; E93-F138 HydrophobicContact CG-CE2 4.32Å; E93-F138 HydrophobicContact CG-CG 4.28Å
94T98.7Very high98.5Very high98 Ų9857.5 Ų57.560%0.60129%0.286SS*.Hα-helixtrans-63-42174.3-57.80000111.5G90 K91 I92 K98G90-T94 PolarHBondContact O-N 3.41Å; G90-T94 PolarHBondContact O-OG1 3.08Å; K91-T94 WeakPolarHBondContact O-CB 3.31Å; K91-T94 PolarHBondContact O-N 3.29Å; I92-T94 VanDerWaalsContact C-N 3.3Å; I92-T94 PolarHBondContact O-N 3.39Å; T94-K98 PolarHBondContact O-N 3.17Å
95E98.4Very high98.5Very high61 Ų6157.1 Ų57.129%0.28529%0.286SS..Hα-helixtrans-65.5-43176-67.8176.4-159.300111.7R59 K91 I92 E93 K98 I99R59-E95 IonicContact CZ-OE2 2.9Å; R59-E95 IonicContact NE-OE2 3.31Å; R59-E95 PolarHBondContact NE-OE2 2.86Å; R59-E95 IonicContact NH2-OE2 3.09Å; R59-E95 PolarHBondContact NH2-OE2 3.33Å; K91-E95 WeakPolarHBondContact CE-OE1 3.24Å; K91-E95 WeakPolarHBondContact O-CG 3.5Å; K91-E95 PolarHBondContact O-N 3.5Å; K91-E95 VanDerWaalsContact O-N 3.1Å; I92-E95 WeakPolarHBondContact O-CB 3.48Å; I92-E95 PolarHBondContact O-N 3.44Å; I92-E95 VanDerWaalsContact O-N 3.17Å; E93-E95 VanDerWaalsContact C-N 3.35Å; E95-K98 PolarHBondContact O-N 3.43Å; E95-I99 WeakPolarHBondContact O-CD1 3.45Å; E95-I99 VanDerWaalsContact O-CG1 3.3Å; E95-I99 WeakPolarHBondContact O-CG1 3.39Å; E95-I99 PolarHBondContact O-N 3.43Å; E95-I99 VanDerWaalsContact O-N 3.08Å
96L98.7Very high98.4Very high1 Ų156.1 Ų56.11%0.00528%0.28CS..Hα-helixtrans-58.9-49.1174.4-78.4170.4000111.8I56 R59 R60 W63 I92 E93 K98 I99 C100 F138I56-L96 HydrophobicContact CD1-CD2 3.55Å; I56-L96 HydrophobicContact CG1-CD2 4.23Å; R59-L96 HydrophobicContact CB-CD2 3.5Å; R59-L96 VanDerWaalsContact CB-CD2 3.5Å; R59-L96 HydrophobicContact CB-CG 4.04Å; R60-L96 HydrophobicContact CG-CD2 3.74Å; W63-L96 HydrophobicContact CB-CD1 3.83Å; W63-L96 HydrophobicContact CG-CD1 3.98Å; I92-L96 HydrophobicContact CG2-CD1 4.21Å; I92-L96 HydrophobicContact CG2-CG 4.44Å; I92-L96 WeakPolarHBondContact O-CG 3.47Å; I92-L96 PolarHBondContact O-N 3.45Å; E93-L96 PolarHBondContact O-N 2.7Å; L96-K98 VanDerWaalsContact C-N 3.33Å; L96-K98 PolarHBondContact O-N 3Å; L96-I99 PolarHBondContact O-N 2.88Å; L96-C100 PolarHBondContact O-N 3.45Å; L96-C100 PolarHBondContact O-SG 2.88Å; L96-F138 HydrophobicContact CB-CD1 4.45Å; L96-F138 HydrophobicContact CB-CE1 3.71Å; L96-F138 HydrophobicContact CB-CE2 4.4Å; L96-F138 HydrophobicContact CB-CZ 3.66Å; L96-F138 HydrophobicContact CD1-CD1 4Å; L96-F138 HydrophobicContact CD1-CE1 4.09Å; L96-F138 HydrophobicContact CD1-CG 4.43Å; L96-F138 HydrophobicContact CG-CE1 4.46Å
97S98.7Very high98.4Very high15 Ų1552.1 Ų52.111%0.10526%0.263CS..Hα-helixtrans-56.8-47.2176.5-79.10000111.2E93 I99 C100 D101 F138 K139E93-S97 WeakPolarHBondContact O-CB 3.44Å; E93-S97 PolarHBondContact O-N 3.3Å; E93-S97 PolarHBondContact O-OG 3.45Å; S97-I99 VanDerWaalsContact C-N 3.32Å; S97-I99 PolarHBondContact O-N 3.35Å; S97-C100 PolarHBondContact O-N 2.86Å; S97-D101 WeakPolarHBondContact O-CB 3.5Å; S97-D101 PolarHBondContact O-N 2.89Å; S97-F138 WeakPolarHBondContact OG-CZ 3.45Å; S97-K139 WeakPolarHBondContact OG-CE 3.41Å
98K98.5Very high98.3Very high166 Ų16650.1 Ų50.172%0.72225%0.252SS*.Hα-helixtrans-59.1-40.8178.9-173.2-178.4177.7-173.10112.9T94 E95 L96 G102T94-K98 PolarHBondContact O-N 3.17Å; E95-K98 PolarHBondContact O-N 3.43Å; L96-K98 VanDerWaalsContact C-N 3.33Å; L96-K98 PolarHBondContact O-N 3Å; K98-G102 PolarHBondContact O-N 2.91Å
99I98.6Very high98.2Very high27 Ų2747.3 Ų47.314%0.13825%0.252CS..Hα-helixtrans-66.1-47.5178.3-63.8155.7000110.3Y52 V55 I56 R59 E95 L96 S97 G102 I103Y52-I99 HydrophobicContact CD1-CG2 3.98Å; Y52-I99 HydrophobicContact CE1-CG2 4.45Å; V55-I99 HydrophobicContact CG1-CD1 3.7Å; V55-I99 HydrophobicContact CG1-CG1 4.06Å; V55-I99 HydrophobicContact CG1-CG2 4.43Å; I56-I99 HydrophobicContact CB-CG2 4.12Å; I56-I99 HydrophobicContact CD1-CB 3.82Å; I56-I99 HydrophobicContact CD1-CD1 4.27Å; I56-I99 HydrophobicContact CD1-CG2 3.65Å; I56-I99 HydrophobicContact CG1-CG2 4.44Å; R59-I99 HydrophobicContact CB-CD1 4.32Å; R59-I99 HydrophobicContact CG-CD1 3.81Å; E95-I99 WeakPolarHBondContact O-CD1 3.45Å; E95-I99 VanDerWaalsContact O-CG1 3.3Å; E95-I99 WeakPolarHBondContact O-CG1 3.39Å; E95-I99 PolarHBondContact O-N 3.43Å; E95-I99 VanDerWaalsContact O-N 3.08Å; L96-I99 PolarHBondContact O-N 2.88Å; S97-I99 VanDerWaalsContact C-N 3.32Å; S97-I99 PolarHBondContact O-N 3.35Å; I99-G102 PolarHBondContact O-N 3.41Å; I99-I103 PolarHBondContact O-N 3.35Å
100C98.7Very high98Very high0 Ų046 Ų460%025%0.248CC..Hα-helixtrans-59.8-47.1176.9-69.40000111.5L96 S97 G102 I103 L104 Y131 L135L96-C100 PolarHBondContact O-N 3.45Å; L96-C100 PolarHBondContact O-SG 2.88Å; S97-C100 PolarHBondContact O-N 2.86Å; C100-G102 VanDerWaalsContact C-N 3.29Å; C100-G102 PolarHBondContact O-N 2.77Å; C100-I103 VanDerWaalsContact O-CG2 3.28Å; C100-I103 WeakPolarHBondContact O-CG2 3.3Å; C100-I103 PolarHBondContact O-N 3.24Å; C100-L104 HydrophobicContact CB-CD1 4.42Å; C100-L104 VanDerWaalsContact O-CB 3.29Å; C100-L104 WeakPolarHBondContact O-CB 3.23Å; C100-L104 WeakPolarHBondContact O-CG 3.06Å; C100-L104 PolarHBondContact O-N 3.31Å; C100-Y131 HydrophobicContact CB-CD1 4.41Å; C100-L135 HydrophobicContact CB-CD1 4.12Å; C100-L135 HydrophobicContact CB-CD2 3.73Å; C100-L135 HydrophobicContact CB-CG 3.78Å
101D98.5Very high97.9Very high78 Ų7844.9 Ų44.942%0.41724%0.236SC..Hα-helixtrans-61.5-38.5-179.9-64.7-18000111.3S97 N105S97-D101 WeakPolarHBondContact O-CB 3.5Å; S97-D101 PolarHBondContact O-N 2.89Å; D101-N105 VanDerWaalsContact O-CB 3.25Å; D101-N105 WeakPolarHBondContact O-CB 3.33Å; D101-N105 PolarHBondContact O-N 3.45Å; D101-N105 PolarHBondContact O-ND2 3.12Å
102G97.7Very high97.8Very high19 Ų1941.1 Ų41.120%0.19622%0.223CC..Hα-helixtrans-57-54176.900000113K98 I99 C100 L106K98-G102 PolarHBondContact O-N 2.91Å; I99-G102 PolarHBondContact O-N 3.41Å; C100-G102 VanDerWaalsContact C-N 3.29Å; C100-G102 PolarHBondContact O-N 2.77Å; G102-L106 PolarHBondContact O-N 3.33Å
103I98.4Very high97.6Very high0 Ų045.1 Ų45.10%025%0.25CC..Hα-helixtrans-73-37.3-179.6-175.658.5000112.7L48 Y52 I99 C100 N105 L106 L107 M127 Y131L48-I103 HydrophobicContact CD2-CD1 4.21Å; L48-I103 HydrophobicContact CG-CD1 4.4Å; Y52-I103 HydrophobicContact CD1-CB 3.85Å; Y52-I103 HydrophobicContact CD1-CG2 4.23Å; Y52-I103 HydrophobicContact CD2-CB 4.38Å; Y52-I103 HydrophobicContact CD2-CD1 3.97Å; Y52-I103 HydrophobicContact CD2-CG1 4.38Å; Y52-I103 HydrophobicContact CE1-CB 3.67Å; Y52-I103 HydrophobicContact CE1-CG2 4.31Å; Y52-I103 HydrophobicContact CE2-CB 4.19Å; Y52-I103 HydrophobicContact CE2-CD1 3.82Å; Y52-I103 HydrophobicContact CE2-CG1 4.43Å; Y52-I103 HydrophobicContact CG-CB 4.2Å; Y52-I103 HydrophobicContact CG-CG1 4.44Å; I99-I103 PolarHBondContact O-N 3.35Å; C100-I103 VanDerWaalsContact O-CG2 3.28Å; C100-I103 WeakPolarHBondContact O-CG2 3.3Å; C100-I103 PolarHBondContact O-N 3.24Å; I103-N105 VanDerWaalsContact C-N 3.31Å; I103-N105 PolarHBondContact O-N 2.86Å; I103-L106 HydrophobicContact CD1-CB 4.47Å; I103-L106 PolarHBondContact O-N 2.97Å; I103-L107 HydrophobicContact CD1-CD1 4.42Å; I103-L107 HydrophobicContact CD1-CG 4.21Å; I103-L107 HydrophobicContact CG1-CD1 3.91Å; I103-L107 HydrophobicContact CG1-CG 4.22Å; I103-L107 WeakPolarHBondContact O-CB 3.34Å; I103-L107 VanDerWaalsContact O-CG 3.24Å; I103-L107 WeakPolarHBondContact O-CG 3.5Å; I103-L107 PolarHBondContact O-N 3.48Å; I103-M127 HydrophobicContact CD1-SD 3.86Å; I103-M127 HydrophobicContact CG1-CG 4.42Å; I103-M127 HydrophobicContact CG1-SD 3.95Å; I103-Y131 HydrophobicContact CB-CD2 4.44Å; I103-Y131 HydrophobicContact CB-CE2 4.48Å; I103-Y131 HydrophobicContact CG1-CD2 4.06Å; I103-Y131 HydrophobicContact CG1-CE2 3.99Å; I103-Y131 HydrophobicContact CG2-CD1 3.37Å; I103-Y131 HydrophobicContact CG2-CD2 3.49Å; I103-Y131 VanDerWaalsContact CG2-CD2 3.49Å; I103-Y131 HydrophobicContact CG2-CE1 3.68Å; I103-Y131 HydrophobicContact CG2-CE2 3.81Å; I103-Y131 HydrophobicContact CG2-CG 3.3Å
104L98.7Very high97.3Very high11 Ų1145.1 Ų45.16%0.05825%0.253CS..Hα-helixtrans-61.7-41.8176.7-71.6172.6000111C100 L107 D108 K128 L135C100-L104 HydrophobicContact CB-CD1 4.42Å; C100-L104 VanDerWaalsContact O-CB 3.29Å; C100-L104 WeakPolarHBondContact O-CB 3.23Å; C100-L104 WeakPolarHBondContact O-CG 3.06Å; C100-L104 PolarHBondContact O-N 3.31Å; L104-L107 PolarHBondContact O-N 3.39Å; L104-D108 WeakPolarHBondContact O-CB 3.43Å; L104-D108 PolarHBondContact O-N 3.29Å; L104-K128 HydrophobicContact CD2-CG 3.9Å; L104-L135 HydrophobicContact CD1-CD1 3.8Å
105N98.1Very high97.1Very high107 Ų10740.8 Ų40.857%0.57223%0.227SC*.Hα-helixtrans-62.2-43.9174.4-75.1-38.6000112D101 I103 D108 S109D101-N105 VanDerWaalsContact O-CB 3.25Å; D101-N105 WeakPolarHBondContact O-CB 3.33Å; D101-N105 PolarHBondContact O-N 3.45Å; D101-N105 PolarHBondContact O-ND2 3.12Å; I103-N105 VanDerWaalsContact C-N 3.31Å; I103-N105 PolarHBondContact O-N 2.86Å; N105-D108 PolarHBondContact O-N 3.2Å; N105-S109 WeakPolarHBondContact O-CB 3.28Å; N105-S109 PolarHBondContact O-N 3.41Å; N105-S109 PolarHBondContact O-OG 2.87Å
106L97.1Very high96.9Very high5 Ų541.4 Ų41.43%0.02624%0.238CC..Hα-helixtrans-62-42.4175.7-78.5175.2000112.6E29 A32 K33 Y52 G102 I103 D108 H110 L111E29-L106 HydrophobicContact CB-CD1 4.14Å; E29-L106 HydrophobicContact CG-CD1 3.81Å; A32-L106 HydrophobicContact CB-CD1 4.22Å; A32-L106 HydrophobicContact CB-CD2 4Å; K33-L106 HydrophobicContact CD-CD2 4.43Å; K33-L106 HydrophobicContact CG-CD2 3.81Å; Y52-L106 HydrophobicContact CE2-CD1 4.36Å; Y52-L106 WeakPolarHBondContact OH-CD1 3.46Å; G102-L106 PolarHBondContact O-N 3.33Å; I103-L106 HydrophobicContact CD1-CB 4.47Å; I103-L106 PolarHBondContact O-N 2.97Å; L106-D108 VanDerWaalsContact C-N 3.35Å; L106-H110 WeakPolarHBondContact O-CB 3.17Å; L106-H110 PolarHBondContact O-N 2.99Å; L106-L111 HydrophobicContact CB-CD1 4.43Å; L106-L111 PolarHBondContact O-N 3.13Å; L106-L111 VanDerWaalsContact O-N 3.1Å
107L98Very high96.7Very high0 Ų046.5 Ų46.50%027%0.265CS..Iπ-helixtrans-60.8-46.6177.9-72.3165.2000110.9I103 L104 L111 V112 Y124 M127 K128I103-L107 HydrophobicContact CD1-CD1 4.42Å; I103-L107 HydrophobicContact CD1-CG 4.21Å; I103-L107 HydrophobicContact CG1-CD1 3.91Å; I103-L107 HydrophobicContact CG1-CG 4.22Å; I103-L107 WeakPolarHBondContact O-CB 3.34Å; I103-L107 VanDerWaalsContact O-CG 3.24Å; I103-L107 WeakPolarHBondContact O-CG 3.5Å; I103-L107 PolarHBondContact O-N 3.48Å; L104-L107 PolarHBondContact O-N 3.39Å; L107-L111 HydrophobicContact CD2-CB 4.27Å; L107-L111 HydrophobicContact CD2-CD1 4.01Å; L107-L111 PolarHBondContact O-N 3.03Å; L107-V112 HydrophobicContact CB-CG2 4.28Å; L107-V112 VanDerWaalsContact O-CB 3.32Å; L107-V112 WeakPolarHBondContact O-CB 3.39Å; L107-V112 WeakPolarHBondContact O-CG2 3.44Å; L107-V112 PolarHBondContact O-N 2.74Å; L107-Y124 HydrophobicContact CD2-CD1 3.83Å; L107-Y124 HydrophobicContact CD2-CG 4.14Å; L107-M127 HydrophobicContact CD1-CB 4.28Å; L107-M127 HydrophobicContact CD1-CG 4.07Å; L107-M127 HydrophobicContact CD1-SD 4.48Å; L107-M127 HydrophobicContact CD2-CB 4.4Å; L107-M127 HydrophobicContact CD2-SD 4.29Å; L107-K128 HydrophobicContact CD1-CB 3.98Å
108D97.3Very high96.6Very high76 Ų7646.9 Ų46.941%0.40627%0.268SS..Iπ-helixtrans-76-36.7-174.6-74.3-4.1000113.4L104 N105 L106 P113 K128L104-D108 WeakPolarHBondContact O-CB 3.43Å; L104-D108 PolarHBondContact O-N 3.29Å; N105-D108 PolarHBondContact O-N 3.2Å; L106-D108 VanDerWaalsContact C-N 3.35Å; D108-P113 WeakPolarHBondContact O-CG 3.19Å; D108-K128 VanDerWaalsContact OD1-CE 3.3Å; D108-K128 WeakPolarHBondContact OD1-CE 3.42Å; D108-K128 IonicContact OD1-NZ 3.65Å; D108-K128 PolarHBondContact OD1-NZ 3Å; D108-K128 IonicContact OD2-NZ 2.74Å; D108-K128 PolarHBondContact OD2-NZ 3.3Å
109S95.3Very high96.5Very high71 Ų7141.9 Ų41.950%0.49725%0.247SC..Iπ-helixtrans-87.3-30.4-176.756.90000114.2N105N105-S109 WeakPolarHBondContact O-CB 3.28Å; N105-S109 PolarHBondContact O-N 3.41Å; N105-S109 PolarHBondContact O-OG 2.87Å
110H95.1Very high96.4Very high37 Ų3740.6 Ų40.617%0.17124%0.241CC..Iπ-helixtrans-127.6-48.8-169.3-64.3-72000113.7V35 D36 L106 T114V35-H110 HydrophobicContact CG2-CB 3.68Å; D36-H110 IonicContact OD1-ND1 3.45Å; D36-H110 PolarHBondContact OD1-ND1 2.84Å; L106-H110 WeakPolarHBondContact O-CB 3.17Å; L106-H110 PolarHBondContact O-N 2.99Å; H110-T114 WeakPolarHBondContact O-CB 3.34Å; H110-T114 WeakPolarHBondContact O-CG2 3.27Å; H110-T114 PolarHBondContact O-OG1 3.46Å
111L96.6Very high96.4Very high0 Ų044.4 Ų44.40%026%0.257CS..Iπ-helixtrans-88.6-44.5-163.2-56172.6000114.4A32 V35 L40 L48 L106 L107 T114 A115 Y124A32-L111 HydrophobicContact CB-CD2 4.15Å; V35-L111 HydrophobicContact CG1-CD2 4.22Å; V35-L111 HydrophobicContact CG2-CD2 4.38Å; L40-L111 HydrophobicContact CD1-CD2 3.65Å; L40-L111 HydrophobicContact CG-CD2 3.96Å; L48-L111 HydrophobicContact CD2-CD1 3.5Å; L48-L111 VanDerWaalsContact CD2-CD1 3.5Å; L106-L111 HydrophobicContact CB-CD1 4.43Å; L106-L111 PolarHBondContact O-N 3.13Å; L106-L111 VanDerWaalsContact O-N 3.1Å; L107-L111 HydrophobicContact CD2-CB 4.27Å; L107-L111 HydrophobicContact CD2-CD1 4.01Å; L107-L111 PolarHBondContact O-N 3.03Å; L111-T114 PolarHBondContact O-OG1 2.87Å; L111-A115 PolarHBondContact O-N 2.87Å; L111-Y124 HydrophobicContact CB-CD1 3.96Å; L111-Y124 HydrophobicContact CB-CD2 4.12Å; L111-Y124 HydrophobicContact CB-CE1 3.93Å; L111-Y124 HydrophobicContact CB-CE2 4.08Å; L111-Y124 HydrophobicContact CB-CG 4.08Å; L111-Y124 HydrophobicContact CD1-CD1 4.26Å; L111-Y124 HydrophobicContact CD1-CE1 4.03Å; L111-Y124 HydrophobicContact CD2-CE1 4.39Å; L111-Y124 HydrophobicContact CG-CE1 4.35Å; L111-Y124 WeakPolarHBondContact O-CD2 3.4Å; L111-Y124 WeakPolarHBondContact O-CE2 3.46Å
