G4LYG3_SCHMA Loading...

Ornithine transporter 2 (Solute carrier family 25 member 2)

AlphaFold DB , UniProt , Accession G4LYG3, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 312 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
1M74.4Confident82.6Confident182 Ų18292.3 Ų92.390%0.89749%0.487SS*.  0-510-71-55.7-74.700112.3Q3 V4 K5M1-Q3 PolarHBondContact O-N 3.13Å; M1-V4 PolarHBondContact O-N 2.9Å; M1-K5 PolarHBondContact O-N 2.88Å
2E79.5Confident83.2Confident145 Ų14590.6 Ų90.668%0.67848%0.483SS*.Hα-helixtrans-61.1-42.7-177-164.7174.7174.900114.2V4 K5 N6E2-V4 VanDerWaalsContact C-N 3.28Å; E2-V4 PolarHBondContact O-N 3.38Å; E2-K5 WeakPolarHBondContact O-CB 3.33Å; E2-K5 PolarHBondContact O-N 3.36Å; E2-N6 WeakPolarHBondContact O-CB 3.37Å; E2-N6 PolarHBondContact O-N 3.37Å
3Q79.6Confident83.8Confident161 Ų16183.7 Ų83.775%0.75245%0.446SS*.Hα-helixtrans-60.8-36175.5-169.3176.58.700113M1 S7M1-Q3 PolarHBondContact O-N 3.13Å; Q3-S7 WeakPolarHBondContact O-CB 3.36Å; Q3-S7 PolarHBondContact O-N 2.86Å; Q3-S7 PolarHBondContact O-OG 3.44Å
4V82.1Confident84.2Confident88 Ų8879.6 Ų79.653%0.53343%0.434SS..Hα-helixtrans-69.8-45.6176.1178.10000110.1M1 E2 N6 S7 L8M1-V4 PolarHBondContact O-N 2.9Å; E2-V4 VanDerWaalsContact C-N 3.28Å; E2-V4 PolarHBondContact O-N 3.38Å; V4-N6 PolarHBondContact O-N 2.9Å; V4-S7 PolarHBondContact O-N 2.87Å; V4-L8 HydrophobicContact CG1-CD1 4.08Å; V4-L8 HydrophobicContact CG1-CG 4.44Å; V4-L8 WeakPolarHBondContact O-CG 3.26Å; V4-L8 PolarHBondContact O-N 3.36Å
5K83.6Confident84.7Confident84 Ų8477.5 Ų77.537%0.36542%0.421SS..Hα-helixtrans-55.4-50.5173.9-73.7-175.6170.5-169.70111.2M1 E2 S7 L8 I9 L311M1-K5 PolarHBondContact O-N 2.88Å; E2-K5 WeakPolarHBondContact O-CB 3.33Å; E2-K5 PolarHBondContact O-N 3.36Å; K5-S7 VanDerWaalsContact C-N 3.34Å; K5-S7 PolarHBondContact O-N 3.42Å; K5-L8 PolarHBondContact O-N 2.94Å; K5-I9 WeakPolarHBondContact O-CG1 3.28Å; K5-I9 PolarHBondContact O-N 3.36Å; K5-L311 HydrophobicContact CB-CD1 4.27Å; K5-L311 HydrophobicContact CD-CB 4.4Å; K5-L311 HydrophobicContact CD-CD1 4.43Å; K5-L311 HydrophobicContact CG-CD1 4.31Å; K5-L311 PolarHBondContact NZ-O 2.89Å
6N84.6Confident85.3Confident73 Ų7376.6 Ų76.639%0.3942%0.416SS..Hα-helixtrans-62.8-38.6179.7-72.5-19.3000112.6E2 V4 G10 H308E2-N6 WeakPolarHBondContact O-CB 3.37Å; E2-N6 PolarHBondContact O-N 3.37Å; V4-N6 PolarHBondContact O-N 2.9Å; N6-G10 PolarHBondContact O-N 2.91Å; N6-H308 PolarHBondContact OD1-CE1 3.18Å
7S82.4Confident85.8Confident59 Ų5972.1 Ų72.141%0.41339%0.392SS..Hα-helixtrans-66.6-41.4176.3-58.50000111.8Q3 V4 K5 G10 L11Q3-S7 WeakPolarHBondContact O-CB 3.36Å; Q3-S7 PolarHBondContact O-N 2.86Å; Q3-S7 PolarHBondContact O-OG 3.44Å; V4-S7 PolarHBondContact O-N 2.87Å; K5-S7 VanDerWaalsContact C-N 3.34Å; K5-S7 PolarHBondContact O-N 3.42Å; S7-G10 PolarHBondContact O-N 2.97Å; S7-L11 WeakPolarHBondContact O-CB 3.43Å; S7-L11 PolarHBondContact O-N 3.03Å