112V96.4Very high96.4Very high44 Ų4440.7 Ų40.727%0.26724%0.238SC..Hα-helixtrans-67.2-44177.51750000111.2L107 T114 A115 L125L107-V112 HydrophobicContact CB-CG2 4.28Å; L107-V112 VanDerWaalsContact O-CB 3.32Å; L107-V112 WeakPolarHBondContact O-CB 3.39Å; L107-V112 WeakPolarHBondContact O-CG2 3.44Å; L107-V112 PolarHBondContact O-N 2.74Å; V112-T114 VanDerWaalsContact C-N 3.31Å; V112-T114 PolarHBondContact O-N 2.78Å; V112-A115 PolarHBondContact O-N 2.96Å; V112-L125 HydrophobicContact CG1-CD2 4.2Å
113P94.4Very high96.4Very high91 Ų9141 Ų4159%0.59123%0.233SC*.Hα-helixtrans-65.2-29.7179-24.135.4000114.6D108D108-P113 WeakPolarHBondContact O-CG 3.19Å
114T92.2Very high96.4Very high41 Ų4141 Ų4125%0.25223%0.234SC..Hα-helixtrans-88.6-16.7-17754.30000113.4V35 E39 H110 L111 V112 S116V35-T114 HydrophobicContact CG2-CG2 4.22Å; E39-T114 VanDerWaalsContact CG-O 3.29Å; E39-T114 WeakPolarHBondContact CG-O 3.36Å; E39-T114 VanDerWaalsContact OE1-O 3.09Å; H110-T114 WeakPolarHBondContact O-CB 3.34Å; H110-T114 WeakPolarHBondContact O-CG2 3.27Å; H110-T114 PolarHBondContact O-OG1 3.46Å; L111-T114 PolarHBondContact O-OG1 2.87Å; V112-T114 VanDerWaalsContact C-N 3.31Å; V112-T114 PolarHBondContact O-N 2.78Å; T114-S116 PolarHBondContact O-N 2.71Å
115A94.8Very high96.4Very high7 Ų741.6 Ų41.66%0.05824%0.237CC..  trans-65.5116.7-177.600000112.6L111 V112 K121 Y124L111-A115 PolarHBondContact O-N 2.87Å; V112-A115 PolarHBondContact O-N 2.96Å; A115-K121 HydrophobicContact CB-CG 3.75Å; A115-K121 WeakPolarHBondContact O-CE 3.35Å; A115-Y124 HydrophobicContact CB-CD2 3.78Å; A115-Y124 HydrophobicContact CB-CE2 3.94Å
116S93Very high96.4Very high73 Ų7338.3 Ų38.351%0.5122%0.217SC..  trans-94.7-41.3178.1630000113.6E39 T114 K121E39-S116 WeakPolarHBondContact OE1-CB 3.25Å; E39-S116 PolarHBondContact OE1-N 2.8Å; E39-S116 PolarHBondContact OE1-OG 3.31Å; E39-S116 PolarHBondContact OE2-N 3.39Å; T114-S116 PolarHBondContact O-N 2.71Å; S116-K121 WeakPolarHBondContact O-CE 3.5Å; S116-K121 PolarHBondContact O-NZ 2.96Å
117L95.2Very high96.5Very high109 Ų10938.5 Ų38.557%0.57122%0.218SC*.SBendtrans-79148.1-176.6-59.9176.7000112.1E119 S120 K121L117-E119 PolarHBondContact O-N 3.11Å; L117-S120 PolarHBondContact N-OG 2.96Å; L117-S120 PolarHBondContact O-N 3.01Å; L117-S120 PolarHBondContact O-OG 3.47Å; L117-S120 VanDerWaalsContact O-OG 3.06Å; L117-K121 WeakPolarHBondContact O-CG 3.48Å; L117-K121 PolarHBondContact O-N 3.15Å
118A97Very high96.6Very high22 Ų2240.7 Ų40.718%0.18223%0.228CC..Hα-helixtrans-55.7-42.4175.100000111.4S120 K121 V122 I161 D165 L166A118-S120 PolarHBondContact O-N 2.93Å; A118-K121 PolarHBondContact O-N 3.33Å; A118-V122 WeakPolarHBondContact O-CB 3.46Å; A118-V122 VanDerWaalsContact O-CG2 3.24Å; A118-V122 WeakPolarHBondContact O-CG2 3.45Å; A118-V122 PolarHBondContact O-N 3.27Å; A118-I161 HydrophobicContact CB-CG2 4Å; A118-D165 HydrophobicContact CB-CB 3.47Å; A118-D165 VanDerWaalsContact CB-CB 3.47Å; A118-L166 HydrophobicContact CB-CD2 4.4Å
119E96.3Very high96.6Very high61 Ų6137 Ų3729%0.28521%0.208SC..Hα-helixtrans-59.7-47.3179.1-164.2-160117.500112.8R45 L117 F123 I172R45-E119 IonicContact NH1-OE1 2.73Å; R45-E119 PolarHBondContact NH1-OE1 3.31Å; R45-E119 VanDerWaalsContact NH1-OE1 3.09Å; L117-E119 PolarHBondContact O-N 3.11Å; E119-F123 VanDerWaalsContact O-CB 3.29Å; E119-F123 WeakPolarHBondContact O-CB 3.08Å; E119-F123 PolarHBondContact O-N 2.82Å; E119-I172 HydrophobicContact CG-CD1 3.4Å
120S96.4Very high96.8Very high0 Ų034.1 Ų34.10%019%0.187CC..Hα-helixtrans-68.4-41.1179.354.80000111.6E39 L117 A118 F123 Y124E39-S120 PolarHBondContact OE2-OG 3.46Å; L117-S120 PolarHBondContact N-OG 2.96Å; L117-S120 PolarHBondContact O-N 3.01Å; L117-S120 PolarHBondContact O-OG 3.47Å; L117-S120 VanDerWaalsContact O-OG 3.06Å; A118-S120 PolarHBondContact O-N 2.93Å; S120-F123 PolarHBondContact O-N 2.78Å; S120-Y124 WeakPolarHBondContact O-CD2 3.46Å; S120-Y124 PolarHBondContact O-N 2.97Å
121K97.8Very high97Very high80 Ų8032.7 Ų32.735%0.34818%0.18SC..Hα-helixtrans-58.5-51.8175.2-72173.5-178168.10112A115 S116 L117 A118 F123 Y124 L125 I161A115-K121 HydrophobicContact CB-CG 3.75Å; A115-K121 WeakPolarHBondContact O-CE 3.35Å; S116-K121 WeakPolarHBondContact O-CE 3.5Å; S116-K121 PolarHBondContact O-NZ 2.96Å; L117-K121 WeakPolarHBondContact O-CG 3.48Å; L117-K121 PolarHBondContact O-N 3.15Å; A118-K121 PolarHBondContact O-N 3.33Å; K121-F123 VanDerWaalsContact C-N 3.3Å; K121-F123 PolarHBondContact O-N 3.4Å; K121-Y124 PolarHBondContact O-N 2.72Å; K121-L125 WeakPolarHBondContact O-CB 3.41Å; K121-L125 VanDerWaalsContact O-CG 3.28Å; K121-L125 WeakPolarHBondContact O-CG 3.32Å; K121-L125 PolarHBondContact O-N 3.43Å; K121-I161 HydrophobicContact CB-CD1 4.09Å; K121-I161 HydrophobicContact CD-CD1 4.37Å
122V98.6Very high97.1Very high0 Ų033.8 Ų33.80%019%0.185CC..Hα-helixtrans-62.9-40.9180178.60000110.3A118 K126 A158 I161 A162 L166 I172 L176A118-V122 WeakPolarHBondContact O-CB 3.46Å; A118-V122 VanDerWaalsContact O-CG2 3.24Å; A118-V122 WeakPolarHBondContact O-CG2 3.45Å; A118-V122 PolarHBondContact O-N 3.27Å; V122-K126 WeakPolarHBondContact O-CB 3.49Å; V122-K126 PolarHBondContact O-N 2.92Å; V122-A158 HydrophobicContact CG1-CB 4.36Å; V122-I161 HydrophobicContact CG2-CB 3.8Å; V122-I161 HydrophobicContact CG2-CG2 3.61Å; V122-A162 HydrophobicContact CG1-CB 3.95Å; V122-A162 HydrophobicContact CG2-CB 3.97Å; V122-L166 HydrophobicContact CB-CD1 4.22Å; V122-L166 HydrophobicContact CG1-CD1 4.29Å; V122-L166 HydrophobicContact CG2-CD1 4.03Å; V122-I172 HydrophobicContact CB-CG2 3.97Å; V122-I172 HydrophobicContact CG1-CG2 3.5Å; V122-I172 VanDerWaalsContact CG1-CG2 3.5Å; V122-L176 HydrophobicContact CG1-CD2 4.13Å
123F97.9Very high97.2Very high25 Ų2532.3 Ų32.311%0.1118%0.175CC..Hα-helixtrans-58.3-50.9177.1-172.7-78.4000112.3R45 E119 S120 K121 M127 I172R45-F123 HydrophobicContact CG-CD1 3.61Å; R45-F123 HydrophobicContact CG-CE1 3.4Å; R45-F123 VanDerWaalsContact CG-CE1 3.4Å; R45-F123 HydrophobicContact CG-CE2 4.4Å; R45-F123 HydrophobicContact CG-CG 4.21Å; R45-F123 HydrophobicContact CG-CZ 3.81Å; E119-F123 VanDerWaalsContact O-CB 3.29Å; E119-F123 WeakPolarHBondContact O-CB 3.08Å; E119-F123 PolarHBondContact O-N 2.82Å; S120-F123 PolarHBondContact O-N 2.78Å; K121-F123 VanDerWaalsContact C-N 3.3Å; K121-F123 PolarHBondContact O-N 3.4Å; F123-M127 HydrophobicContact CE1-CE 3.64Å; F123-M127 HydrophobicContact CZ-CE 4.19Å; F123-M127 WeakPolarHBondContact O-CB 3.37Å; F123-M127 PolarHBondContact O-N 3.43Å; F123-I172 HydrophobicContact CB-CD1 4.35Å; F123-I172 HydrophobicContact CD2-CD1 3.92Å; F123-I172 HydrophobicContact CD2-CG1 4.34Å
124Y98.5Very high97.4Very high1 Ų128.9 Ų28.90%0.00415%0.151CC..Hα-helixtrans-70.7-39.7-178-63.4-46.5000112.7R45 L107 L111 A115 S120 K121 M127 K128R45-Y124 HydrophobicContact CG-CE1 3.63Å; L107-Y124 HydrophobicContact CD2-CD1 3.83Å; L107-Y124 HydrophobicContact CD2-CG 4.14Å; L111-Y124 HydrophobicContact CB-CD1 3.96Å; L111-Y124 HydrophobicContact CB-CD2 4.12Å; L111-Y124 HydrophobicContact CB-CE1 3.93Å; L111-Y124 HydrophobicContact CB-CE2 4.08Å; L111-Y124 HydrophobicContact CB-CG 4.08Å; L111-Y124 HydrophobicContact CD1-CD1 4.26Å; L111-Y124 HydrophobicContact CD1-CE1 4.03Å; L111-Y124 HydrophobicContact CD2-CE1 4.39Å; L111-Y124 HydrophobicContact CG-CE1 4.35Å; L111-Y124 WeakPolarHBondContact O-CD2 3.4Å; L111-Y124 WeakPolarHBondContact O-CE2 3.46Å; A115-Y124 HydrophobicContact CB-CD2 3.78Å; A115-Y124 HydrophobicContact CB-CE2 3.94Å; S120-Y124 WeakPolarHBondContact O-CD2 3.46Å; S120-Y124 PolarHBondContact O-N 2.97Å; K121-Y124 PolarHBondContact O-N 2.72Å; Y124-M127 WeakPolarHBondContact O-CB 3.44Å; Y124-M127 PolarHBondContact O-N 3.39Å; Y124-K128 WeakPolarHBondContact O-CB 3.3Å; Y124-K128 PolarHBondContact O-N 3.2Å
125L98.8Very high97.7Very high24 Ų2427.7 Ų27.713%0.12614%0.143CC..Hα-helixtrans-66.5-39.3176.3-69.7170.3000111.7V112 K121 M127 K128 G129 A158 I161V112-L125 HydrophobicContact CG1-CD2 4.2Å; K121-L125 WeakPolarHBondContact O-CB 3.41Å; K121-L125 VanDerWaalsContact O-CG 3.28Å; K121-L125 WeakPolarHBondContact O-CG 3.32Å; K121-L125 PolarHBondContact O-N 3.43Å; L125-M127 VanDerWaalsContact C-N 3.35Å; L125-K128 WeakPolarHBondContact O-CB 3.49Å; L125-K128 PolarHBondContact O-N 3.48Å; L125-G129 PolarHBondContact O-N 3.1Å; L125-A158 HydrophobicContact CB-CB 3.68Å; L125-I161 HydrophobicContact CD1-CD1 3.82Å
126K98.6Very high97.9Very high37 Ų3727.4 Ų27.416%0.16114%0.14CC..Hα-helixtrans-58.8-48.3170.4179.1-170.8175.5-660110.6V122 K128 G129 D130 Y155 G175 L176 N179V122-K126 WeakPolarHBondContact O-CB 3.49Å; V122-K126 PolarHBondContact O-N 2.92Å; K126-K128 VanDerWaalsContact C-N 3.32Å; K126-K128 PolarHBondContact O-N 3.34Å; K126-G129 PolarHBondContact O-N 2.65Å; K126-D130 IonicContact NZ-OD2 2.99Å; K126-D130 PolarHBondContact NZ-OD2 3.3Å; K126-D130 PolarHBondContact O-N 2.75Å; K126-Y155 HydrophobicContact CG-CE1 4.38Å; K126-Y155 WeakPolarHBondContact O-CE1 3.47Å; K126-G175 WeakPolarHBondContact CE-O 3.43Å; K126-L176 HydrophobicContact CB-CD1 4.1Å; K126-L176 HydrophobicContact CD-CB 4.18Å; K126-L176 HydrophobicContact CG-CB 4.41Å; K126-L176 HydrophobicContact CG-CD1 4.04Å; K126-N179 PolarHBondContact NZ-ND2 3.47Å
127M98.6Very high98.1Very high9 Ų925.6 Ų25.64%0.04412%0.124CC..Hα-helixtrans-59.9-43178.3-171.1176.2-84.500111.3S49 I103 L107 F123 Y124 L125 G129 D130 Y131S49-M127 VanDerWaalsContact CA-CE 3.48Å; S49-M127 WeakPolarHBondContact OG-CE 3.43Å; I103-M127 HydrophobicContact CD1-SD 3.86Å; I103-M127 HydrophobicContact CG1-CG 4.42Å; I103-M127 HydrophobicContact CG1-SD 3.95Å; L107-M127 HydrophobicContact CD1-CB 4.28Å; L107-M127 HydrophobicContact CD1-CG 4.07Å; L107-M127 HydrophobicContact CD1-SD 4.48Å; L107-M127 HydrophobicContact CD2-CB 4.4Å; L107-M127 HydrophobicContact CD2-SD 4.29Å; F123-M127 HydrophobicContact CE1-CE 3.64Å; F123-M127 HydrophobicContact CZ-CE 4.19Å; F123-M127 WeakPolarHBondContact O-CB 3.37Å; F123-M127 PolarHBondContact O-N 3.43Å; Y124-M127 WeakPolarHBondContact O-CB 3.44Å; Y124-M127 PolarHBondContact O-N 3.39Å; L125-M127 VanDerWaalsContact C-N 3.35Å; M127-G129 VanDerWaalsContact C-N 3.34Å; M127-G129 PolarHBondContact O-N 2.93Å; M127-D130 WeakPolarHBondContact O-CB 3.43Å; M127-D130 PolarHBondContact O-N 2.9Å; M127-D130 VanDerWaalsContact O-N 3.13Å; M127-Y131 HydrophobicContact CG-CD2 3.78Å; M127-Y131 HydrophobicContact CG-CE2 3.6Å; M127-Y131 VanDerWaalsContact O-CD2 3.24Å; M127-Y131 WeakPolarHBondContact O-CD2 3.22Å; M127-Y131 PolarHBondContact O-N 2.99Å; M127-Y131 HydrophobicContact SD-CE2 4.31Å
128K98.8Very high98.2Very high46 Ų4621 Ų2120%0.210%0.099CC..Hα-helixtrans-56.7-47.6174.1-176169.3-176167.10111.6L104 L107 D108 Y124 L125 K126 D130 Y131 H132 A154L104-K128 HydrophobicContact CD2-CG 3.9Å; L107-K128 HydrophobicContact CD1-CB 3.98Å; D108-K128 VanDerWaalsContact OD1-CE 3.3Å; D108-K128 WeakPolarHBondContact OD1-CE 3.42Å; D108-K128 IonicContact OD1-NZ 3.65Å; D108-K128 PolarHBondContact OD1-NZ 3Å; D108-K128 IonicContact OD2-NZ 2.74Å; D108-K128 PolarHBondContact OD2-NZ 3.3Å; Y124-K128 WeakPolarHBondContact O-CB 3.3Å; Y124-K128 PolarHBondContact O-N 3.2Å; L125-K128 WeakPolarHBondContact O-CB 3.49Å; L125-K128 PolarHBondContact O-N 3.48Å; K126-K128 VanDerWaalsContact C-N 3.32Å; K126-K128 PolarHBondContact O-N 3.34Å; K128-D130 VanDerWaalsContact C-N 3.34Å; K128-D130 PolarHBondContact O-N 3.42Å; K128-Y131 PolarHBondContact O-N 3.02Å; K128-H132 PolarHBondContact O-CD2 3.38Å; K128-H132 VanDerWaalsContact O-CD2 3.27Å; K128-H132 PolarHBondContact O-N 2.85Å; K128-H132 VanDerWaalsContact O-N 3.09Å; K128-A154 HydrophobicContact CB-CB 4.2Å; K128-A154 HydrophobicContact CD-CB 4.46Å; K128-A154 HydrophobicContact CG-CB 4.08Å
129G98.8Very high98.2Very high0 Ų022.2 Ų22.20%010%0.1CC..Hα-helixtrans-59.8-42.1174.700000112.7L125 K126 M127 Y131 R133 T151L125-G129 PolarHBondContact O-N 3.1Å; K126-G129 PolarHBondContact O-N 2.65Å; M127-G129 VanDerWaalsContact C-N 3.34Å; M127-G129 PolarHBondContact O-N 2.93Å; G129-Y131 PolarHBondContact O-N 3.21Å; G129-R133 VanDerWaalsContact O-CB 3.25Å; G129-R133 WeakPolarHBondContact O-CB 3.13Å; G129-R133 PolarHBondContact O-N 2.85Å; G129-T151 WeakPolarHBondContact O-CG2 3.42Å
130D98.7Very high98.3Very high10 Ų1024.4 Ų24.45%0.05312%0.118CC..Hα-helixtrans-59.7-45.1177.4-80.3-44.2000112.6K126 M127 K128 R133 Y134 Y155 N179K126-D130 IonicContact NZ-OD2 2.99Å; K126-D130 PolarHBondContact NZ-OD2 3.3Å; K126-D130 PolarHBondContact O-N 2.75Å; M127-D130 WeakPolarHBondContact O-CB 3.43Å; M127-D130 PolarHBondContact O-N 2.9Å; M127-D130 VanDerWaalsContact O-N 3.13Å; K128-D130 VanDerWaalsContact C-N 3.34Å; K128-D130 PolarHBondContact O-N 3.42Å; D130-R133 WeakPolarHBondContact O-CB 2.91Å; D130-R133 PolarHBondContact O-N 3.05Å; D130-R133 IonicContact OD1-CZ 2.78Å; D130-R133 IonicContact OD1-NE 3.47Å; D130-R133 IonicContact OD1-NH2 3.64Å; D130-R133 PolarHBondContact OD1-NH2 3.21Å; D130-Y134 HydrophobicContact CB-CE2 4.21Å; D130-Y134 WeakPolarHBondContact O-CD1 3.4Å; D130-Y134 WeakPolarHBondContact O-CD2 3.47Å; D130-Y134 WeakPolarHBondContact O-CE2 3.5Å; D130-Y134 PolarHBondContact O-N 3.28Å; D130-Y155 PolarHBondContact OD1-OH 2.91Å; D130-N179 VanDerWaalsContact CG-ND2 3.26Å; D130-N179 PolarHBondContact OD1-ND2 3.16Å; D130-N179 PolarHBondContact OD2-ND2 3.46Å
131Y98.8Very high98.3Very high6 Ų627.4 Ų27.42%0.02415%0.148CC..Hα-helixtrans-76-33.6-178.3-75.9-81.7000113.5Y52 K53 I56 C100 I103 M127 K128 G129 R133 Y134 L135Y52-Y131 VanDerWaalsContact C-OH 3.29Å; Y52-Y131 WeakPolarHBondContact CB-OH 3.47Å; K53-Y131 PolarHBondContact N-OH 3.37Å; I56-Y131 HydrophobicContact CB-CE1 4.07Å; I56-Y131 HydrophobicContact CG1-CE1 4.13Å; I56-Y131 HydrophobicContact CG2-CE1 3.97Å; C100-Y131 HydrophobicContact CB-CD1 4.41Å; I103-Y131 HydrophobicContact CB-CD2 4.44Å; I103-Y131 HydrophobicContact CB-CE2 4.48Å; I103-Y131 HydrophobicContact CG1-CD2 4.06Å; I103-Y131 HydrophobicContact CG1-CE2 3.99Å; I103-Y131 HydrophobicContact CG2-CD1 3.37Å; I103-Y131 HydrophobicContact CG2-CD2 3.49Å; I103-Y131 VanDerWaalsContact CG2-CD2 3.49Å; I103-Y131 HydrophobicContact CG2-CE1 3.68Å; I103-Y131 HydrophobicContact CG2-CE2 3.81Å; I103-Y131 HydrophobicContact CG2-CG 3.3Å; M127-Y131 HydrophobicContact CG-CD2 3.78Å; M127-Y131 HydrophobicContact CG-CE2 3.6Å; M127-Y131 VanDerWaalsContact O-CD2 3.24Å; M127-Y131 WeakPolarHBondContact O-CD2 3.22Å; M127-Y131 PolarHBondContact O-N 2.99Å; M127-Y131 HydrophobicContact SD-CE2 4.31Å; K128-Y131 PolarHBondContact O-N 3.02Å; G129-Y131 PolarHBondContact O-N 3.21Å; Y131-R133 VanDerWaalsContact C-N 3.3Å; Y131-Y134 AromaticContact CD1-CD2 3.67Å; Y131-Y134 HydrophobicContact CD1-CD2 3.67Å; Y131-Y134 HydrophobicContact CD1-CE2 4.04Å; Y131-Y134 AromaticContact CE1-CD2 3.94Å; Y131-Y134 HydrophobicContact CE1-CD2 3.94Å; Y131-Y134 AromaticContact CE1-CE2 3.97Å; Y131-Y134 HydrophobicContact CE1-CE2 3.97Å; Y131-Y134 HydrophobicContact CG-CD2 4.14Å; Y131-Y134 HydrophobicContact CG-CE2 4.35Å; Y131-Y134 PolarHBondContact O-N 3.48Å; Y131-L135 PolarHBondContact O-N 2.89Å; Y131-L135 VanDerWaalsContact O-N 3.12Å
132H98.9Very high98.3Very high24 Ų2427.5 Ų27.511%0.11117%0.165CC..Hα-helixtrans-65.1-36.2167.5-76.9-64.4000112K128 Y134 L135 A136 T151K128-H132 PolarHBondContact O-CD2 3.38Å; K128-H132 VanDerWaalsContact O-CD2 3.27Å; K128-H132 PolarHBondContact O-N 2.85Å; K128-H132 VanDerWaalsContact O-N 3.09Å; H132-Y134 VanDerWaalsContact C-N 3.34Å; H132-Y134 PolarHBondContact O-N 3.02Å; H132-L135 WeakPolarHBondContact O-CB 3.41Å; H132-L135 PolarHBondContact O-N 2.87Å; H132-A136 PolarHBondContact O-N 3.45Å; H132-T151 VanDerWaalsContact CB-OG1 3.27Å; H132-T151 WeakPolarHBondContact CB-OG1 3.37Å
133R98.7Very high98.3Very high12 Ų1232.4 Ų32.45%0.04519%0.187CC..Hα-helixtrans-61.9-44.3175.2-179.6172.85884-4.7110.9G129 D130 Y131 L135 A136 E137 T151 Y155 F183 I187G129-R133 VanDerWaalsContact O-CB 3.25Å; G129-R133 WeakPolarHBondContact O-CB 3.13Å; G129-R133 PolarHBondContact O-N 2.85Å; D130-R133 WeakPolarHBondContact O-CB 2.91Å; D130-R133 PolarHBondContact O-N 3.05Å; D130-R133 IonicContact OD1-CZ 2.78Å; D130-R133 IonicContact OD1-NE 3.47Å; D130-R133 IonicContact OD1-NH2 3.64Å; D130-R133 PolarHBondContact OD1-NH2 3.21Å; Y131-R133 VanDerWaalsContact C-N 3.3Å; R133-L135 VanDerWaalsContact C-N 3.29Å; R133-L135 PolarHBondContact O-N 3.5Å; R133-A136 WeakPolarHBondContact O-CB 3.47Å; R133-A136 PolarHBondContact O-N 3.37Å; R133-E137 IonicContact NH1-OE1 3.15Å; R133-E137 PolarHBondContact NH1-OE1 2.9Å; R133-E137 PolarHBondContact O-N 2.97Å; R133-E137 VanDerWaalsContact O-N 3.15Å; R133-T151 WeakPolarHBondContact CA-OG1 3.2Å; R133-T151 HydrophobicContact CB-CG2 3.86Å; R133-T151 PolarHBondContact N-OG1 3.06Å; R133-Y155 PolarHBondContact NE-OH 3.01Å; R133-Y155 VanDerWaalsContact NE-OH 3.13Å; R133-F183 HydrophobicContact CG-CD2 4.23Å; R133-I187 HydrophobicContact CG-CG1 4.02Å
134Y98.6Very high98.3Very high20 Ų2036.7 Ų36.78%0.07820%0.203CC..Hα-helixtrans-60.9-38.3175.7-56-32.3000112.2I56 R60 D130 Y131 H132 A136 E137 F138I56-Y134 HydrophobicContact CG1-CD2 3.86Å; I56-Y134 HydrophobicContact CG1-CE2 4.39Å; I56-Y134 HydrophobicContact CG1-CG 4.44Å; I56-Y134 HydrophobicContact CG2-CD2 4.29Å; I56-Y134 HydrophobicContact CG2-CE2 3.98Å; R60-Y134 VanDerWaalsContact CZ-CD1 3.49Å; R60-Y134 VanDerWaalsContact CZ-CE1 3.45Å; D130-Y134 HydrophobicContact CB-CE2 4.21Å; D130-Y134 WeakPolarHBondContact O-CD1 3.4Å; D130-Y134 WeakPolarHBondContact O-CD2 3.47Å; D130-Y134 WeakPolarHBondContact O-CE2 3.5Å; D130-Y134 PolarHBondContact O-N 3.28Å; Y131-Y134 AromaticContact CD1-CD2 3.67Å; Y131-Y134 HydrophobicContact CD1-CD2 3.67Å; Y131-Y134 HydrophobicContact CD1-CE2 4.04Å; Y131-Y134 AromaticContact CE1-CD2 3.94Å; Y131-Y134 HydrophobicContact CE1-CD2 3.94Å; Y131-Y134 AromaticContact CE1-CE2 3.97Å; Y131-Y134 HydrophobicContact CE1-CE2 3.97Å; Y131-Y134 HydrophobicContact CG-CD2 4.14Å; Y131-Y134 HydrophobicContact CG-CE2 4.35Å; Y131-Y134 PolarHBondContact O-N 3.48Å; H132-Y134 VanDerWaalsContact C-N 3.34Å; H132-Y134 PolarHBondContact O-N 3.02Å; Y134-A136 VanDerWaalsContact C-N 3.34Å; Y134-E137 WeakPolarHBondContact O-CB 3.39Å; Y134-E137 PolarHBondContact O-N 2.91Å; Y134-F138 WeakPolarHBondContact O-CD1 3.49Å; Y134-F138 VanDerWaalsContact O-CE1 3.23Å; Y134-F138 WeakPolarHBondContact O-CE1 3.28Å
135L98.7Very high98.3Very high16 Ų1643.2 Ų43.28%0.08423%0.231CC..Hα-helixtrans-60.7-43.8171.4-69.7171.7000111.4C100 L104 Y131 H132 R133 E137 F138 K139 A147C100-L135 HydrophobicContact CB-CD1 4.12Å; C100-L135 HydrophobicContact CB-CD2 3.73Å; C100-L135 HydrophobicContact CB-CG 3.78Å; L104-L135 HydrophobicContact CD1-CD1 3.8Å; Y131-L135 PolarHBondContact O-N 2.89Å; Y131-L135 VanDerWaalsContact O-N 3.12Å; H132-L135 WeakPolarHBondContact O-CB 3.41Å; H132-L135 PolarHBondContact O-N 2.87Å; R133-L135 VanDerWaalsContact C-N 3.29Å; R133-L135 PolarHBondContact O-N 3.5Å; L135-E137 PolarHBondContact O-N 2.93Å; L135-F138 HydrophobicContact CD2-CE1 4.18Å; L135-F138 HydrophobicContact CD2-CZ 3.78Å; L135-F138 PolarHBondContact O-N 2.78Å; L135-K139 HydrophobicContact CB-CG 4.43Å; L135-K139 WeakPolarHBondContact O-CB 3.37Å; L135-K139 WeakPolarHBondContact O-CG 3.45Å; L135-K139 PolarHBondContact O-N 2.68Å; L135-A147 HydrophobicContact CB-CB 3.89Å
136A98.5Very high98.3Very high0 Ų048.1 Ų48.10%025%0.253CS..Hα-helixtrans-66-17.7-179.800000114.4H132 R133 Y134 R144 A147 A148 I187H132-A136 PolarHBondContact O-N 3.45Å; R133-A136 WeakPolarHBondContact O-CB 3.47Å; R133-A136 PolarHBondContact O-N 3.37Å; Y134-A136 VanDerWaalsContact C-N 3.34Å; A136-R144 PolarHBondContact O-NE 2.86Å; A136-A147 HydrophobicContact CB-CB 3.84Å; A136-A148 HydrophobicContact CB-CB 4.47Å; A136-I187 HydrophobicContact CB-CD1 4.42Å; A136-I187 HydrophobicContact CB-CG2 3.88Å
137E97.7Very high98.3Very high36 Ų3646.6 Ų46.617%0.16825%0.248CC..Hα-helixtrans-69.1-37.5177.3-71.8172.5-167.100112.6R60 W63 R64 R133 Y134 L135 I187R60-E137 IonicContact CZ-OE1 2.61Å; R60-E137 IonicContact CZ-OE2 3.58Å; R60-E137 VanDerWaalsContact CZ-OE2 3.31Å; R60-E137 IonicContact NE-OE1 2.72Å; R60-E137 IonicContact NE-OE2 2.75Å; R60-E137 PolarHBondContact NE-OE2 3.32Å; R60-E137 VanDerWaalsContact NH2-CD 3.26Å; R60-E137 IonicContact NH2-OE1 3.58Å; R60-E137 PolarHBondContact NH2-OE1 2.9Å; R60-E137 IonicContact NH2-OE2 3.97Å; R60-E137 PolarHBondContact NH2-OE2 2.99Å; W63-E137 WeakPolarHBondContact CH2-O 3.46Å; R64-E137 IonicContact NH2-OE2 3.29Å; R133-E137 IonicContact NH1-OE1 3.15Å; R133-E137 PolarHBondContact NH1-OE1 2.9Å; R133-E137 PolarHBondContact O-N 2.97Å; R133-E137 VanDerWaalsContact O-N 3.15Å; Y134-E137 WeakPolarHBondContact O-CB 3.39Å; Y134-E137 PolarHBondContact O-N 2.91Å; L135-E137 PolarHBondContact O-N 2.93Å; E137-I187 HydrophobicContact CG-CD1 3.91Å
138F97.3Very high98.3Very high13 Ų1346.9 Ų46.96%0.05725%0.251CS..Hα-helixtrans-119.5-20.4-173.168.7-91.4000114.4W63 E93 L96 S97 Y134 L135W63-F138 HydrophobicContact CD2-CB 4.15Å; W63-F138 VanDerWaalsContact CE2-CB 3.44Å; W63-F138 HydrophobicContact CH2-CB 3.93Å; W63-F138 HydrophobicContact CZ2-CB 3.34Å; E93-F138 HydrophobicContact CB-CD2 3.83Å; E93-F138 HydrophobicContact CB-CE2 3.97Å; E93-F138 HydrophobicContact CG-CB 4.36Å; E93-F138 HydrophobicContact CG-CD2 3.67Å; E93-F138 HydrophobicContact CG-CE2 4.32Å; E93-F138 HydrophobicContact CG-CG 4.28Å; L96-F138 HydrophobicContact CB-CD1 4.45Å; L96-F138 HydrophobicContact CB-CE1 3.71Å; L96-F138 HydrophobicContact CB-CE2 4.4Å; L96-F138 HydrophobicContact CB-CZ 3.66Å; L96-F138 HydrophobicContact CD1-CD1 4Å; L96-F138 HydrophobicContact CD1-CE1 4.09Å; L96-F138 HydrophobicContact CD1-CG 4.43Å; L96-F138 HydrophobicContact CG-CE1 4.46Å; S97-F138 WeakPolarHBondContact OG-CZ 3.45Å; Y134-F138 WeakPolarHBondContact O-CD1 3.49Å; Y134-F138 VanDerWaalsContact O-CE1 3.23Å; Y134-F138 WeakPolarHBondContact O-CE1 3.28Å; L135-F138 HydrophobicContact CD2-CE1 4.18Å; L135-F138 HydrophobicContact CD2-CZ 3.78Å; L135-F138 PolarHBondContact O-N 2.78Å
139K98Very high98.3Very high47 Ų4749.6 Ų49.620%0.20427%0.265CS..  trans-65.8157.1173.7-70.6-69-170.5164.30110.8S97 L135 E143 R144S97-K139 WeakPolarHBondContact OG-CE 3.41Å; L135-K139 HydrophobicContact CB-CG 4.43Å; L135-K139 WeakPolarHBondContact O-CB 3.37Å; L135-K139 WeakPolarHBondContact O-CG 3.45Å; L135-K139 PolarHBondContact O-N 2.68Å; K139-E143 HydrophobicContact CB-CB 4.07Å; K139-E143 HydrophobicContact CD-CB 4.04Å; K139-E143 HydrophobicContact CG-CB 4.29Å; K139-E143 IonicContact NZ-OE1 2.63Å; K139-E143 PolarHBondContact NZ-OE1 3.43Å; K139-E143 IonicContact NZ-OE2 2.95Å; K139-E143 PolarHBondContact NZ-OE2 3.49Å; K139-R144 HydrophobicContact CB-CB 4.33Å; K139-R144 WeakPolarHBondContact O-CB 3.44Å; K139-R144 WeakPolarHBondContact O-CD 3.1Å; K139-R144 WeakPolarHBondContact O-CG 3.23Å
140T97Very high98.3Very high106 Ų10651.2 Ų51.265%0.6528%0.276SS*.  trans-127.2166.7-179.863.90000111.3A142 E143 R144T140-A142 PolarHBondContact O-N 3.31Å; T140-E143 PolarHBondContact O-N 3.08Å; T140-R144 PolarHBondContact O-N 3.13Å
141G97.3Very high98.3Very high63 Ų6350.8 Ų50.865%0.64927%0.274SS*.Hα-helixtrans55.6-131.2174.700000114.3R144 K145G141-R144 PolarHBondContact O-N 2.75Å; G141-K145 PolarHBondContact O-N 3.49Å
142A98.2Very high98.3Very high83 Ų8353.3 Ų53.369%0.68629%0.288SS*.Hα-helixtrans-65.1-39.9-177.500000112.8T140 R144 K145 E146T140-A142 PolarHBondContact O-N 3.31Å; A142-R144 VanDerWaalsContact C-N 3.31Å; A142-R144 PolarHBondContact O-N 2.95Å; A142-K145 WeakPolarHBondContact O-CB 3.42Å; A142-K145 PolarHBondContact O-N 3.46Å; A142-K145 VanDerWaalsContact O-N 3.15Å; A142-E146 PolarHBondContact O-N 3.27Å
143E98Very high98.3Very high102 Ų10256.7 Ų56.748%0.47731%0.31SS..Hα-helixtrans-62.8-39179.1-64.1-176.5105.200111.4K139 T140 K145 E146 A147K139-E143 HydrophobicContact CB-CB 4.07Å; K139-E143 HydrophobicContact CD-CB 4.04Å; K139-E143 HydrophobicContact CG-CB 4.29Å; K139-E143 IonicContact NZ-OE1 2.63Å; K139-E143 PolarHBondContact NZ-OE1 3.43Å; K139-E143 IonicContact NZ-OE2 2.95Å; K139-E143 PolarHBondContact NZ-OE2 3.49Å; T140-E143 PolarHBondContact O-N 3.08Å; E143-K145 VanDerWaalsContact C-N 3.32Å; E143-K145 PolarHBondContact O-N 3.36Å; E143-E146 PolarHBondContact O-N 2.96Å; E143-A147 WeakPolarHBondContact O-CB 3.37Å; E143-A147 PolarHBondContact O-N 3.21Å
144R98.2Very high98.3Very high115 Ų11556.3 Ų56.343%0.43431%0.309SS..Hα-helixtrans-61.3-44175.1-170.7178174.3-159.4-6111.4A136 K139 T140 G141 A142 A147 A148A136-R144 PolarHBondContact O-NE 2.86Å; K139-R144 HydrophobicContact CB-CB 4.33Å; K139-R144 WeakPolarHBondContact O-CB 3.44Å; K139-R144 WeakPolarHBondContact O-CD 3.1Å; K139-R144 WeakPolarHBondContact O-CG 3.23Å; T140-R144 PolarHBondContact O-N 3.13Å; G141-R144 PolarHBondContact O-N 2.75Å; A142-R144 VanDerWaalsContact C-N 3.31Å; A142-R144 PolarHBondContact O-N 2.95Å; R144-A147 PolarHBondContact O-N 3.21Å; R144-A148 WeakPolarHBondContact O-CB 3.49Å; R144-A148 PolarHBondContact O-N 3.13Å
145K98.4Very high98.3Very high138 Ų13855.4 Ų55.460%0.631%0.305SS*.Hα-helixtrans-63.5-46.9-179.7-176.5179.7170.8-176.90110.9G141 A142 E143 A147 A148 E149G141-K145 PolarHBondContact O-N 3.49Å; A142-K145 WeakPolarHBondContact O-CB 3.42Å; A142-K145 PolarHBondContact O-N 3.46Å; A142-K145 VanDerWaalsContact O-N 3.15Å; E143-K145 VanDerWaalsContact C-N 3.32Å; E143-K145 PolarHBondContact O-N 3.36Å; K145-A147 PolarHBondContact O-N 3.15Å; K145-A148 PolarHBondContact O-N 3.24Å; K145-E149 WeakPolarHBondContact CE-OE1 3.36Å; K145-E149 IonicContact NZ-OE1 2.68Å; K145-E149 WeakPolarHBondContact O-CG 3.27Å; K145-E149 PolarHBondContact O-N 3.39Å
146E98.6Very high98.3Very high127 Ų12758.5 Ų58.559%0.59332%0.318SS*.Hα-helixtrans-61.1-42.9177.1-178.3178.4-176.900112.1A142 E143 E149 S150A142-E146 PolarHBondContact O-N 3.27Å; E143-E146 PolarHBondContact O-N 2.96Å; E146-E149 PolarHBondContact O-N 3.36Å; E146-S150 WeakPolarHBondContact O-CB 3.2Å; E146-S150 PolarHBondContact O-N 2.89Å; E146-S150 PolarHBondContact O-OG 2.62Å
147A98.7Very high98.3Very high6 Ų660.8 Ų60.85%0.0534%0.335CS..Hα-helixtrans-63.6-41.4176.700000111.9L135 A136 E143 R144 K145 S150 T151L135-A147 HydrophobicContact CB-CB 3.89Å; A136-A147 HydrophobicContact CB-CB 3.84Å; E143-A147 WeakPolarHBondContact O-CB 3.37Å; E143-A147 PolarHBondContact O-N 3.21Å; R144-A147 PolarHBondContact O-N 3.21Å; K145-A147 PolarHBondContact O-N 3.15Å; A147-S150 PolarHBondContact O-N 3.17Å; A147-T151 WeakPolarHBondContact O-CB 3.42Å; A147-T151 PolarHBondContact O-N 3.5Å; A147-T151 PolarHBondContact O-OG1 3.06Å