8L83.5Confident86.3Confident100 Ų10068.1 Ų68.152%0.52437%0.37SS..Hα-helixtrans-65.9-45.8175.9-72.2173.2000111.9V4 K5 G10 L11 V12V4-L8 HydrophobicContact CG1-CD1 4.08Å; V4-L8 HydrophobicContact CG1-CG 4.44Å; V4-L8 WeakPolarHBondContact O-CG 3.26Å; V4-L8 PolarHBondContact O-N 3.36Å; K5-L8 PolarHBondContact O-N 2.94Å; L8-G10 VanDerWaalsContact C-N 3.28Å; L8-G10 PolarHBondContact O-N 3.47Å; L8-L11 PolarHBondContact O-N 3.47Å; L8-V12 WeakPolarHBondContact O-CG2 3.49Å; L8-V12 PolarHBondContact O-N 3.07Å
9I87.7Confident86.8Confident12 Ų1268.2 Ų68.26%0.06237%0.367CS..Hα-helixtrans-57.4-45.4173.8-66.5161.1000109.9K5 L11 V12 A13 R304 L311K5-I9 WeakPolarHBondContact O-CG1 3.28Å; K5-I9 PolarHBondContact O-N 3.36Å; I9-L11 PolarHBondContact O-N 3.4Å; I9-V12 PolarHBondContact O-N 3.3Å; I9-A13 WeakPolarHBondContact O-CB 3.4Å; I9-A13 PolarHBondContact O-N 3.22Å; I9-R304 HydrophobicContact CG2-CB 4.4Å; I9-R304 HydrophobicContact CG2-CG 4.18Å; I9-L311 HydrophobicContact CD1-CD1 3.8Å; I9-L311 HydrophobicContact CG1-CD1 3.87Å
10G86.9Confident87.3Confident32 Ų3266.1 Ų66.133%0.3336%0.359SS..Hα-helixtrans-59.7-43.5177.800000112.9N6 S7 L8 G14N6-G10 PolarHBondContact O-N 2.91Å; S7-G10 PolarHBondContact O-N 2.97Å; L8-G10 VanDerWaalsContact C-N 3.28Å; L8-G10 PolarHBondContact O-N 3.47Å; G10-G14 PolarHBondContact O-N 2.54Å
11L84.9Confident87.7Confident79 Ų7963.9 Ų63.941%0.41435%0.349SS..Hα-helixtrans-64.8-48.4177.7-17766.4000111.8S7 L8 I9 A13 G14 I15S7-L11 WeakPolarHBondContact O-CB 3.43Å; S7-L11 PolarHBondContact O-N 3.03Å; L8-L11 PolarHBondContact O-N 3.47Å; I9-L11 PolarHBondContact O-N 3.4Å; L11-A13 VanDerWaalsContact C-N 3.33Å; L11-A13 PolarHBondContact O-N 3.13Å; L11-G14 PolarHBondContact O-N 2.83Å; L11-I15 HydrophobicContact CG-CD1 4.25Å; L11-I15 WeakPolarHBondContact O-CG1 3.39Å; L11-I15 PolarHBondContact O-N 2.82Å
12V89.2Confident88.7Confident72 Ų7256.1 Ų56.144%0.43631%0.312SS..Hα-helixtrans-63.2-41.4178.6176.50000110.7L8 I9 G14 I15 N16 T303L8-V12 WeakPolarHBondContact O-CG2 3.49Å; L8-V12 PolarHBondContact O-N 3.07Å; I9-V12 PolarHBondContact O-N 3.3Å; V12-G14 VanDerWaalsContact C-N 3.34Å; V12-G14 PolarHBondContact O-N 3.25Å; V12-I15 PolarHBondContact O-N 3.05Å; V12-N16 WeakPolarHBondContact O-CB 3.43Å; V12-N16 PolarHBondContact O-N 2.97Å; V12-T303 HydrophobicContact CB-CG2 4.49Å; V12-T303 HydrophobicContact CG1-CG2 3.91Å