148A98.7Very high98.4Very high14 Ų1459.1 Ų59.112%0.11633%0.327CS..Hα-helixtrans-66.3-42.817600000112.2A136 R144 K145 T151 L152 F183 I187 L188A136-A148 HydrophobicContact CB-CB 4.47Å; R144-A148 WeakPolarHBondContact O-CB 3.49Å; R144-A148 PolarHBondContact O-N 3.13Å; K145-A148 PolarHBondContact O-N 3.24Å; A148-T151 WeakPolarHBondContact O-CB 3.27Å; A148-T151 PolarHBondContact O-N 3.27Å; A148-L152 PolarHBondContact O-N 3.32Å; A148-F183 HydrophobicContact CB-CE2 4.37Å; A148-F183 HydrophobicContact CB-CZ 4.44Å; A148-F183 VanDerWaalsContact O-CZ 3.3Å; A148-F183 WeakPolarHBondContact O-CZ 3.49Å; A148-I187 HydrophobicContact CB-CG2 4.01Å; A148-L188 HydrophobicContact CB-CD2 4.39Å
149E98.7Very high98.4Very high104 Ų10459.7 Ų59.749%0.48633%0.329SS..Hα-helixtrans-62.2-45.4175.4-73.7173.7177.700111.2K145 E146 T151 L152 V153K145-E149 WeakPolarHBondContact CE-OE1 3.36Å; K145-E149 IonicContact NZ-OE1 2.68Å; K145-E149 WeakPolarHBondContact O-CG 3.27Å; K145-E149 PolarHBondContact O-N 3.39Å; E146-E149 PolarHBondContact O-N 3.36Å; E149-T151 VanDerWaalsContact C-N 3.32Å; E149-T151 PolarHBondContact O-N 3.28Å; E149-L152 PolarHBondContact O-N 3.05Å; E149-V153 WeakPolarHBondContact O-CG2 3.27Å; E149-V153 PolarHBondContact O-N 3.42Å
150S98.8Very high98.5Very high34 Ų3462.4 Ų62.424%0.23835%0.346CS..Hα-helixtrans-62.5-38.8176.8-59.70000112.4E146 A147 A154E146-S150 WeakPolarHBondContact O-CB 3.2Å; E146-S150 PolarHBondContact O-N 2.89Å; E146-S150 PolarHBondContact O-OG 2.62Å; A147-S150 PolarHBondContact O-N 3.17Å; S150-A154 WeakPolarHBondContact O-CB 3.44Å; S150-A154 PolarHBondContact O-N 3.01Å
151T98.9Very high98.5Very high0 Ų059.3 Ų59.30%033%0.325CS..Hα-helixtrans-60.1-49173.3-57.50000111.2G129 H132 R133 A147 A148 E149 V153 A154 Y155 F183G129-T151 WeakPolarHBondContact O-CG2 3.42Å; H132-T151 VanDerWaalsContact CB-OG1 3.27Å; H132-T151 WeakPolarHBondContact CB-OG1 3.37Å; R133-T151 WeakPolarHBondContact CA-OG1 3.2Å; R133-T151 HydrophobicContact CB-CG2 3.86Å; R133-T151 PolarHBondContact N-OG1 3.06Å; A147-T151 WeakPolarHBondContact O-CB 3.42Å; A147-T151 PolarHBondContact O-N 3.5Å; A147-T151 PolarHBondContact O-OG1 3.06Å; A148-T151 WeakPolarHBondContact O-CB 3.27Å; A148-T151 PolarHBondContact O-N 3.27Å; E149-T151 VanDerWaalsContact C-N 3.32Å; E149-T151 PolarHBondContact O-N 3.28Å; T151-V153 PolarHBondContact O-N 3.05Å; T151-A154 PolarHBondContact O-N 3.43Å; T151-Y155 HydrophobicContact CG2-CD2 3.57Å; T151-Y155 HydrophobicContact CG2-CE2 3.35Å; T151-Y155 PolarHBondContact O-N 3.13Å; T151-F183 HydrophobicContact CG2-CB 4.46Å; T151-F183 HydrophobicContact CG2-CD1 4.13Å; T151-F183 HydrophobicContact CG2-CD2 3.34Å; T151-F183 HydrophobicContact CG2-CE1 4.16Å; T151-F183 HydrophobicContact CG2-CE2 3.41Å; T151-F183 VanDerWaalsContact CG2-CE2 3.41Å; T151-F183 HydrophobicContact CG2-CG 3.72Å; T151-F183 HydrophobicContact CG2-CZ 3.83Å
152L98.7Very high98.6Very high60 Ų6056.4 Ų56.431%0.31430%0.295SS..Hα-helixtrans-62-44.2-178.7-178.762.8000111.5A148 E149 K156 F180 F183 Y184A148-L152 PolarHBondContact O-N 3.32Å; E149-L152 PolarHBondContact O-N 3.05Å; L152-K156 HydrophobicContact CD1-CG 4.21Å; L152-K156 VanDerWaalsContact O-CB 3.31Å; L152-K156 WeakPolarHBondContact O-CB 3.44Å; L152-K156 WeakPolarHBondContact O-CG 3.24Å; L152-K156 PolarHBondContact O-N 3.19Å; L152-F180 HydrophobicContact CD1-CE2 3.77Å; L152-F180 HydrophobicContact CD1-CZ 3.76Å; L152-F183 HydrophobicContact CB-CE1 3.98Å; L152-F183 HydrophobicContact CB-CZ 4.19Å; L152-F183 HydrophobicContact CD1-CE1 4.12Å; L152-Y184 HydrophobicContact CD1-CE1 4.47Å
153V98.7Very high98.6Very high95 Ų9556.3 Ų56.358%0.57628%0.283SS*.Hα-helixtrans-60.2-51.6176.6170.50000110.6E149 T151 Y155 K156 S157E149-V153 WeakPolarHBondContact O-CG2 3.27Å; E149-V153 PolarHBondContact O-N 3.42Å; T151-V153 PolarHBondContact O-N 3.05Å; V153-Y155 PolarHBondContact O-N 3.38Å; V153-K156 PolarHBondContact O-N 2.91Å; V153-S157 PolarHBondContact O-N 3.35Å; V153-S157 PolarHBondContact O-OG 3.09Å
154A98.8Very high98.6Very high4 Ų455.1 Ų55.13%0.03329%0.29CS..Hα-helixtrans-61.2-45.2-177.600000112.2K128 S150 T151 S157 A158K128-A154 HydrophobicContact CB-CB 4.2Å; K128-A154 HydrophobicContact CD-CB 4.46Å; K128-A154 HydrophobicContact CG-CB 4.08Å; S150-A154 WeakPolarHBondContact O-CB 3.44Å; S150-A154 PolarHBondContact O-N 3.01Å; T151-A154 PolarHBondContact O-N 3.43Å; A154-S157 PolarHBondContact O-N 2.84Å; A154-A158 WeakPolarHBondContact O-CB 3.42Å; A154-A158 PolarHBondContact O-N 2.82Å
155Y98.8Very high98.6Very high0 Ų054.8 Ų54.80%030%0.297CS..Hα-helixtrans-68.8-35.5177.4-72.6-30000113.6K126 D130 R133 T151 V153 A158 Q159 L176 F180 F183K126-Y155 HydrophobicContact CG-CE1 4.38Å; K126-Y155 WeakPolarHBondContact O-CE1 3.47Å; D130-Y155 PolarHBondContact OD1-OH 2.91Å; R133-Y155 PolarHBondContact NE-OH 3.01Å; R133-Y155 VanDerWaalsContact NE-OH 3.13Å; T151-Y155 HydrophobicContact CG2-CD2 3.57Å; T151-Y155 HydrophobicContact CG2-CE2 3.35Å; T151-Y155 PolarHBondContact O-N 3.13Å; V153-Y155 PolarHBondContact O-N 3.38Å; Y155-A158 PolarHBondContact O-N 3.1Å; Y155-Q159 WeakPolarHBondContact O-CB 3.37Å; Y155-Q159 PolarHBondContact O-N 3.49Å; Y155-L176 HydrophobicContact CD1-CD1 3.54Å; Y155-L176 HydrophobicContact CE1-CD1 4.17Å; Y155-L176 HydrophobicContact CG-CD1 4.22Å; Y155-F180 HydrophobicContact CD2-CB 4.08Å; Y155-F180 AromaticContact CD2-CD2 3.49Å; Y155-F180 HydrophobicContact CD2-CD2 3.49Å; Y155-F180 VanDerWaalsContact CD2-CD2 3.49Å; Y155-F180 HydrophobicContact CD2-CE2 4.04Å; Y155-F180 AromaticContact CD2-CG 3.89Å; Y155-F180 HydrophobicContact CD2-CG 3.89Å; Y155-F180 HydrophobicContact CE2-CD2 4.35Å; Y155-F180 HydrophobicContact CG-CB 4.25Å; Y155-F180 HydrophobicContact CG-CD1 4.5Å; Y155-F180 HydrophobicContact CG-CD2 4.03Å; Y155-F180 HydrophobicContact CG-CE2 4.46Å; Y155-F180 HydrophobicContact CG-CG 4.05Å; Y155-F183 HydrophobicContact CD2-CB 4.3Å; Y155-F183 HydrophobicContact CD2-CD1 4.3Å; Y155-F183 HydrophobicContact CD2-CG 4.35Å; Y155-F183 HydrophobicContact CE2-CB 3.81Å; Y155-F183 HydrophobicContact CE2-CG 4.15Å
156K98.7Very high98.5Very high81 Ų8149.1 Ų49.135%0.35227%0.273SS..Hα-helixtrans-65-46.8174.7-81.2-68.5177.9-169.40111.6L152 V153 A158 Q159 D160 F180L152-K156 HydrophobicContact CD1-CG 4.21Å; L152-K156 VanDerWaalsContact O-CB 3.31Å; L152-K156 WeakPolarHBondContact O-CB 3.44Å; L152-K156 WeakPolarHBondContact O-CG 3.24Å; L152-K156 PolarHBondContact O-N 3.19Å; V153-K156 PolarHBondContact O-N 2.91Å; K156-A158 VanDerWaalsContact C-N 3.3Å; K156-A158 PolarHBondContact O-N 3.09Å; K156-Q159 PolarHBondContact O-N 3.11Å; K156-Q159 VanDerWaalsContact O-N 3.08Å; K156-D160 VanDerWaalsContact O-CG 3.26Å; K156-D160 PolarHBondContact O-N 3.33Å; K156-F180 HydrophobicContact CD-CE1 4.09Å; K156-F180 HydrophobicContact CD-CZ 4.1Å; K156-F180 HydrophobicContact CG-CE1 4.29Å; K156-F180 HydrophobicContact CG-CZ 3.97Å
157S98.5Very high98.4Very high49 Ų4945.3 Ų45.334%0.34326%0.263SS..Hα-helixtrans-60.1-40.1174.8-59.60000112.4V153 A154 I161V153-S157 PolarHBondContact O-N 3.35Å; V153-S157 PolarHBondContact O-OG 3.09Å; A154-S157 PolarHBondContact O-N 2.84Å; S157-I161 WeakPolarHBondContact O-CG1 3.4Å; S157-I161 PolarHBondContact O-N 3.28Å
158A98.8Very high98.3Very high0 Ų045.8 Ų45.80%027%0.266CS..Hα-helixtrans-64.4-40.8174.200000111.9V122 L125 A154 Y155 K156 A162 L176V122-A158 HydrophobicContact CG1-CB 4.36Å; L125-A158 HydrophobicContact CB-CB 3.68Å; A154-A158 WeakPolarHBondContact O-CB 3.42Å; A154-A158 PolarHBondContact O-N 2.82Å; Y155-A158 PolarHBondContact O-N 3.1Å; K156-A158 VanDerWaalsContact C-N 3.3Å; K156-A158 PolarHBondContact O-N 3.09Å; A158-A162 VanDerWaalsContact O-CB 3.24Å; A158-A162 WeakPolarHBondContact O-CB 3.24Å; A158-A162 PolarHBondContact O-N 3.25Å; A158-L176 VanDerWaalsContact C-CD2 3.46Å; A158-L176 HydrophobicContact CB-CD1 3.83Å; A158-L176 HydrophobicContact CB-CD2 3.59Å; A158-L176 HydrophobicContact CB-CG 4.37Å
159Q98.7Very high98.2Very high25 Ų2545.3 Ų45.312%0.11726%0.262CS..Hα-helixtrans-66.9-43.8-177.7175.7170.764.100110.9Y155 K156 I161 A162 L163 L176Y155-Q159 WeakPolarHBondContact O-CB 3.37Å; Y155-Q159 PolarHBondContact O-N 3.49Å; K156-Q159 PolarHBondContact O-N 3.11Å; K156-Q159 VanDerWaalsContact O-N 3.08Å; Q159-I161 VanDerWaalsContact C-N 3.32Å; Q159-I161 PolarHBondContact O-N 2.69Å; Q159-A162 PolarHBondContact O-N 2.78Å; Q159-L163 HydrophobicContact CG-CD1 3.73Å; Q159-L163 HydrophobicContact CG-CG 4.01Å; Q159-L163 WeakPolarHBondContact O-CB 3.29Å; Q159-L163 VanDerWaalsContact O-CG 3.24Å; Q159-L163 WeakPolarHBondContact O-CG 3.49Å; Q159-L163 PolarHBondContact O-N 3.15Å; Q159-L176 HydrophobicContact CB-CD2 4.13Å
160D98.6Very high98.1Very high104 Ų10442.7 Ų42.756%0.55625%0.25SC*.Hα-helixtrans-59.9-43.6-179.7-65.3-20.4000111.3K156 A164K156-D160 VanDerWaalsContact O-CG 3.26Å; K156-D160 PolarHBondContact O-N 3.33Å; D160-A164 WeakPolarHBondContact O-CB 3.49Å; D160-A164 PolarHBondContact O-N 3.33Å
161I98.7Very high98Very high42 Ų4242.7 Ų42.722%0.21525%0.248CC..Hα-helixtrans-68.5-44.7175.7-58.8168.7000110.6A118 K121 V122 L125 S157 Q159 L163 A164 D165A118-I161 HydrophobicContact CB-CG2 4Å; K121-I161 HydrophobicContact CB-CD1 4.09Å; K121-I161 HydrophobicContact CD-CD1 4.37Å; V122-I161 HydrophobicContact CG2-CB 3.8Å; V122-I161 HydrophobicContact CG2-CG2 3.61Å; L125-I161 HydrophobicContact CD1-CD1 3.82Å; S157-I161 WeakPolarHBondContact O-CG1 3.4Å; S157-I161 PolarHBondContact O-N 3.28Å; Q159-I161 VanDerWaalsContact C-N 3.32Å; Q159-I161 PolarHBondContact O-N 2.69Å; I161-L163 VanDerWaalsContact C-N 3.35Å; I161-L163 PolarHBondContact O-N 3.44Å; I161-A164 PolarHBondContact O-N 2.81Å; I161-D165 PolarHBondContact O-N 3.28Å
162A98.6Very high97.9Very high2 Ų243.9 Ų43.92%0.01726%0.255CS..Hα-helixtrans-63.7-39.1-17800000112.7V122 A158 Q159 A164 L166 R173 L176V122-A162 HydrophobicContact CG1-CB 3.95Å; V122-A162 HydrophobicContact CG2-CB 3.97Å; A158-A162 VanDerWaalsContact O-CB 3.24Å; A158-A162 WeakPolarHBondContact O-CB 3.24Å; A158-A162 PolarHBondContact O-N 3.25Å; Q159-A162 PolarHBondContact O-N 2.78Å; A162-A164 VanDerWaalsContact C-N 3.32Å; A162-L166 HydrophobicContact CB-CD1 4.2Å; A162-L166 WeakPolarHBondContact O-CB 3.35Å; A162-L166 PolarHBondContact O-N 3.34Å; A162-L166 VanDerWaalsContact O-N 3.09Å; A162-L166 VanDerWaalsContact O-O 3.08Å; A162-R173 HydrophobicContact CB-CB 4.25Å; A162-R173 HydrophobicContact CB-CG 4.1Å; A162-L176 HydrophobicContact CB-CD2 4.13Å
163L97.8Very high97.8Very high81 Ų8142.5 Ų42.542%0.42425%0.245SC..Hα-helixtrans-68.5-32.9177.4-69.7178.7000112.1Q159 I161Q159-L163 HydrophobicContact CG-CD1 3.73Å; Q159-L163 HydrophobicContact CG-CG 4.01Å; Q159-L163 WeakPolarHBondContact O-CB 3.29Å; Q159-L163 VanDerWaalsContact O-CG 3.24Å; Q159-L163 WeakPolarHBondContact O-CG 3.49Å; Q159-L163 PolarHBondContact O-N 3.15Å; I161-L163 VanDerWaalsContact C-N 3.35Å; I161-L163 PolarHBondContact O-N 3.44Å
164A98Very high97.8Very high76 Ų7638.1 Ų38.163%0.62822%0.218SC*.Hα-helixtrans-78.3-43.5179.700000112.9D160 I161 A162D160-A164 WeakPolarHBondContact O-CB 3.49Å; D160-A164 PolarHBondContact O-N 3.33Å; I161-A164 PolarHBondContact O-N 2.81Å; A162-A164 VanDerWaalsContact C-N 3.32Å
165D97.9Very high97.8Very high109 Ų10938.4 Ų38.458%0.58322%0.222SC*.Hα-helixtrans-117.3-11.7-162.1-63.8-29.2000114.6A118 I161A118-D165 HydrophobicContact CB-CB 3.47Å; A118-D165 VanDerWaalsContact CB-CB 3.47Å; I161-D165 PolarHBondContact O-N 3.28Å
166L97Very high97.8Very high18 Ų1838.6 Ų38.69%0.09422%0.223CC..SBendtrans-117.1136.7-178.2-55.1-179.5000111.4A118 V122 A162 H170 I172 R173A118-L166 HydrophobicContact CB-CD2 4.4Å; V122-L166 HydrophobicContact CB-CD1 4.22Å; V122-L166 HydrophobicContact CG1-CD1 4.29Å; V122-L166 HydrophobicContact CG2-CD1 4.03Å; A162-L166 HydrophobicContact CB-CD1 4.2Å; A162-L166 WeakPolarHBondContact O-CB 3.35Å; A162-L166 PolarHBondContact O-N 3.34Å; A162-L166 VanDerWaalsContact O-N 3.09Å; A162-L166 VanDerWaalsContact O-O 3.08Å; L166-H170 HydrophobicContact CB-CB 4.04Å; L166-I172 HydrophobicContact CD1-CG2 4.36Å; L166-R173 HydrophobicContact CB-CB 4.26Å; L166-R173 HydrophobicContact CD1-CB 4.39Å; L166-R173 PolarHBondContact O-NH1 3.23Å
167A96.2Very high97.8Very high47 Ų4735.2 Ų35.239%0.38821%0.21SC..  trans-58.1147.6174.500000111.3T169 H170 R173A167-T169 PolarHBondContact O-N 3.15Å; A167-T169 VanDerWaalsContact O-N 3.1Å; A167-H170 WeakPolarHBondContact O-CB 3.25Å; A167-H170 PolarHBondContact O-N 3.47Å; A167-R173 WeakPolarHBondContact O-CD 3.38Å
168P97.4Very high97.8Very high16 Ų1633.8 Ų33.810%0.10420%0.199CC..THydrogen-bonded Turntrans-52.1-31.8176.2-29.136.2000114.9H170 L174 E204 E208P168-H170 VanDerWaalsContact C-N 3.34Å; P168-L174 WeakPolarHBondContact O-CG 3.2Å; P168-E204 HydrophobicContact CB-CB 3.89Å; P168-E204 HydrophobicContact CG-CB 4.38Å; P168-E208 WeakPolarHBondContact CD-OE2 3.48Å
169T96.9Very high97.8Very high5 Ų535.2 Ų35.23%0.03121%0.206CC..THydrogen-bonded Turntrans-80.4-9.9176.847.70000113.8A167 P171 L174 A205 E208 L209 L212 S220A167-T169 PolarHBondContact O-N 3.15Å; A167-T169 VanDerWaalsContact O-N 3.1Å; T169-P171 WeakPolarHBondContact O-CD 3.47Å; T169-L174 WeakPolarHBondContact O-CD1 3.3Å; T169-A205 HydrophobicContact CG2-CB 4.39Å; T169-A205 WeakPolarHBondContact CG2-O 3.21Å; T169-E208 HydrophobicContact CG2-CB 4.02Å; T169-L209 HydrophobicContact CG2-CD1 4.47Å; T169-L212 HydrophobicContact CG2-CD1 4Å; T169-L212 HydrophobicContact CG2-CD2 4.43Å; T169-L212 HydrophobicContact CG2-CG 4.23Å; T169-L212 WeakPolarHBondContact OG1-CD2 3.39Å; T169-S220 WeakPolarHBondContact O-CB 3.45Å; T169-S220 PolarHBondContact O-OG 3.45Å
170H95.8Very high97.8Very high49 Ų4934 Ų3423%0.22720%0.201CC..  trans-62.1126.1-175.2-168.1-71000111.2L166 A167 P168 I172 R173 L174L166-H170 HydrophobicContact CB-CB 4.04Å; A167-H170 WeakPolarHBondContact O-CB 3.25Å; A167-H170 PolarHBondContact O-N 3.47Å; P168-H170 VanDerWaalsContact C-N 3.34Å; H170-I172 VanDerWaalsContact C-N 3.28Å; H170-I172 PolarHBondContact ND1-N 3.47Å; H170-I172 PolarHBondContact O-N 3.28Å; H170-I172 VanDerWaalsContact O-N 3.11Å; H170-R173 HydrophobicContact CB-CB 4.27Å; H170-R173 WeakPolarHBondContact O-CB 3.45Å; H170-R173 PolarHBondContact O-N 3.45Å; H170-L174 PolarHBondContact O-N 3.28Å
171P95.8Very high97.8Very high33 Ų3329 Ų2921%0.21417%0.174CC..Hα-helixtrans-54.9-38-173.9-30.736000114.6T169 G175 D219 I223T169-P171 WeakPolarHBondContact O-CD 3.47Å; P171-G175 PolarHBondContact O-N 3.04Å; P171-D219 HydrophobicContact CB-CB 4.41Å; P171-D219 HydrophobicContact CG-CB 3.91Å; P171-I223 HydrophobicContact CB-CD1 3.86Å; P171-I223 VanDerWaalsContact O-CD1 3.32Å; P171-I223 WeakPolarHBondContact O-CD1 3.39Å
172I96.6Very high97.7Very high26 Ų2627.9 Ų27.913%0.13317%0.169CC..Hα-helixtrans-66.3-39.2176.2-69.2170.6000112.5E119 V122 F123 L166 H170 L176E119-I172 HydrophobicContact CG-CD1 3.4Å; V122-I172 HydrophobicContact CB-CG2 3.97Å; V122-I172 HydrophobicContact CG1-CG2 3.5Å; V122-I172 VanDerWaalsContact CG1-CG2 3.5Å; F123-I172 HydrophobicContact CB-CD1 4.35Å; F123-I172 HydrophobicContact CD2-CD1 3.92Å; F123-I172 HydrophobicContact CD2-CG1 4.34Å; L166-I172 HydrophobicContact CD1-CG2 4.36Å; H170-I172 VanDerWaalsContact C-N 3.28Å; H170-I172 PolarHBondContact ND1-N 3.47Å; H170-I172 PolarHBondContact O-N 3.28Å; H170-I172 VanDerWaalsContact O-N 3.11Å; I172-L176 WeakPolarHBondContact O-CB 3.48Å; I172-L176 PolarHBondContact O-N 3.36Å
173R98Very high97.8Very high31 Ų3127.8 Ų27.812%0.11717%0.168CC..Hα-helixtrans-67.1-45.8176.3176.5175.3168.2167.3-6.3110.5A162 L166 A167 H170 L176 A177 E204A162-R173 HydrophobicContact CB-CB 4.25Å; A162-R173 HydrophobicContact CB-CG 4.1Å; L166-R173 HydrophobicContact CB-CB 4.26Å; L166-R173 HydrophobicContact CD1-CB 4.39Å; L166-R173 PolarHBondContact O-NH1 3.23Å; A167-R173 WeakPolarHBondContact O-CD 3.38Å; H170-R173 HydrophobicContact CB-CB 4.27Å; H170-R173 WeakPolarHBondContact O-CB 3.45Å; H170-R173 PolarHBondContact O-N 3.45Å; R173-L176 WeakPolarHBondContact O-CB 3.46Å; R173-L176 PolarHBondContact O-N 3.01Å; R173-A177 PolarHBondContact O-N 2.9Å; R173-E204 IonicContact CZ-OE2 2.84Å; R173-E204 IonicContact NH2-OE2 2.65Å; R173-E204 PolarHBondContact NH2-OE2 3.04Å
174L98.3Very high97.8Very high2 Ų224.8 Ų24.81%0.0115%0.151CC..Hα-helixtrans-59.9-46.9174.8-75.7173.4000111.9P168 T169 H170 L176 A177 L178 A205 I223 M224 L227P168-L174 WeakPolarHBondContact O-CG 3.2Å; T169-L174 WeakPolarHBondContact O-CD1 3.3Å; H170-L174 PolarHBondContact O-N 3.28Å; L174-L176 VanDerWaalsContact C-N 3.3Å; L174-L176 PolarHBondContact O-N 3.34Å; L174-A177 PolarHBondContact O-N 2.86Å; L174-L178 PolarHBondContact O-N 3.48Å; L174-A205 HydrophobicContact CD2-CB 3.76Å; L174-I223 HydrophobicContact CB-CB 4.15Å; L174-I223 HydrophobicContact CB-CD1 4.37Å; L174-I223 HydrophobicContact CB-CG2 3.67Å; L174-M224 HydrophobicContact CD1-CG 4.05Å; L174-M224 HydrophobicContact CD2-CG 4.21Å; L174-L227 HydrophobicContact CD2-CD1 4.01Å
175G98.1Very high97.8Very high11 Ų1123.6 Ų23.611%0.11313%0.131CC..Hα-helixtrans-64.1-33.8178.700000112.9K126 P171 N179K126-G175 WeakPolarHBondContact CE-O 3.43Å; P171-G175 PolarHBondContact O-N 3.04Å; G175-N179 PolarHBondContact O-N 3.47Å; G175-N179 VanDerWaalsContact O-N 3.13Å
176L98.7Very high97.7Very high4 Ų423.4 Ų23.42%0.02113%0.127CC..Hα-helixtrans-65-49.1171.3172.265000111.1V122 K126 Y155 A158 Q159 A162 I172 R173 L174 L178 N179 F180V122-L176 HydrophobicContact CG1-CD2 4.13Å; K126-L176 HydrophobicContact CB-CD1 4.1Å; K126-L176 HydrophobicContact CD-CB 4.18Å; K126-L176 HydrophobicContact CG-CB 4.41Å; K126-L176 HydrophobicContact CG-CD1 4.04Å; Y155-L176 HydrophobicContact CD1-CD1 3.54Å; Y155-L176 HydrophobicContact CE1-CD1 4.17Å; Y155-L176 HydrophobicContact CG-CD1 4.22Å; A158-L176 VanDerWaalsContact C-CD2 3.46Å; A158-L176 HydrophobicContact CB-CD1 3.83Å; A158-L176 HydrophobicContact CB-CD2 3.59Å; A158-L176 HydrophobicContact CB-CG 4.37Å; Q159-L176 HydrophobicContact CB-CD2 4.13Å; A162-L176 HydrophobicContact CB-CD2 4.13Å; I172-L176 WeakPolarHBondContact O-CB 3.48Å; I172-L176 PolarHBondContact O-N 3.36Å; R173-L176 WeakPolarHBondContact O-CB 3.46Å; R173-L176 PolarHBondContact O-N 3.01Å; L174-L176 VanDerWaalsContact C-N 3.3Å; L174-L176 PolarHBondContact O-N 3.34Å; L176-L178 VanDerWaalsContact C-N 3.29Å; L176-L178 PolarHBondContact O-N 3.39Å; L176-N179 PolarHBondContact O-N 3.33Å; L176-F180 VanDerWaalsContact O-CB 3.24Å; L176-F180 WeakPolarHBondContact O-CB 3.34Å; L176-F180 PolarHBondContact O-N 3.41Å
177A98.7Very high97.8Very high9 Ų923.4 Ų23.47%0.07413%0.126CC..Hα-helixtrans-60.7-39.1179.200000112.2R173 L174 S181 A201R173-A177 PolarHBondContact O-N 2.9Å; L174-A177 PolarHBondContact O-N 2.86Å; A177-S181 WeakPolarHBondContact O-CB 3.39Å; A177-S181 PolarHBondContact O-N 3.31Å; A177-S181 PolarHBondContact O-OG 3.24Å; A177-A201 HydrophobicContact CB-CB 3.49Å; A177-A201 VanDerWaalsContact CB-CB 3.49Å
178L98.7Very high97.8Very high20 Ų2024 Ų2411%0.10512%0.122CC..Hα-helixtrans-58.5-53.3173.217864.6000111.3L174 L176 F180 S181 V182 I223 L226 L227 N230L174-L178 PolarHBondContact O-N 3.48Å; L176-L178 VanDerWaalsContact C-N 3.29Å; L176-L178 PolarHBondContact O-N 3.39Å; L178-F180 VanDerWaalsContact C-N 3.33Å; L178-F180 PolarHBondContact O-N 3Å; L178-S181 PolarHBondContact O-N 3.13Å; L178-S181 PolarHBondContact O-OG 3.12Å; L178-V182 WeakPolarHBondContact O-CG2 3.42Å; L178-V182 PolarHBondContact O-N 2.75Å; L178-V182 VanDerWaalsContact O-N 3.13Å; L178-I223 HydrophobicContact CB-CG2 4.45Å; L178-I223 HydrophobicContact CD2-CG2 4.21Å; L178-L226 HydrophobicContact CD1-CB 4.14Å; L178-L226 HydrophobicContact CD2-CB 3.86Å; L178-L226 HydrophobicContact CD2-CD1 3.91Å; L178-L227 HydrophobicContact CB-CD2 3.93Å; L178-L227 HydrophobicContact CB-CG 4.27Å; L178-L227 HydrophobicContact CD1-CD2 3.88Å; L178-L227 HydrophobicContact CD1-CG 4.13Å; L178-N230 WeakPolarHBondContact CD1-ND2 3.43Å
179N98.4Very high97.8Very high29 Ų2929.9 Ų29.916%0.15515%0.153CC..Hα-helixtrans-72-30.1-176.2-72.313000112.7K126 D130 G175 L176 F183K126-N179 PolarHBondContact NZ-ND2 3.47Å; D130-N179 VanDerWaalsContact CG-ND2 3.26Å; D130-N179 PolarHBondContact OD1-ND2 3.16Å; D130-N179 PolarHBondContact OD2-ND2 3.46Å; G175-N179 PolarHBondContact O-N 3.47Å; G175-N179 VanDerWaalsContact O-N 3.13Å; L176-N179 PolarHBondContact O-N 3.33Å; N179-F183 PolarHBondContact O-N 3.5Å
180F98.8Very high97.8Very high0 Ų031.2 Ų31.20%016%0.163CC..Hα-helixtrans-74.5-36.5177.2-164.3-176.4000111.7L152 Y155 K156 L176 L178 F183 Y184 L197L152-F180 HydrophobicContact CD1-CE2 3.77Å; L152-F180 HydrophobicContact CD1-CZ 3.76Å; Y155-F180 HydrophobicContact CD2-CB 4.08Å; Y155-F180 AromaticContact CD2-CD2 3.49Å; Y155-F180 HydrophobicContact CD2-CD2 3.49Å; Y155-F180 VanDerWaalsContact CD2-CD2 3.49Å; Y155-F180 HydrophobicContact CD2-CE2 4.04Å; Y155-F180 AromaticContact CD2-CG 3.89Å; Y155-F180 HydrophobicContact CD2-CG 3.89Å; Y155-F180 HydrophobicContact CE2-CD2 4.35Å; Y155-F180 HydrophobicContact CG-CB 4.25Å; Y155-F180 HydrophobicContact CG-CD1 4.5Å; Y155-F180 HydrophobicContact CG-CD2 4.03Å; Y155-F180 HydrophobicContact CG-CE2 4.46Å; Y155-F180 HydrophobicContact CG-CG 4.05Å; K156-F180 HydrophobicContact CD-CE1 4.09Å; K156-F180 HydrophobicContact CD-CZ 4.1Å; K156-F180 HydrophobicContact CG-CE1 4.29Å; K156-F180 HydrophobicContact CG-CZ 3.97Å; L176-F180 VanDerWaalsContact O-CB 3.24Å; L176-F180 WeakPolarHBondContact O-CB 3.34Å; L176-F180 PolarHBondContact O-N 3.41Å; L178-F180 VanDerWaalsContact C-N 3.33Å; L178-F180 PolarHBondContact O-N 3Å; F180-F183 HydrophobicContact CD2-CB 4.46Å; F180-F183 AromaticContact CD2-CD1 3.87Å; F180-F183 HydrophobicContact CD2-CD1 3.87Å; F180-F183 AromaticContact CE2-CD1 3.84Å; F180-F183 HydrophobicContact CE2-CD1 3.84Å; F180-F183 HydrophobicContact CE2-CE1 4.28Å; F180-F183 WeakPolarHBondContact O-CB 3.5Å; F180-F183 PolarHBondContact O-N 3.37Å; F180-Y184 HydrophobicContact CD1-CE2 4.36Å; F180-Y184 AromaticContact CD2-CD2 3.86Å; F180-Y184 HydrophobicContact CD2-CD2 3.86Å; F180-Y184 AromaticContact CD2-CE2 3.5Å; F180-Y184 HydrophobicContact CD2-CE2 3.5Å; F180-Y184 VanDerWaalsContact CD2-CE2 3.5Å; F180-Y184 HydrophobicContact CE1-CE2 4.17Å; F180-Y184 AromaticContact CE2-CD2 3.99Å; F180-Y184 HydrophobicContact CE2-CD2 3.99Å; F180-Y184 HydrophobicContact CE2-CE1 4.35Å; F180-Y184 AromaticContact CE2-CE2 3.25Å; F180-Y184 HydrophobicContact CE2-CE2 3.25Å; F180-Y184 AromaticContact CE2-CZ 3.46Å; F180-Y184 VanDerWaalsContact CE2-CZ 3.46Å; F180-Y184 WeakPolarHBondContact CE2-OH 3.44Å; F180-Y184 HydrophobicContact CG-CD2 4.48Å; F180-Y184 HydrophobicContact CG-CE2 4.07Å; F180-Y184 AromaticContact CZ-CE2 3.63Å; F180-Y184 HydrophobicContact CZ-CE2 3.63Å; F180-Y184 AromaticContact CZ-CZ 3.69Å; F180-Y184 VanDerWaalsContact CZ-OH 3.22Å; F180-Y184 WeakPolarHBondContact CZ-OH 3.47Å; F180-Y184 VanDerWaalsContact O-CD2 3.24Å; F180-Y184 WeakPolarHBondContact O-CD2 3.3Å; F180-Y184 PolarHBondContact O-N 3.5Å; F180-L197 HydrophobicContact CB-CD2 3.82Å; F180-L197 HydrophobicContact CD1-CD2 3.85Å; F180-L197 HydrophobicContact CG-CD2 3.79Å
181S98.6Very high97.8Very high0 Ų030.6 Ų30.60%016%0.163CC..Hα-helixtrans-64.6-43.7172.359.90000111.5A177 L178 F183 Y184 Y185 A194A177-S181 WeakPolarHBondContact O-CB 3.39Å; A177-S181 PolarHBondContact O-N 3.31Å; A177-S181 PolarHBondContact O-OG 3.24Å; L178-S181 PolarHBondContact O-N 3.13Å; L178-S181 PolarHBondContact O-OG 3.12Å; S181-F183 VanDerWaalsContact C-N 3.28Å; S181-F183 PolarHBondContact O-N 2.9Å; S181-Y184 PolarHBondContact O-N 3.44Å; S181-Y184 VanDerWaalsContact O-N 3.15Å; S181-Y185 PolarHBondContact O-N 3.48Å; S181-A194 WeakPolarHBondContact CB-O 3.42Å; S181-A194 WeakPolarHBondContact O-CB 3.42Å
182V98.4Very high97.8Very high18 Ų1834.9 Ų34.911%0.10918%0.184CC..Hα-helixtrans-57.2-40.7172.9171.90000111.6L178 Y185 E186 N230 W234L178-V182 WeakPolarHBondContact O-CG2 3.42Å; L178-V182 PolarHBondContact O-N 2.75Å; L178-V182 VanDerWaalsContact O-N 3.13Å; V182-Y185 PolarHBondContact O-N 3.13Å; V182-E186 HydrophobicContact CG1-CG 4.06Å; V182-E186 WeakPolarHBondContact CG1-OE2 3.39Å; V182-E186 WeakPolarHBondContact O-CB 3.43Å; V182-E186 PolarHBondContact O-N 2.81Å; V182-N230 WeakPolarHBondContact CG2-ND2 3.45Å; V182-W234 HydrophobicContact CG2-CH2 4.13Å; V182-W234 HydrophobicContact CG2-CZ2 4.05Å
183F98.7Very high97.8Very high0 Ų041.2 Ų41.20%021%0.206CC..Hα-helixtrans-62.2-45.2175.2170.6-108.9000113.3R133 A148 T151 L152 Y155 N179 F180 S181 Y185 I187 L188R133-F183 HydrophobicContact CG-CD2 4.23Å; A148-F183 HydrophobicContact CB-CE2 4.37Å; A148-F183 HydrophobicContact CB-CZ 4.44Å; A148-F183 VanDerWaalsContact O-CZ 3.3Å; A148-F183 WeakPolarHBondContact O-CZ 3.49Å; T151-F183 HydrophobicContact CG2-CB 4.46Å; T151-F183 HydrophobicContact CG2-CD1 4.13Å; T151-F183 HydrophobicContact CG2-CD2 3.34Å; T151-F183 HydrophobicContact CG2-CE1 4.16Å; T151-F183 HydrophobicContact CG2-CE2 3.41Å; T151-F183 VanDerWaalsContact CG2-CE2 3.41Å; T151-F183 HydrophobicContact CG2-CG 3.72Å; T151-F183 HydrophobicContact CG2-CZ 3.83Å; L152-F183 HydrophobicContact CB-CE1 3.98Å; L152-F183 HydrophobicContact CB-CZ 4.19Å; L152-F183 HydrophobicContact CD1-CE1 4.12Å; Y155-F183 HydrophobicContact CD2-CB 4.3Å; Y155-F183 HydrophobicContact CD2-CD1 4.3Å; Y155-F183 HydrophobicContact CD2-CG 4.35Å; Y155-F183 HydrophobicContact CE2-CB 3.81Å; Y155-F183 HydrophobicContact CE2-CG 4.15Å; N179-F183 PolarHBondContact O-N 3.5Å; F180-F183 HydrophobicContact CD2-CB 4.46Å; F180-F183 AromaticContact CD2-CD1 3.87Å; F180-F183 HydrophobicContact CD2-CD1 3.87Å; F180-F183 AromaticContact CE2-CD1 3.84Å; F180-F183 HydrophobicContact CE2-CD1 3.84Å; F180-F183 HydrophobicContact CE2-CE1 4.28Å; F180-F183 WeakPolarHBondContact O-CB 3.5Å; F180-F183 PolarHBondContact O-N 3.37Å; S181-F183 VanDerWaalsContact C-N 3.28Å; S181-F183 PolarHBondContact O-N 2.9Å; F183-Y185 PolarHBondContact O-N 2.96Å; F183-I187 HydrophobicContact CD2-CB 3.55Å; F183-I187 HydrophobicContact CD2-CG1 3.7Å; F183-I187 HydrophobicContact CD2-CG2 3.98Å; F183-I187 HydrophobicContact CE2-CB 3.66Å; F183-I187 HydrophobicContact CE2-CG1 4.17Å; F183-I187 HydrophobicContact CE2-CG2 3.55Å; F183-I187 WeakPolarHBondContact O-CB 3.47Å; F183-I187 PolarHBondContact O-N 3.37Å; F183-L188 HydrophobicContact CD1-CD1 4.04Å; F183-L188 HydrophobicContact CD1-CG 4.26Å; F183-L188 HydrophobicContact CE1-CD1 3.31Å; F183-L188 HydrophobicContact CE1-CD2 4.28Å; F183-L188 HydrophobicContact CE1-CG 3.63Å; F183-L188 HydrophobicContact CE2-CD2 4.4Å; F183-L188 HydrophobicContact CE2-CG 4.19Å; F183-L188 HydrophobicContact CZ-CD1 3.72Å; F183-L188 HydrophobicContact CZ-CD2 3.79Å; F183-L188 HydrophobicContact CZ-CG 3.58Å; F183-L188 PolarHBondContact O-N 3.38Å; F183-L188 VanDerWaalsContact O-N 3.13Å