13A91.2Very high89.5Confident1 Ų154.8 Ų54.81%0.00830%0.301CS..Hα-helixtrans-61.3-42.1174.400000112I9 L11 N16 G17 V300 T303 R304I9-A13 WeakPolarHBondContact O-CB 3.4Å; I9-A13 PolarHBondContact O-N 3.22Å; L11-A13 VanDerWaalsContact C-N 3.33Å; L11-A13 PolarHBondContact O-N 3.13Å; A13-N16 PolarHBondContact O-N 3.25Å; A13-G17 PolarHBondContact O-N 3.11Å; A13-V300 HydrophobicContact CB-CG1 4.19Å; A13-V300 WeakPolarHBondContact O-CG2 3.34Å; A13-T303 HydrophobicContact CB-CG2 3.87Å; A13-R304 HydrophobicContact CB-CG 3.73Å
14G89.9Confident90.3Very high27 Ų2750.3 Ų50.328%0.27829%0.285SS..Hα-helixtrans-61.3-43.7174.800000113G10 L11 V12 G18G10-G14 PolarHBondContact O-N 2.54Å; L11-G14 PolarHBondContact O-N 2.83Å; V12-G14 VanDerWaalsContact C-N 3.34Å; V12-G14 PolarHBondContact O-N 3.25Å; G14-G18 PolarHBondContact O-N 2.83Å
15I91.6Very high90.9Very high47 Ų4746.2 Ų46.224%0.24126%0.26CS..Hα-helixtrans-64.1-48.9176.8-67.7168.2000110.9L11 V12 G17 G18 F19 V74L11-I15 HydrophobicContact CG-CD1 4.25Å; L11-I15 WeakPolarHBondContact O-CG1 3.39Å; L11-I15 PolarHBondContact O-N 2.82Å; V12-I15 PolarHBondContact O-N 3.05Å; I15-G17 PolarHBondContact O-N 3.2Å; I15-G18 CarbonylContact O-C 3.53Å; I15-G18 WeakPolarHBondContact O-CA 3.21Å; I15-G18 PolarHBondContact O-N 3.38Å; I15-G18 VanDerWaalsContact O-N 3.17Å; I15-F19 HydrophobicContact CG2-CD1 4.29Å; I15-F19 HydrophobicContact CG2-CE1 4.03Å; I15-F19 HydrophobicContact CG2-CE2 4.38Å; I15-F19 HydrophobicContact CG2-CZ 4.07Å; I15-F19 WeakPolarHBondContact O-CD1 3.44Å; I15-F19 PolarHBondContact O-N 2.79Å; I15-V74 HydrophobicContact CG2-CG2 4.2Å
16N93.8Very high91.5Very high63 Ų6342.3 Ų42.334%0.33724%0.243SC..Hα-helixtrans-63.7-41179.2-74-16000112.1V12 A13 G18 F19 A20 T303V12-N16 WeakPolarHBondContact O-CB 3.43Å; V12-N16 PolarHBondContact O-N 2.97Å; A13-N16 PolarHBondContact O-N 3.25Å; N16-G18 VanDerWaalsContact C-N 3.32Å; N16-F19 PolarHBondContact O-N 2.92Å; N16-A20 WeakPolarHBondContact O-CB 3.36Å; N16-A20 PolarHBondContact O-N 3.17Å; N16-T303 WeakPolarHBondContact CB-OG1 3.33Å; N16-T303 WeakPolarHBondContact ND2-CG2 3.49Å; N16-T303 PolarHBondContact ND2-OG1 3.28Å; N16-T303 VanDerWaalsContact ND2-OG1 3.11Å
17G94.4Very high92Very high0 Ų040.1 Ų40.10%023%0.233CC..Hα-helixtrans-58.1-45.3171.400000112.4A13 I15 A20 S21 L296A13-G17 PolarHBondContact O-N 3.11Å; I15-G17 PolarHBondContact O-N 3.2Å; G17-A20 PolarHBondContact O-N 3.46Å; G17-S21 VanDerWaalsContact O-CB 3.28Å; G17-S21 WeakPolarHBondContact O-CB 3.43Å; G17-S21 PolarHBondContact O-N 3.42Å; G17-L296 WeakPolarHBondContact O-CA 3.48Å
18G94Very high92.6Very high1 Ų139.2 Ų39.21%0.0122%0.223CC..Hα-helixtrans-56.8-46.9172.800000113.4G14 I15 N16 S21 V22 N73G14-G18 PolarHBondContact O-N 2.83Å; I15-G18 CarbonylContact O-C 3.53Å; I15-G18 WeakPolarHBondContact O-CA 3.21Å; I15-G18 PolarHBondContact O-N 3.38Å; I15-G18 VanDerWaalsContact O-N 3.17Å; N16-G18 VanDerWaalsContact C-N 3.32Å; G18-S21 WeakPolarHBondContact O-CB 3.31Å; G18-S21 PolarHBondContact O-N 3.14Å; G18-V22 VanDerWaalsContact O-CG2 3.29Å; G18-V22 WeakPolarHBondContact O-CG2 3.43Å; G18-V22 PolarHBondContact O-N 2.93Å; G18-N73 WeakPolarHBondContact CA-OD1 3.45Å