184Y98.5Very high97.8Very high18 Ų1839.7 Ų39.77%0.07120%0.201CC..Hα-helixtrans-59.3-40175.6-81-63000111.6L152 F180 S181 L188 N189 S190 R193 L197L152-Y184 HydrophobicContact CD1-CE1 4.47Å; F180-Y184 HydrophobicContact CD1-CE2 4.36Å; F180-Y184 AromaticContact CD2-CD2 3.86Å; F180-Y184 HydrophobicContact CD2-CD2 3.86Å; F180-Y184 AromaticContact CD2-CE2 3.5Å; F180-Y184 HydrophobicContact CD2-CE2 3.5Å; F180-Y184 VanDerWaalsContact CD2-CE2 3.5Å; F180-Y184 HydrophobicContact CE1-CE2 4.17Å; F180-Y184 AromaticContact CE2-CD2 3.99Å; F180-Y184 HydrophobicContact CE2-CD2 3.99Å; F180-Y184 HydrophobicContact CE2-CE1 4.35Å; F180-Y184 AromaticContact CE2-CE2 3.25Å; F180-Y184 HydrophobicContact CE2-CE2 3.25Å; F180-Y184 AromaticContact CE2-CZ 3.46Å; F180-Y184 VanDerWaalsContact CE2-CZ 3.46Å; F180-Y184 WeakPolarHBondContact CE2-OH 3.44Å; F180-Y184 HydrophobicContact CG-CD2 4.48Å; F180-Y184 HydrophobicContact CG-CE2 4.07Å; F180-Y184 AromaticContact CZ-CE2 3.63Å; F180-Y184 HydrophobicContact CZ-CE2 3.63Å; F180-Y184 AromaticContact CZ-CZ 3.69Å; F180-Y184 VanDerWaalsContact CZ-OH 3.22Å; F180-Y184 WeakPolarHBondContact CZ-OH 3.47Å; F180-Y184 VanDerWaalsContact O-CD2 3.24Å; F180-Y184 WeakPolarHBondContact O-CD2 3.3Å; F180-Y184 PolarHBondContact O-N 3.5Å; S181-Y184 PolarHBondContact O-N 3.44Å; S181-Y184 VanDerWaalsContact O-N 3.15Å; Y184-L188 HydrophobicContact CD1-CD1 3.73Å; Y184-L188 HydrophobicContact CE1-CD1 3.86Å; Y184-L188 CarbonylContact O-C 3.55Å; Y184-N189 PolarHBondContact O-N 3.28Å; Y184-S190 PolarHBondContact O-N 3.01Å; Y184-R193 HydrophobicContact CD1-CB 3.95Å; Y184-R193 HydrophobicContact CE1-CB 4.42Å; Y184-R193 HydrophobicContact CG-CB 4.02Å; Y184-L197 HydrophobicContact CD2-CD2 4.03Å; Y184-L197 HydrophobicContact CE2-CD2 3.94Å
185Y98.1Very high97.8Very high51 Ų5140.3 Ų40.320%0.221%0.205CC..Hα-helixtrans-71.4-63.3-179.6-165.8-86.2000111.4S181 V182 F183 N189 P191 A194 W234 D237S181-Y185 PolarHBondContact O-N 3.48Å; V182-Y185 PolarHBondContact O-N 3.13Å; F183-Y185 PolarHBondContact O-N 2.96Å; Y185-N189 WeakPolarHBondContact O-CA 3.35Å; Y185-N189 PolarHBondContact O-N 3.03Å; Y185-P191 HydrophobicContact CD2-CB 3.9Å; Y185-P191 HydrophobicContact CE2-CB 3.79Å; Y185-A194 HydrophobicContact CD2-CB 4.19Å; Y185-A194 HydrophobicContact CG-CB 4.46Å; Y185-W234 AromaticContact CD1-CD1 3.97Å; Y185-W234 AromaticContact CD1-NE1 3.56Å; Y185-W234 HydrophobicContact CD2-CB 4.11Å; Y185-W234 AromaticContact CD2-CD1 3.57Å; Y185-W234 AromaticContact CD2-CD2 3.59Å; Y185-W234 HydrophobicContact CD2-CD2 3.59Å; Y185-W234 AromaticContact CD2-CE2 3.71Å; Y185-W234 HydrophobicContact CD2-CE3 4.26Å; Y185-W234 AromaticContact CD2-CG 3.5Å; Y185-W234 HydrophobicContact CD2-CG 3.5Å; Y185-W234 VanDerWaalsContact CD2-CG 3.5Å; Y185-W234 HydrophobicContact CD2-CZ2 4.45Å; Y185-W234 AromaticContact CD2-NE1 3.68Å; Y185-W234 AromaticContact CE1-CD1 3.68Å; Y185-W234 AromaticContact CE1-NE1 3.67Å; Y185-W234 HydrophobicContact CE2-CB 3.63Å; Y185-W234 AromaticContact CE2-CD1 3.24Å; Y185-W234 AromaticContact CE2-CD2 3.96Å; Y185-W234 HydrophobicContact CE2-CD2 3.96Å; Y185-W234 AromaticContact CE2-CG 3.32Å; Y185-W234 HydrophobicContact CE2-CG 3.32Å; Y185-W234 AromaticContact CE2-NE1 3.8Å; Y185-W234 AromaticContact CG-CD1 3.93Å; Y185-W234 HydrophobicContact CG-CD2 4.03Å; Y185-W234 AromaticContact CG-CE2 3.64Å; Y185-W234 HydrophobicContact CG-CG 4.2Å; Y185-W234 HydrophobicContact CG-CZ2 4.07Å; Y185-W234 AromaticContact CG-NE1 3.57Å; Y185-W234 AromaticContact CZ-CD1 3.3Å; Y185-W234 AromaticContact CZ-CG 3.89Å; Y185-W234 AromaticContact CZ-NE1 3.79Å; Y185-D237 PolarHBondContact OH-OD2 3.41Å
186E96.6Very high97.8Very high105 Ų10543.5 Ų43.549%0.49123%0.226SC..Hα-helixtrans-79-31.2-167.6-63.6-176170.900114V182V182-E186 HydrophobicContact CG1-CG 4.06Å; V182-E186 WeakPolarHBondContact CG1-OE2 3.39Å; V182-E186 WeakPolarHBondContact O-CB 3.43Å; V182-E186 PolarHBondContact O-N 2.81Å
187I98.1Very high97.8Very high18 Ų1844.2 Ų44.29%0.09223%0.229CC..THydrogen-bonded Turntrans-104.3-45.1-173.3-54-57.5000112.1R133 A136 E137 A148 F183R133-I187 HydrophobicContact CG-CG1 4.02Å; A136-I187 HydrophobicContact CB-CD1 4.42Å; A136-I187 HydrophobicContact CB-CG2 3.88Å; E137-I187 HydrophobicContact CG-CD1 3.91Å; A148-I187 HydrophobicContact CB-CG2 4.01Å; F183-I187 HydrophobicContact CD2-CB 3.55Å; F183-I187 HydrophobicContact CD2-CG1 3.7Å; F183-I187 HydrophobicContact CD2-CG2 3.98Å; F183-I187 HydrophobicContact CE2-CB 3.66Å; F183-I187 HydrophobicContact CE2-CG1 4.17Å; F183-I187 HydrophobicContact CE2-CG2 3.55Å; F183-I187 WeakPolarHBondContact O-CB 3.47Å; F183-I187 PolarHBondContact O-N 3.37Å
188L97.5Very high97.7Very high58 Ų5843.8 Ų43.830%0.30423%0.226SC..THydrogen-bonded Turntrans-91.1-1.7-178.6-62.7-173.5000113.8A148 F183 Y184 S190A148-L188 HydrophobicContact CB-CD2 4.39Å; F183-L188 HydrophobicContact CD1-CD1 4.04Å; F183-L188 HydrophobicContact CD1-CG 4.26Å; F183-L188 HydrophobicContact CE1-CD1 3.31Å; F183-L188 HydrophobicContact CE1-CD2 4.28Å; F183-L188 HydrophobicContact CE1-CG 3.63Å; F183-L188 HydrophobicContact CE2-CD2 4.4Å; F183-L188 HydrophobicContact CE2-CG 4.19Å; F183-L188 HydrophobicContact CZ-CD1 3.72Å; F183-L188 HydrophobicContact CZ-CD2 3.79Å; F183-L188 HydrophobicContact CZ-CG 3.58Å; F183-L188 PolarHBondContact O-N 3.38Å; F183-L188 VanDerWaalsContact O-N 3.13Å; Y184-L188 HydrophobicContact CD1-CD1 3.73Å; Y184-L188 HydrophobicContact CE1-CD1 3.86Å; Y184-L188 CarbonylContact O-C 3.55Å; L188-S190 PolarHBondContact O-N 3.15Å; L188-S190 PolarHBondContact O-OG 3.03Å
189N96.3Very high97.7Very high141 Ų14148.6 Ų48.675%0.75425%0.246SC*.  trans48.345.2-179.1-163.252.9000112.1Y184 Y185 P191Y184-N189 PolarHBondContact O-N 3.28Å; Y185-N189 WeakPolarHBondContact O-CA 3.35Å; Y185-N189 PolarHBondContact O-N 3.03Å; N189-P191 VanDerWaalsContact C-CD 3.42Å; N189-P191 WeakPolarHBondContact O-CD 3.48Å
190S97Very high97.7Very high33 Ų3351.6 Ų51.623%0.23126%0.259CS..  trans-122.866.7-174.8-65.10000110.1Y184 L188 D192 R193 A194Y184-S190 PolarHBondContact O-N 3.01Å; L188-S190 PolarHBondContact O-N 3.15Å; L188-S190 PolarHBondContact O-OG 3.03Å; S190-D192 VanDerWaalsContact C-N 3.32Å; S190-D192 PolarHBondContact O-N 3.36Å; S190-R193 PolarHBondContact O-N 2.91Å; S190-R193 VanDerWaalsContact O-N 3.11Å; S190-A194 PolarHBondContact O-N 3.09Å; S190-A194 VanDerWaalsContact O-N 3.09Å
191P96.6Very high97.6Very high35 Ų3552.1 Ų52.123%0.22726%0.263CS..Hα-helixtrans-58.8-39.5-172.123.3-34.1000112.9Y185 N189 R193 A194 C195 I238Y185-P191 HydrophobicContact CD2-CB 3.9Å; Y185-P191 HydrophobicContact CE2-CB 3.79Å; N189-P191 VanDerWaalsContact C-CD 3.42Å; N189-P191 WeakPolarHBondContact O-CD 3.48Å; P191-R193 VanDerWaalsContact C-N 3.31Å; P191-R193 PolarHBondContact O-N 3.18Å; P191-A194 WeakPolarHBondContact O-CB 3.48Å; P191-A194 PolarHBondContact O-N 3.13Å; P191-A194 VanDerWaalsContact O-N 3.13Å; P191-C195 WeakPolarHBondContact O-CB 3.43Å; P191-C195 PolarHBondContact O-N 2.83Å; P191-C195 PolarHBondContact O-SG 3.26Å; P191-I238 HydrophobicContact CB-CD1 4.11Å; P191-I238 HydrophobicContact CB-CG1 4.28Å
192D95.6Very high97.6Very high123 Ų12354.3 Ų54.366%0.65827%0.273SS*.Hα-helixtrans-58.4-42.6177-65.2-33.9000112.6S190 S196S190-D192 VanDerWaalsContact C-N 3.32Å; S190-D192 PolarHBondContact O-N 3.36Å; D192-S196 VanDerWaalsContact O-CB 3.24Å; D192-S196 WeakPolarHBondContact O-CB 3.43Å; D192-S196 PolarHBondContact O-N 3.3Å
193R97Very high97.6Very high159 Ų15957.2 Ų57.260%0.629%0.288SS*.Hα-helixtrans-68.7-39.1177.7-70.5-173.1178179.31.1111.3Y184 S190 P191 L197Y184-R193 HydrophobicContact CD1-CB 3.95Å; Y184-R193 HydrophobicContact CE1-CB 4.42Å; Y184-R193 HydrophobicContact CG-CB 4.02Å; S190-R193 PolarHBondContact O-N 2.91Å; S190-R193 VanDerWaalsContact O-N 3.11Å; P191-R193 VanDerWaalsContact C-N 3.31Å; P191-R193 PolarHBondContact O-N 3.18Å; R193-L197 WeakPolarHBondContact O-CB 3.42Å; R193-L197 PolarHBondContact O-N 3.11Å
194A97.9Very high97.5Very high0 Ų059.8 Ų59.80%030%0.3CS..Hα-helixtrans-61.1-52176.300000111.2S181 Y185 S190 P191 L197 A198 W234S181-A194 WeakPolarHBondContact CB-O 3.42Å; S181-A194 WeakPolarHBondContact O-CB 3.42Å; Y185-A194 HydrophobicContact CD2-CB 4.19Å; Y185-A194 HydrophobicContact CG-CB 4.46Å; S190-A194 PolarHBondContact O-N 3.09Å; S190-A194 VanDerWaalsContact O-N 3.09Å; P191-A194 WeakPolarHBondContact O-CB 3.48Å; P191-A194 PolarHBondContact O-N 3.13Å; P191-A194 VanDerWaalsContact O-N 3.13Å; A194-L197 PolarHBondContact O-N 2.95Å; A194-A198 WeakPolarHBondContact O-CB 3.41Å; A194-A198 PolarHBondContact O-N 3.34Å; A194-W234 HydrophobicContact CB-CE3 4.18Å; A194-W234 HydrophobicContact CB-CH2 4.37Å; A194-W234 HydrophobicContact CB-CZ3 3.91Å
195C97.7Very high97.4Very high15 Ų1559 Ų5910%0.10130%0.296CS..Hα-helixtrans-62-44.5178.4-70.80000111.8P191 L197 A198 K199 L231P191-C195 WeakPolarHBondContact O-CB 3.43Å; P191-C195 PolarHBondContact O-N 2.83Å; P191-C195 PolarHBondContact O-SG 3.26Å; C195-L197 PolarHBondContact O-N 3.48Å; C195-A198 PolarHBondContact O-N 3.01Å; C195-K199 WeakPolarHBondContact O-CB 3.34Å; C195-K199 PolarHBondContact O-N 2.9Å; C195-L231 HydrophobicContact CB-CD2 4.14Å; C195-L231 WeakPolarHBondContact O-CD2 3.38Å
196S97.6Very high97.3Very high78 Ų7860.5 Ų60.555%0.54531%0.307SS..Hα-helixtrans-60.3-44.6177.5-174.90000112D192 Q200D192-S196 VanDerWaalsContact O-CB 3.24Å; D192-S196 WeakPolarHBondContact O-CB 3.43Å; D192-S196 PolarHBondContact O-N 3.3Å; S196-Q200 WeakPolarHBondContact O-CB 3.19Å; S196-Q200 PolarHBondContact O-N 3.43Å
197L98.2Very high97.2Very high19 Ų1959.8 Ų59.810%0.09931%0.314CS..Hα-helixtrans-67.9-46.3-179.817861.5000111.9F180 Y184 R193 A194 C195 K199 Q200 A201F180-L197 HydrophobicContact CB-CD2 3.82Å; F180-L197 HydrophobicContact CD1-CD2 3.85Å; F180-L197 HydrophobicContact CG-CD2 3.79Å; Y184-L197 HydrophobicContact CD2-CD2 4.03Å; Y184-L197 HydrophobicContact CE2-CD2 3.94Å; R193-L197 WeakPolarHBondContact O-CB 3.42Å; R193-L197 PolarHBondContact O-N 3.11Å; A194-L197 PolarHBondContact O-N 2.95Å; C195-L197 PolarHBondContact O-N 3.48Å; L197-K199 VanDerWaalsContact C-N 3.34Å; L197-K199 PolarHBondContact O-N 3.43Å; L197-Q200 PolarHBondContact O-N 2.99Å; L197-A201 PolarHBondContact O-N 3.23Å
198A98.3Very high97Very high0 Ų062.5 Ų62.50%033%0.326CS..Hα-helixtrans-63.2-42.4179.500000111.4A194 C195 A201 F202 L227 L231 W234A194-A198 WeakPolarHBondContact O-CB 3.41Å; A194-A198 PolarHBondContact O-N 3.34Å; C195-A198 PolarHBondContact O-N 3.01Å; A198-A201 PolarHBondContact O-N 3.5Å; A198-F202 WeakPolarHBondContact O-CB 3.32Å; A198-F202 PolarHBondContact O-N 3.44Å; A198-L227 HydrophobicContact CB-CD2 3.9Å; A198-L231 HydrophobicContact CB-CD1 4.26Å; A198-L231 HydrophobicContact CB-CD2 3.88Å; A198-L231 HydrophobicContact CB-CG 3.93Å; A198-W234 HydrophobicContact CB-CZ3 4.22Å
199K97.6Very high96.8Very high120 Ų12060.3 Ų60.352%0.52232%0.315SS..Hα-helixtrans-64.3-46.5177.1-175.7175.8-179.5-1780111.8C195 L197 A201 F202 D203 L231C195-K199 WeakPolarHBondContact O-CB 3.34Å; C195-K199 PolarHBondContact O-N 2.9Å; L197-K199 VanDerWaalsContact C-N 3.34Å; L197-K199 PolarHBondContact O-N 3.43Å; K199-A201 PolarHBondContact O-N 2.91Å; K199-F202 PolarHBondContact O-N 3.47Å; K199-D203 WeakPolarHBondContact CE-OD2 3.22Å; K199-D203 WeakPolarHBondContact CG-OD2 3.4Å; K199-D203 WeakPolarHBondContact O-CB 3.42Å; K199-D203 VanDerWaalsContact O-CG 3.3Å; K199-D203 PolarHBondContact O-N 3.05Å; K199-L231 HydrophobicContact CB-CD1 4.26Å; K199-L231 HydrophobicContact CB-CD2 4.3Å
200Q98Very high96.6Very high92 Ų9261.3 Ų61.343%0.4332%0.32SS..Hα-helixtrans-57-48.9176.7179.9-177.8-2.900111.4S196 L197 F202 D203 E204S196-Q200 WeakPolarHBondContact O-CB 3.19Å; S196-Q200 PolarHBondContact O-N 3.43Å; L197-Q200 PolarHBondContact O-N 2.99Å; Q200-F202 VanDerWaalsContact C-N 3.3Å; Q200-F202 PolarHBondContact O-N 3.02Å; Q200-D203 PolarHBondContact O-N 2.93Å; Q200-E204 HydrophobicContact CG-CG 4.35Å; Q200-E204 VanDerWaalsContact CG-OE1 3.25Å; Q200-E204 WeakPolarHBondContact CG-OE1 3.39Å; Q200-E204 PolarHBondContact NE2-OE1 2.86Å; Q200-E204 WeakPolarHBondContact O-CB 3.24Å; Q200-E204 VanDerWaalsContact O-CG 3.3Å; Q200-E204 WeakPolarHBondContact O-CG 3.46Å; Q200-E204 PolarHBondContact O-N 3.34Å
201A98.1Very high96.1Very high11 Ų1164.8 Ų64.89%0.09134%0.34CS..Hα-helixtrans-62.5-38.3179.700000112.4A177 L197 A198 K199 A205 L227A177-A201 HydrophobicContact CB-CB 3.49Å; A177-A201 VanDerWaalsContact CB-CB 3.49Å; L197-A201 PolarHBondContact O-N 3.23Å; A198-A201 PolarHBondContact O-N 3.5Å; K199-A201 PolarHBondContact O-N 2.91Å; A201-A205 VanDerWaalsContact O-CB 3.29Å; A201-A205 WeakPolarHBondContact O-CB 3.39Å; A201-A205 PolarHBondContact O-N 3.47Å; A201-A205 VanDerWaalsContact O-N 3.11Å; A201-L227 HydrophobicContact CB-CD1 4.23Å
202F97.6Very high95.8Very high47 Ų4765.1 Ų65.121%0.20634%0.34CS..Hα-helixtrans-66-47.7176.2-172.6-84.9000112A198 K199 Q200 A205 I206 M224 L227 R228A198-F202 WeakPolarHBondContact O-CB 3.32Å; A198-F202 PolarHBondContact O-N 3.44Å; K199-F202 PolarHBondContact O-N 3.47Å; Q200-F202 VanDerWaalsContact C-N 3.3Å; Q200-F202 PolarHBondContact O-N 3.02Å; F202-A205 PolarHBondContact O-N 3.16Å; F202-I206 WeakPolarHBondContact O-CG2 3.48Å; F202-I206 PolarHBondContact O-N 3.3Å; F202-M224 HydrophobicContact CD2-CB 4.11Å; F202-M224 HydrophobicContact CD2-CE 4.45Å; F202-M224 WeakPolarHBondContact CD2-O 3.16Å; F202-M224 HydrophobicContact CE2-CB 4Å; F202-M224 HydrophobicContact CE2-CE 4.26Å; F202-M224 WeakPolarHBondContact CE2-O 3.42Å; F202-M224 HydrophobicContact CZ-CE 4.46Å; F202-L227 HydrophobicContact CD2-CB 4.41Å; F202-R228 HydrophobicContact CD2-CB 4.42Å; F202-R228 HydrophobicContact CE2-CB 3.97Å
203D97.6Very high95.4Very high79 Ų7961.5 Ų61.542%0.42233%0.331SS..Hα-helixtrans-68-35.2-177.7-70.4-14.8000112.1K199 Q200 I206 S207K199-D203 WeakPolarHBondContact CE-OD2 3.22Å; K199-D203 WeakPolarHBondContact CG-OD2 3.4Å; K199-D203 WeakPolarHBondContact O-CB 3.42Å; K199-D203 VanDerWaalsContact O-CG 3.3Å; K199-D203 PolarHBondContact O-N 3.05Å; Q200-D203 PolarHBondContact O-N 2.93Å; D203-I206 WeakPolarHBondContact O-CG2 3.36Å; D203-S207 PolarHBondContact O-N 2.9Å
204E97.1Very high94.9Very high54 Ų5462.6 Ų62.625%0.25234%0.343SS..Hα-helixtrans-68-46.1172.4-70.4174.1-173.900111P168 R173 Q200 S207P168-E204 HydrophobicContact CB-CB 3.89Å; P168-E204 HydrophobicContact CG-CB 4.38Å; R173-E204 IonicContact CZ-OE2 2.84Å; R173-E204 IonicContact NH2-OE2 2.65Å; R173-E204 PolarHBondContact NH2-OE2 3.04Å; Q200-E204 HydrophobicContact CG-CG 4.35Å; Q200-E204 VanDerWaalsContact CG-OE1 3.25Å; Q200-E204 WeakPolarHBondContact CG-OE1 3.39Å; Q200-E204 PolarHBondContact NE2-OE1 2.86Å; Q200-E204 WeakPolarHBondContact O-CB 3.24Å; Q200-E204 VanDerWaalsContact O-CG 3.3Å; Q200-E204 WeakPolarHBondContact O-CG 3.46Å; Q200-E204 PolarHBondContact O-N 3.34Å; E204-S207 PolarHBondContact O-N 3.39Å; E204-S207 PolarHBondContact O-OG 3.5Å
205A96.7Very high94.1Very high0 Ų070.4 Ų70.40%038%0.38CS..Hα-helixtrans-67.9-37.9-178.200000113.4T169 L174 A201 F202 S207 E208 L209 M224T169-A205 HydrophobicContact CG2-CB 4.39Å; T169-A205 WeakPolarHBondContact CG2-O 3.21Å; L174-A205 HydrophobicContact CD2-CB 3.76Å; A201-A205 VanDerWaalsContact O-CB 3.29Å; A201-A205 WeakPolarHBondContact O-CB 3.39Å; A201-A205 PolarHBondContact O-N 3.47Å; A201-A205 VanDerWaalsContact O-N 3.11Å; F202-A205 PolarHBondContact O-N 3.16Å; A205-S207 PolarHBondContact O-N 3.38Å; A205-E208 PolarHBondContact O-N 3.49Å; A205-L209 PolarHBondContact O-N 3Å; A205-L209 VanDerWaalsContact O-N 3.09Å; A205-M224 HydrophobicContact CB-CE 4.02Å; A205-M224 HydrophobicContact CB-CG 4.23Å; A205-M224 HydrophobicContact CB-SD 3.87Å
206I95.9Very high93.6Very high84 Ų8472.4 Ų72.443%0.43139%0.394SS..Hα-helixtrans-63.2-32.6176.5-166.166.2000111.6F202 D203 E208 L209 M224F202-I206 WeakPolarHBondContact O-CG2 3.48Å; F202-I206 PolarHBondContact O-N 3.3Å; D203-I206 WeakPolarHBondContact O-CG2 3.36Å; I206-E208 VanDerWaalsContact C-N 3.26Å; I206-E208 PolarHBondContact O-N 3.35Å; I206-L209 HydrophobicContact CD1-CD2 4.04Å; I206-L209 PolarHBondContact O-N 3.31Å; I206-M224 HydrophobicContact CB-CE 4Å; I206-M224 HydrophobicContact CD1-CE 4.04Å
207S95.4Very high93.3Very high89 Ų8973.8 Ų73.862%0.62239%0.388SS*.Hα-helixtrans-69.7-22.1-17977.40000113.8D203 E204 A205D203-S207 PolarHBondContact O-N 2.9Å; E204-S207 PolarHBondContact O-N 3.39Å; E204-S207 PolarHBondContact O-OG 3.5Å; A205-S207 PolarHBondContact O-N 3.38Å
208E94.3Very high93Very high75 Ų7580.3 Ų80.335%0.3542%0.415SS..Hα-helixtrans-114.73.7-179.2-66-173.2-156.100113P168 T169 A205 I206 D210 T211P168-E208 WeakPolarHBondContact CD-OE2 3.48Å; T169-E208 HydrophobicContact CG2-CB 4.02Å; A205-E208 PolarHBondContact O-N 3.49Å; I206-E208 VanDerWaalsContact C-N 3.26Å; I206-E208 PolarHBondContact O-N 3.35Å; E208-D210 VanDerWaalsContact C-N 3.28Å; E208-D210 PolarHBondContact O-N 2.99Å; E208-T211 WeakPolarHBondContact O-CB 3.36Å; E208-T211 PolarHBondContact O-N 2.61Å; E208-T211 VanDerWaalsContact O-N 3.09Å; E208-T211 PolarHBondContact O-OG1 2.89Å
209L92.2Very high92.7Very high13 Ų1384 Ų847%0.06844%0.435CS..G310 helixtrans-62-35-171.4-165.169.4000113.2T169 A205 I206 T211 L212 Y217 T221 M224T169-L209 HydrophobicContact CG2-CD1 4.47Å; A205-L209 PolarHBondContact O-N 3Å; A205-L209 VanDerWaalsContact O-N 3.09Å; I206-L209 HydrophobicContact CD1-CD2 4.04Å; I206-L209 PolarHBondContact O-N 3.31Å; L209-T211 PolarHBondContact O-N 3.48Å; L209-T211 VanDerWaalsContact O-N 3.1Å; L209-L212 HydrophobicContact CD1-CD1 3.81Å; L209-L212 PolarHBondContact O-N 3.35Å; L209-Y217 HydrophobicContact CD1-CD2 4.27Å; L209-Y217 HydrophobicContact CD1-CE2 4.26Å; L209-Y217 HydrophobicContact CD2-CE2 3.79Å; L209-Y217 HydrophobicContact CG-CD2 4.05Å; L209-Y217 HydrophobicContact CG-CE2 3.67Å; L209-T221 HydrophobicContact CD1-CG2 4.05Å; L209-T221 HydrophobicContact CD2-CG2 4.03Å; L209-M224 HydrophobicContact CD1-CE 4.46Å; L209-M224 HydrophobicContact CD1-SD 3.75Å; L209-M224 HydrophobicContact CD2-CE 4.45Å
210D91.2Very high92.6Very high161 Ų16178.3 Ų78.386%0.86141%0.41SS*.G310 helixtrans-66.8-9.1-180-67.6-21.6000113.5E208E208-D210 VanDerWaalsContact C-N 3.28Å; E208-D210 PolarHBondContact O-N 2.99Å
211T88.4Confident92.5Very high107 Ų10776 Ų7666%0.65640%0.402SS*.G310 helixtrans-89.7-8.9180710000113.8E208 L209E208-T211 WeakPolarHBondContact O-CB 3.36Å; E208-T211 PolarHBondContact O-N 2.61Å; E208-T211 VanDerWaalsContact O-N 3.09Å; E208-T211 PolarHBondContact O-OG1 2.89Å; L209-T211 PolarHBondContact O-N 3.48Å; L209-T211 VanDerWaalsContact O-N 3.1Å
212L89.4Confident92.4Very high42 Ų4280.8 Ų80.822%0.2243%0.426CS..  trans-81.8146.5-172.7-66.7179.4000113.5T169 L209 Y217T169-L212 HydrophobicContact CG2-CD1 4Å; T169-L212 HydrophobicContact CG2-CD2 4.43Å; T169-L212 HydrophobicContact CG2-CG 4.23Å; T169-L212 WeakPolarHBondContact OG1-CD2 3.39Å; L209-L212 HydrophobicContact CD1-CD1 3.81Å; L209-L212 PolarHBondContact O-N 3.35Å; L212-Y217 HydrophobicContact CB-CD2 4.47Å
213G87.3Confident92.4Very high46 Ų4679.9 Ų79.947%0.47442%0.423SS..  trans-72.4163.3161.900000112.1E215 S216 Y217G213-E215 PolarHBondContact O-N 2.97Å; G213-S216 PolarHBondContact O-N 2.72Å; G213-Y217 VanDerWaalsContact O-CB 3.28Å; G213-Y217 WeakPolarHBondContact O-CB 3.18Å; G213-Y217 PolarHBondContact O-N 3.23Å
214E85.4Confident92.4Very high183 Ų18376.5 Ų76.586%0.85541%0.405SS*.Hα-helixtrans-56.4-43.5-170.9-170.4177-176.300114.1Y217 K218E214-Y217 PolarHBondContact O-N 3.13Å; E214-K218 PolarHBondContact O-N 2.65Å
215E82.2Confident92.4Very high163 Ų16377 Ų7776%0.76241%0.407SS*.Hα-helixtrans-66-52.1180-172.4175.6-168.900111.6G213 Y217 K218 D219G213-E215 PolarHBondContact O-N 2.97Å; E215-Y217 VanDerWaalsContact C-N 3.25Å; E215-Y217 PolarHBondContact O-N 3.11Å; E215-K218 PolarHBondContact O-N 3.13Å; E215-D219 PolarHBondContact O-N 3Å
216S87.3Confident92.5Very high57 Ų5780.8 Ų80.840%0.39943%0.427SS..Hα-helixtrans-63.1-32.9177.3-52.40000112.3G213 S220G213-S216 PolarHBondContact O-N 2.72Å; S216-S220 VanDerWaalsContact O-CB 3.27Å; S216-S220 WeakPolarHBondContact O-CB 3.47Å; S216-S220 PolarHBondContact O-N 3.03Å; S216-S220 PolarHBondContact O-OG 3.4Å
217Y90.7Very high92.6Very high108 Ų10876.8 Ų76.842%0.42441%0.407SS..Hα-helixtrans-61.1-46.2176.9-177.5-87.9000111.4L209 L212 G213 E214 E215 S220 T221L209-Y217 HydrophobicContact CD1-CD2 4.27Å; L209-Y217 HydrophobicContact CD1-CE2 4.26Å; L209-Y217 HydrophobicContact CD2-CE2 3.79Å; L209-Y217 HydrophobicContact CG-CD2 4.05Å; L209-Y217 HydrophobicContact CG-CE2 3.67Å; L212-Y217 HydrophobicContact CB-CD2 4.47Å; G213-Y217 VanDerWaalsContact O-CB 3.28Å; G213-Y217 WeakPolarHBondContact O-CB 3.18Å; G213-Y217 PolarHBondContact O-N 3.23Å; E214-Y217 PolarHBondContact O-N 3.13Å; E215-Y217 VanDerWaalsContact C-N 3.25Å; E215-Y217 PolarHBondContact O-N 3.11Å; Y217-S220 PolarHBondContact O-N 3.47Å; Y217-T221 HydrophobicContact CD1-CG2 4.05Å; Y217-T221 HydrophobicContact CD2-CG2 4.45Å; Y217-T221 HydrophobicContact CE1-CG2 3.71Å; Y217-T221 HydrophobicContact CE2-CG2 4.16Å; Y217-T221 HydrophobicContact CG-CG2 4.4Å; Y217-T221 WeakPolarHBondContact O-CB 2.92Å; Y217-T221 VanDerWaalsContact O-CG2 3.27Å; Y217-T221 WeakPolarHBondContact O-CG2 3.45Å; Y217-T221 PolarHBondContact O-N 3.49Å; Y217-T221 PolarHBondContact O-OG1 3.05Å
218K92.3Very high92.7Very high155 Ų15578.4 Ų78.467%0.67440%0.399SS*.Hα-helixtrans-62.7-46-179.7-172.6-177.7175.7-172.90112.2E214 E215 T221 L222E214-K218 PolarHBondContact O-N 2.65Å; E215-K218 PolarHBondContact O-N 3.13Å; K218-T221 PolarHBondContact O-OG1 3.37Å; K218-T221 VanDerWaalsContact O-OG1 3.08Å; K218-L222 WeakPolarHBondContact O-CB 3.45Å; K218-L222 PolarHBondContact O-N 2.92Å; K218-L222 VanDerWaalsContact O-N 3.13Å
219D92.4Very high92.8Very high79 Ų7978.3 Ų78.342%0.42240%0.401SS..Hα-helixtrans-67.9-41.7-178.9-72.6-11.1000111.8P171 E215 L222 I223P171-D219 HydrophobicContact CB-CB 4.41Å; P171-D219 HydrophobicContact CG-CB 3.91Å; E215-D219 PolarHBondContact O-N 3Å; D219-L222 PolarHBondContact O-N 3.23Å; D219-I223 WeakPolarHBondContact O-CG1 3.37Å; D219-I223 PolarHBondContact O-N 3.18Å
220S94.8Very high93Very high0 Ų079.4 Ų79.40%041%0.407CS..Hα-helixtrans-65.7-46.3179.6-51.30000111.4T169 S216 Y217 L222 I223 M224T169-S220 WeakPolarHBondContact O-CB 3.45Å; T169-S220 PolarHBondContact O-OG 3.45Å; S216-S220 VanDerWaalsContact O-CB 3.27Å; S216-S220 WeakPolarHBondContact O-CB 3.47Å; S216-S220 PolarHBondContact O-N 3.03Å; S216-S220 PolarHBondContact O-OG 3.4Å; Y217-S220 PolarHBondContact O-N 3.47Å; S220-L222 VanDerWaalsContact C-N 3.33Å; S220-L222 PolarHBondContact O-N 3.21Å; S220-I223 PolarHBondContact O-N 2.88Å; S220-M224 VanDerWaalsContact O-CG 3.27Å; S220-M224 WeakPolarHBondContact O-CG 3.4Å; S220-M224 PolarHBondContact O-N 3.27Å
221T95.9Very high93.3Very high42 Ų4272.9 Ų72.926%0.25837%0.372SS..Hα-helixtrans-65.1-34.9179.8510000112.7L209 Y217 K218 I223 M224 Q225L209-T221 HydrophobicContact CD1-CG2 4.05Å; L209-T221 HydrophobicContact CD2-CG2 4.03Å; Y217-T221 HydrophobicContact CD1-CG2 4.05Å; Y217-T221 HydrophobicContact CD2-CG2 4.45Å; Y217-T221 HydrophobicContact CE1-CG2 3.71Å; Y217-T221 HydrophobicContact CE2-CG2 4.16Å; Y217-T221 HydrophobicContact CG-CG2 4.4Å; Y217-T221 WeakPolarHBondContact O-CB 2.92Å; Y217-T221 VanDerWaalsContact O-CG2 3.27Å; Y217-T221 WeakPolarHBondContact O-CG2 3.45Å; Y217-T221 PolarHBondContact O-N 3.49Å; Y217-T221 PolarHBondContact O-OG1 3.05Å; K218-T221 PolarHBondContact O-OG1 3.37Å; K218-T221 VanDerWaalsContact O-OG1 3.08Å; T221-I223 VanDerWaalsContact C-N 3.34Å; T221-I223 PolarHBondContact O-N 3.47Å; T221-M224 PolarHBondContact O-N 3.14Å; T221-Q225 WeakPolarHBondContact O-CB 3.49Å; T221-Q225 PolarHBondContact O-N 3Å
222L96.2Very high93.7Very high112 Ų11272.2 Ų72.259%0.58637%0.368SS*.Hα-helixtrans-61.4-42.3173.6-178.163.1000111.7K218 D219 S220 Q225 L226K218-L222 WeakPolarHBondContact O-CB 3.45Å; K218-L222 PolarHBondContact O-N 2.92Å; K218-L222 VanDerWaalsContact O-N 3.13Å; D219-L222 PolarHBondContact O-N 3.23Å; S220-L222 VanDerWaalsContact C-N 3.33Å; S220-L222 PolarHBondContact O-N 3.21Å; L222-Q225 WeakPolarHBondContact O-CB 3.49Å; L222-Q225 PolarHBondContact O-N 2.9Å; L222-L226 PolarHBondContact O-N 3.32Å
223I97.4Very high93.9Very high29 Ų2974.8 Ų74.815%0.14938%0.381CS..Hα-helixtrans-74.3-38.9179.4-57.3168000111.2P171 L174 L178 D219 S220 T221 Q225 L226 L227P171-I223 HydrophobicContact CB-CD1 3.86Å; P171-I223 VanDerWaalsContact O-CD1 3.32Å; P171-I223 WeakPolarHBondContact O-CD1 3.39Å; L174-I223 HydrophobicContact CB-CB 4.15Å; L174-I223 HydrophobicContact CB-CD1 4.37Å; L174-I223 HydrophobicContact CB-CG2 3.67Å; L178-I223 HydrophobicContact CB-CG2 4.45Å; L178-I223 HydrophobicContact CD2-CG2 4.21Å; D219-I223 WeakPolarHBondContact O-CG1 3.37Å; D219-I223 PolarHBondContact O-N 3.18Å; S220-I223 PolarHBondContact O-N 2.88Å; T221-I223 VanDerWaalsContact C-N 3.34Å; T221-I223 PolarHBondContact O-N 3.47Å; I223-Q225 PolarHBondContact O-N 2.87Å; I223-L226 WeakPolarHBondContact O-CB 3.36Å; I223-L226 PolarHBondContact O-N 2.76Å; I223-L226 VanDerWaalsContact O-N 3.13Å; I223-L227 PolarHBondContact O-N 3.16Å
224M97.7Very high94.3Very high7 Ų772.9 Ų72.93%0.03436%0.36CS..Hα-helixtrans-60-37173.4-70.6170.770.900111.8L174 F202 A205 I206 L209 S220 T221 L226 L227 R228L174-M224 HydrophobicContact CD1-CG 4.05Å; L174-M224 HydrophobicContact CD2-CG 4.21Å; F202-M224 HydrophobicContact CD2-CB 4.11Å; F202-M224 HydrophobicContact CD2-CE 4.45Å; F202-M224 WeakPolarHBondContact CD2-O 3.16Å; F202-M224 HydrophobicContact CE2-CB 4Å; F202-M224 HydrophobicContact CE2-CE 4.26Å; F202-M224 WeakPolarHBondContact CE2-O 3.42Å; F202-M224 HydrophobicContact CZ-CE 4.46Å; A205-M224 HydrophobicContact CB-CE 4.02Å; A205-M224 HydrophobicContact CB-CG 4.23Å; A205-M224 HydrophobicContact CB-SD 3.87Å; I206-M224 HydrophobicContact CB-CE 4Å; I206-M224 HydrophobicContact CD1-CE 4.04Å; L209-M224 HydrophobicContact CD1-CE 4.46Å; L209-M224 HydrophobicContact CD1-SD 3.75Å; L209-M224 HydrophobicContact CD2-CE 4.45Å; S220-M224 VanDerWaalsContact O-CG 3.27Å; S220-M224 WeakPolarHBondContact O-CG 3.4Å; S220-M224 PolarHBondContact O-N 3.27Å; T221-M224 PolarHBondContact O-N 3.14Å; M224-L226 VanDerWaalsContact C-N 3.35Å; M224-L226 PolarHBondContact O-N 3.07Å; M224-L227 WeakPolarHBondContact O-CB 3.47Å; M224-L227 PolarHBondContact O-N 3.26Å; M224-R228 PolarHBondContact O-N 3.15Å
225Q97.7Very high94.5Very high64 Ų6467.8 Ų67.830%0.29934%0.338SS..Hα-helixtrans-60.3-44.8174.1-178.955.44100111.4T221 L222 I223 L227 R228 D229T221-Q225 WeakPolarHBondContact O-CB 3.49Å; T221-Q225 PolarHBondContact O-N 3Å; L222-Q225 WeakPolarHBondContact O-CB 3.49Å; L222-Q225 PolarHBondContact O-N 2.9Å; I223-Q225 PolarHBondContact O-N 2.87Å; Q225-L227 PolarHBondContact O-N 3.14Å; Q225-R228 WeakPolarHBondContact O-CB 3.41Å; Q225-R228 PolarHBondContact O-N 3.49Å; Q225-D229 PolarHBondContact NE2-OD1 3.2Å; Q225-D229 PolarHBondContact NE2-OD2 3.01Å; Q225-D229 VanDerWaalsContact NE2-OD2 3.13Å; Q225-D229 PolarHBondContact O-N 2.95Å
226L98Very high94.8Very high81 Ų8162.4 Ų62.442%0.42432%0.319SS..Hα-helixtrans-64.2-39.3176.4-63.7173.6000112.5L178 L222 I223 M224 R228 D229 N230L178-L226 HydrophobicContact CD1-CB 4.14Å; L178-L226 HydrophobicContact CD2-CB 3.86Å; L178-L226 HydrophobicContact CD2-CD1 3.91Å; L222-L226 PolarHBondContact O-N 3.32Å; I223-L226 WeakPolarHBondContact O-CB 3.36Å; I223-L226 PolarHBondContact O-N 2.76Å; I223-L226 VanDerWaalsContact O-N 3.13Å; M224-L226 VanDerWaalsContact C-N 3.35Å; M224-L226 PolarHBondContact O-N 3.07Å; L226-R228 VanDerWaalsContact C-N 3.33Å; L226-D229 PolarHBondContact O-N 3.48Å; L226-N230 PolarHBondContact O-N 3.05Å
227L98Very high94.6Very high0 Ų062.2 Ų62.20%031%0.313CS..Hα-helixtrans-59.5-45173.1-77.6168.4000111.3L174 L178 A198 A201 F202 I223 M224 Q225 N230 L231L174-L227 HydrophobicContact CD2-CD1 4.01Å; L178-L227 HydrophobicContact CB-CD2 3.93Å; L178-L227 HydrophobicContact CB-CG 4.27Å; L178-L227 HydrophobicContact CD1-CD2 3.88Å; L178-L227 HydrophobicContact CD1-CG 4.13Å; A198-L227 HydrophobicContact CB-CD2 3.9Å; A201-L227 HydrophobicContact CB-CD1 4.23Å; F202-L227 HydrophobicContact CD2-CB 4.41Å; I223-L227 PolarHBondContact O-N 3.16Å; M224-L227 WeakPolarHBondContact O-CB 3.47Å; M224-L227 PolarHBondContact O-N 3.26Å; Q225-L227 PolarHBondContact O-N 3.14Å; L227-N230 PolarHBondContact O-N 3.32Å; L227-L231 WeakPolarHBondContact O-CG 3.48Å; L227-L231 PolarHBondContact O-N 2.7Å
228R97.4Very high94.2Very high123 Ų12359.3 Ų59.346%0.46430%0.304SS..Hα-helixtrans-62.6-44.5177.3-172.4-177.274.7-175.75.6111.7F202 M224 Q225 L226 N230 L231 T232F202-R228 HydrophobicContact CD2-CB 4.42Å; F202-R228 HydrophobicContact CE2-CB 3.97Å; M224-R228 PolarHBondContact O-N 3.15Å; Q225-R228 WeakPolarHBondContact O-CB 3.41Å; Q225-R228 PolarHBondContact O-N 3.49Å; L226-R228 VanDerWaalsContact C-N 3.33Å; R228-N230 VanDerWaalsContact C-N 3.34Å; R228-N230 PolarHBondContact O-N 3.01Å; R228-L231 WeakPolarHBondContact O-CB 3.48Å; R228-L231 PolarHBondContact O-N 3.25Å; R228-T232 PolarHBondContact O-N 2.84Å; R228-T232 PolarHBondContact O-OG1 3.14Å
229D97.9Very high93.4Very high72 Ų7257.1 Ų57.139%0.38530%0.3SS..Hα-helixtrans-63.4-42.2-178.3-65.2-14.6000111Q225 L226 T232 L233Q225-D229 PolarHBondContact NE2-OD1 3.2Å; Q225-D229 PolarHBondContact NE2-OD2 3.01Å; Q225-D229 VanDerWaalsContact NE2-OD2 3.13Å; Q225-D229 PolarHBondContact O-N 2.95Å; L226-D229 PolarHBondContact O-N 3.48Å; D229-T232 PolarHBondContact O-N 3.26Å; D229-L233 PolarHBondContact O-N 3.19Å
230N96.6Very high92.6Very high37 Ų3759.3 Ų59.320%0.19831%0.312CS..Hα-helixtrans-60.9-45.7172-78.10000112.2L178 V182 L226 L227 R228 T232 L233 W234L178-N230 WeakPolarHBondContact CD1-ND2 3.43Å; V182-N230 WeakPolarHBondContact CG2-ND2 3.45Å; L226-N230 PolarHBondContact O-N 3.05Å; L227-N230 PolarHBondContact O-N 3.32Å; R228-N230 VanDerWaalsContact C-N 3.34Å; R228-N230 PolarHBondContact O-N 3.01Å; N230-T232 VanDerWaalsContact C-N 3.3Å; N230-T232 PolarHBondContact O-N 3.38Å; N230-L233 PolarHBondContact O-N 3.06Å; N230-W234 HydrophobicContact CB-CD2 4.23Å; N230-W234 HydrophobicContact CB-CE3 4.18Å; N230-W234 HydrophobicContact CB-CH2 3.76Å; N230-W234 HydrophobicContact CB-CZ2 3.8Å; N230-W234 HydrophobicContact CB-CZ3 3.95Å; N230-W234 WeakPolarHBondContact O-CB 3.22Å; N230-W234 VanDerWaalsContact O-CD2 3.29Å; N230-W234 PolarHBondContact O-N 3.15Å
231L96.5Very high91.3Very high23 Ų2366.8 Ų66.812%0.1235%0.347CS..Hα-helixtrans-60.7-39.5177.1-76.3168.2000112.2C195 A198 K199 L227 R228 N235C195-L231 HydrophobicContact CB-CD2 4.14Å; C195-L231 WeakPolarHBondContact O-CD2 3.38Å; A198-L231 HydrophobicContact CB-CD1 4.26Å; A198-L231 HydrophobicContact CB-CD2 3.88Å; A198-L231 HydrophobicContact CB-CG 3.93Å; K199-L231 HydrophobicContact CB-CD1 4.26Å; K199-L231 HydrophobicContact CB-CD2 4.3Å; L227-L231 WeakPolarHBondContact O-CG 3.48Å; L227-L231 PolarHBondContact O-N 2.7Å; R228-L231 WeakPolarHBondContact O-CB 3.48Å; R228-L231 PolarHBondContact O-N 3.25Å; L231-N235 WeakPolarHBondContact O-CB 3.34Å; L231-N235 VanDerWaalsContact O-CG 3.29Å; L231-N235 PolarHBondContact O-N 2.68Å; L231-N235 VanDerWaalsContact O-N 3.08Å; L231-N235 PolarHBondContact O-ND2 3.44Å
232T96Very high89.7Confident94 Ų9468.2 Ų68.258%0.57736%0.363SS*.Hα-helixtrans-62.9-47.3176.2-62.80000111R228 D229 N230 S236R228-T232 PolarHBondContact O-N 2.84Å; R228-T232 PolarHBondContact O-OG1 3.14Å; D229-T232 PolarHBondContact O-N 3.26Å; N230-T232 VanDerWaalsContact C-N 3.3Å; N230-T232 PolarHBondContact O-N 3.38Å; T232-S236 PolarHBondContact O-N 3.08Å; T232-S236 PolarHBondContact O-OG 3.4Å
233L94.8Very high87.6Confident96 Ų9665 Ų6550%0.50336%0.357SS..Hα-helixtrans-62.5-48.3178.9-176.368.1000112D229 N230 N235 S236 D237D229-L233 PolarHBondContact O-N 3.19Å; N230-L233 PolarHBondContact O-N 3.06Å; L233-N235 PolarHBondContact O-N 3.24Å; L233-S236 PolarHBondContact O-N 2.77Å; L233-S236 PolarHBondContact O-OG 2.77Å; L233-D237 VanDerWaalsContact O-CG 3.32Å; L233-D237 PolarHBondContact O-N 3.03Å; L233-D237 VanDerWaalsContact O-N 3.15Å
234W95.3Very high85.1Confident6 Ų666.4 Ų66.42%0.02338%0.378CS..Hα-helixtrans-70.7-33.2-175.5-60.1-24.5000113V182 Y185 A194 A198 N230 S236 D237 I238V182-W234 HydrophobicContact CG2-CH2 4.13Å; V182-W234 HydrophobicContact CG2-CZ2 4.05Å; Y185-W234 AromaticContact CD1-CD1 3.97Å; Y185-W234 AromaticContact CD1-NE1 3.56Å; Y185-W234 HydrophobicContact CD2-CB 4.11Å; Y185-W234 AromaticContact CD2-CD1 3.57Å; Y185-W234 AromaticContact CD2-CD2 3.59Å; Y185-W234 HydrophobicContact CD2-CD2 3.59Å; Y185-W234 AromaticContact CD2-CE2 3.71Å; Y185-W234 HydrophobicContact CD2-CE3 4.26Å; Y185-W234 AromaticContact CD2-CG 3.5Å; Y185-W234 HydrophobicContact CD2-CG 3.5Å; Y185-W234 VanDerWaalsContact CD2-CG 3.5Å; Y185-W234 HydrophobicContact CD2-CZ2 4.45Å; Y185-W234 AromaticContact CD2-NE1 3.68Å; Y185-W234 AromaticContact CE1-CD1 3.68Å; Y185-W234 AromaticContact CE1-NE1 3.67Å; Y185-W234 HydrophobicContact CE2-CB 3.63Å; Y185-W234 AromaticContact CE2-CD1 3.24Å; Y185-W234 AromaticContact CE2-CD2 3.96Å; Y185-W234 HydrophobicContact CE2-CD2 3.96Å; Y185-W234 AromaticContact CE2-CG 3.32Å; Y185-W234 HydrophobicContact CE2-CG 3.32Å; Y185-W234 AromaticContact CE2-NE1 3.8Å; Y185-W234 AromaticContact CG-CD1 3.93Å; Y185-W234 HydrophobicContact CG-CD2 4.03Å; Y185-W234 AromaticContact CG-CE2 3.64Å; Y185-W234 HydrophobicContact CG-CG 4.2Å; Y185-W234 HydrophobicContact CG-CZ2 4.07Å; Y185-W234 AromaticContact CG-NE1 3.57Å; Y185-W234 AromaticContact CZ-CD1 3.3Å; Y185-W234 AromaticContact CZ-CG 3.89Å; Y185-W234 AromaticContact CZ-NE1 3.79Å; A194-W234 HydrophobicContact CB-CE3 4.18Å; A194-W234 HydrophobicContact CB-CH2 4.37Å; A194-W234 HydrophobicContact CB-CZ3 3.91Å; A198-W234 HydrophobicContact CB-CZ3 4.22Å; N230-W234 HydrophobicContact CB-CD2 4.23Å; N230-W234 HydrophobicContact CB-CE3 4.18Å; N230-W234 HydrophobicContact CB-CH2 3.76Å; N230-W234 HydrophobicContact CB-CZ2 3.8Å; N230-W234 HydrophobicContact CB-CZ3 3.95Å; N230-W234 WeakPolarHBondContact O-CB 3.22Å; N230-W234 VanDerWaalsContact O-CD2 3.29Å; N230-W234 PolarHBondContact O-N 3.15Å; W234-S236 VanDerWaalsContact C-N 3.34Å; W234-D237 PolarHBondContact O-N 3.34Å; W234-I238 WeakPolarHBondContact O-CD1 3.4Å; W234-I238 WeakPolarHBondContact O-CG1 3.32Å; W234-I238 PolarHBondContact O-N 3.13Å
235N89.6Confident82.6Confident75 Ų7573.3 Ų73.340%0.40142%0.415SS..Hα-helixtrans-70.7-29.4175-74.1-51.3000112.4L231 L233 N239L231-N235 WeakPolarHBondContact O-CB 3.34Å; L231-N235 VanDerWaalsContact O-CG 3.29Å; L231-N235 PolarHBondContact O-N 2.68Å; L231-N235 VanDerWaalsContact O-N 3.08Å; L231-N235 PolarHBondContact O-ND2 3.44Å; L233-N235 PolarHBondContact O-N 3.24Å; N235-N239 WeakPolarHBondContact O-CB 3.45Å; N235-N239 PolarHBondContact O-N 3.45Å; N235-N239 PolarHBondContact O-ND2 2.98Å
236S88.5Confident80Confident50 Ų5078.8 Ų78.835%0.3544%0.441SS..Hα-helixtrans-66.8-44.7170.549.10000111.1T232 L233 W234 I238 N239 D240T232-S236 PolarHBondContact O-N 3.08Å; T232-S236 PolarHBondContact O-OG 3.4Å; L233-S236 PolarHBondContact O-N 2.77Å; L233-S236 PolarHBondContact O-OG 2.77Å; W234-S236 VanDerWaalsContact C-N 3.34Å; S236-I238 PolarHBondContact O-N 3.38Å; S236-N239 PolarHBondContact O-N 2.94Å; S236-D240 PolarHBondContact O-N 3.19Å
237D83.4Confident77.5Confident54 Ų5482.2 Ų82.229%0.28946%0.458SS..Hα-helixtrans-62.8-42.8-178-62-16.9000111.7Y185 L233 W234 N239 D240 E241Y185-D237 PolarHBondContact OH-OD2 3.41Å; L233-D237 VanDerWaalsContact O-CG 3.32Å; L233-D237 PolarHBondContact O-N 3.03Å; L233-D237 VanDerWaalsContact O-N 3.15Å; W234-D237 PolarHBondContact O-N 3.34Å; D237-N239 VanDerWaalsContact C-N 3.34Å; D237-N239 PolarHBondContact O-N 3.03Å; D237-D240 PolarHBondContact O-N 3.34Å; D237-E241 WeakPolarHBondContact O-CG 3.39Å; D237-E241 PolarHBondContact O-N 3.45Å
238I81.9Confident74.8Confident46 Ų4691.5 Ų91.524%0.23650%0.499CS..Hα-helixtrans-63.6-39.6177.2-65.1162000111.5P191 W234 S236 A242P191-I238 HydrophobicContact CB-CD1 4.11Å; P191-I238 HydrophobicContact CB-CG1 4.28Å; W234-I238 WeakPolarHBondContact O-CD1 3.4Å; W234-I238 WeakPolarHBondContact O-CG1 3.32Å; W234-I238 PolarHBondContact O-N 3.13Å; S236-I238 PolarHBondContact O-N 3.38Å; I238-A242 WeakPolarHBondContact O-CB 3.46Å; I238-A242 PolarHBondContact O-N 3.27Å
239N75.8Confident71.9Confident110 Ų11095.1 Ų95.159%0.58852%0.52SS*.Hα-helixtrans-70.7-36.4179.1-72.7-27.2000111.9N235 S236 D237 A242 G243N235-N239 WeakPolarHBondContact O-CB 3.45Å; N235-N239 PolarHBondContact O-N 3.45Å; N235-N239 PolarHBondContact O-ND2 2.98Å; S236-N239 PolarHBondContact O-N 2.94Å; D237-N239 VanDerWaalsContact C-N 3.34Å; D237-N239 PolarHBondContact O-N 3.03Å; N239-A242 PolarHBondContact O-N 3Å; N239-G243 PolarHBondContact O-N 3.48Å
240D76.3Confident69.1Low124 Ų12496.5 Ų96.566%0.66354%0.542SS*.Hα-helixtrans-68.2-38.8176.2-74.1-12.3000111.4S236 D237S236-D240 PolarHBondContact O-N 3.19Å; D237-D240 PolarHBondContact O-N 3.34Å
241E66.8Low66.4Low158 Ų158100 Ų10074%0.73857%0.569SS**Hα-helixtrans-66.4-39.8173.5-73.9-172.6171.900112.3D237D237-E241 WeakPolarHBondContact O-CG 3.39Å; D237-E241 PolarHBondContact O-N 3.45Å
242A62.2Low63.6Low72 Ų72109 Ų10960%0.59561%0.608SS**Hα-helixtrans-72.5-29.8178.300000113.4I238 N239 G244I238-A242 WeakPolarHBondContact O-CB 3.46Å; I238-A242 PolarHBondContact O-N 3.27Å; N239-A242 PolarHBondContact O-N 3Å; A242-G244 VanDerWaalsContact C-N 3.31Å; A242-G244 PolarHBondContact O-N 2.97Å
243G51.7Low61Low45 Ų45112.4 Ų112.446%0.46462%0.616SS.*Hα-helixtrans-77.9-10178.500000115N239 D245N239-G243 PolarHBondContact O-N 3.48Å; G243-D245 PolarHBondContact O-N 3.47Å
244G45.4Very low58.5Low57 Ų57115.1 Ų115.159%0.58863%0.627SS**THydrogen-bonded Turntrans-74.4-16.8-177.800000115.6A242A242-G244 VanDerWaalsContact C-N 3.31Å; A242-G244 PolarHBondContact O-N 2.97Å
245D45.3Very low55.8Low153 Ų153120.5 Ų120.582%0.81866%0.662SS**THydrogen-bonded Turntrans-96.1-7.7-175.1-95.4-17.6000114.7G243G243-D245 PolarHBondContact O-N 3.47Å
246E43.3Very low53.4Low178 Ų178126.5 Ų126.583%0.83269%0.688SS**THydrogen-bonded Turntrans-91.43.3-176.5-71.3-163.3158.900115.8
247I44.7Very low51.3Low154 Ų154132.9 Ų132.979%0.7971%0.712SS**THydrogen-bonded Turntrans-101.93.6-177.1-61.1178.2000114.3
248K41.2Very low49.2Very low195 Ų195133.7 Ų133.785%0.84873%0.733SS**SBendtrans-105.33.7-176.3-82.6-174.3-180172.40118.6
249E36.7Very low47.4Very low198 Ų198141.3 Ų141.393%0.92576%0.764SS**SBendtrans-1144.3179.2-78.4-16214500117
250A38.7Very low46.1Very low102 Ų102142 Ų14284%0.84378%0.775SS**SBendtrans-109.450.4178.300000113.8
251S39.8Very low44.5Very low109 Ų109140.6 Ų140.676%0.76278%0.78SS**  trans-152.759.5163.557.50000111.8
252K38.2Very low43.3Very low214 Ų214142 Ų14293%0.9379%0.787SS**  trans-105.683.7152.7-83.8-179.1178.1171.10107.7
253H42.4Very low42.3Very low164 Ų164145.6 Ų145.676%0.75980%0.802SS**  trans-120.1105.1159.8-136.4-30.8000108
254E40.9Very low42.1Very low154 Ų154147 Ų14772%0.7282%0.817SS**  trans30.7130.8151.4-65.2174151.200121E256E254-E256 PolarHBondContact O-N 3.45Å
255P40.1Very low41.9Very low119 Ų119157.5 Ų157.577%0.77385%0.85SS**  trans-83107161.632.5-24.9000109.9E257P255-E257 PolarHBondContact O-N 3.3Å
256E38.4Very low41.7Very low201 Ų201157.8 Ų157.894%0.93985%0.852SS**  trans-79.591.7154.1-91.1-164.4150.500108.5E254E254-E256 PolarHBondContact O-N 3.45Å
257E44.4Very low41.6Very low184 Ų184156.7 Ų156.786%0.8685%0.853SS**  trans-93118.5164.5-83.4-172.1158.900110.7P255P255-E257 PolarHBondContact O-N 3.3Å
258G39.6Very low41.4Very low70 Ų70156.8 Ų156.872%0.72286%0.856SS**  80.495.3123.500000118.1
259K44Very low41.5Very low206 Ų206154.6 Ų154.690%0.89686%0.857SS**PPolyproline II helixtrans-46.9134.5152.1-76.4176.7172.7178.70111.1
260P47.4Very low41.8Very low126 Ų126151.9 Ų151.982%0.81885%0.853SS**PPolyproline II helixtrans-80.6137.1162.129.7-27.2000110.6
261A43.9Very low42Very low93 Ų93155.2 Ų155.277%0.76985%0.853SS**PPolyproline II helixtrans-65.5146.7-179.200000113.1
262E40.4Very low42.1Very low189 Ų189158.5 Ų158.588%0.88386%0.86SS**PPolyproline II helixtrans-56.9129161.3-71.5174.6143.300110.6
263T42.9Very low42.4Very low147 Ų147154.2 Ų154.290%0.90285%0.854SS**  trans-173.1114.1144.317.10000109
264G47Very low42.4Very low75 Ų75153.4 Ų153.477%0.77386%0.862SS**  trans14982162.700000116.6
265Q40.2Very low42.6Very low277 Ų277153.4 Ų153.4100%1.29488%0.875SS**  trans132.80145.5-76.4-174.7-9.400114.1

Retrieved 265 of 265 residues in 498.1 ms (Link to these results)

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