19F96Very high93.2Very high70 Ų7034.9 Ų34.931%0.30720%0.201SC..Hα-helixtrans-63.7-47.9178.1-76.912.8000111.6I15 N16 S21 V22 Y23 L70 V74I15-F19 HydrophobicContact CG2-CD1 4.29Å; I15-F19 HydrophobicContact CG2-CE1 4.03Å; I15-F19 HydrophobicContact CG2-CE2 4.38Å; I15-F19 HydrophobicContact CG2-CZ 4.07Å; I15-F19 WeakPolarHBondContact O-CD1 3.44Å; I15-F19 PolarHBondContact O-N 2.79Å; N16-F19 PolarHBondContact O-N 2.92Å; F19-S21 VanDerWaalsContact C-N 3.33Å; F19-S21 PolarHBondContact O-N 3.23Å; F19-V22 PolarHBondContact O-N 3.3Å; F19-Y23 WeakPolarHBondContact O-CD2 3.33Å; F19-Y23 PolarHBondContact O-N 3.27Å; F19-L70 HydrophobicContact CB-CD2 4.06Å; F19-L70 HydrophobicContact CD1-CB 4.34Å; F19-L70 HydrophobicContact CD1-CD2 3.37Å; F19-L70 HydrophobicContact CD1-CG 4.36Å; F19-L70 HydrophobicContact CD2-CD2 4.5Å; F19-L70 HydrophobicContact CE1-CB 3.93Å; F19-L70 HydrophobicContact CE1-CD2 3.82Å; F19-L70 HydrophobicContact CE1-CG 4.35Å; F19-L70 HydrophobicContact CG-CD2 3.74Å; F19-V74 HydrophobicContact CE1-CG2 3.64Å; F19-V74 HydrophobicContact CZ-CG2 4.29Å
20A96.3Very high93.5Very high26 Ų2634.3 Ų34.322%0.21520%0.198CC..Hα-helixtrans-59.1-45177.200000111.8N16 G17 V22 Y23 V24 A295 A299N16-A20 WeakPolarHBondContact O-CB 3.36Å; N16-A20 PolarHBondContact O-N 3.17Å; G17-A20 PolarHBondContact O-N 3.46Å; A20-V22 PolarHBondContact O-N 3.35Å; A20-Y23 PolarHBondContact O-N 3.48Å; A20-V24 WeakPolarHBondContact O-CB 3.11Å; A20-V24 WeakPolarHBondContact O-CG2 3.26Å; A20-V24 PolarHBondContact O-N 3.41Å; A20-A295 HydrophobicContact CB-CB 4.14Å; A20-A299 HydrophobicContact CB-CB 3.59Å
21S95.4Very high94Very high20 Ų2033 Ų3314%0.1418%0.183CC..Hα-helixtrans-57.6-45.3174.1-1790000112.5G17 G18 F19 G25G17-S21 VanDerWaalsContact O-CB 3.28Å; G17-S21 WeakPolarHBondContact O-CB 3.43Å; G17-S21 PolarHBondContact O-N 3.42Å; G18-S21 WeakPolarHBondContact O-CB 3.31Å; G18-S21 PolarHBondContact O-N 3.14Å; F19-S21 VanDerWaalsContact C-N 3.33Å; F19-S21 PolarHBondContact O-N 3.23Å; S21-G25 WeakPolarHBondContact O-CA 3.22Å; S21-G25 PolarHBondContact O-N 2.68Å
22V95.9Very high94.4Very high18 Ų1829.5 Ų29.511%0.10917%0.165CC..Hα-helixtrans-64.3-51176.8169.80000110.7G18 F19 A20 V24 G25 Q26 T66 L70 N73G18-V22 VanDerWaalsContact O-CG2 3.29Å; G18-V22 WeakPolarHBondContact O-CG2 3.43Å; G18-V22 PolarHBondContact O-N 2.93Å; F19-V22 PolarHBondContact O-N 3.3Å; A20-V22 PolarHBondContact O-N 3.35Å; V22-V24 VanDerWaalsContact C-N 3.35Å; V22-V24 PolarHBondContact O-N 3.31Å; V22-G25 PolarHBondContact O-N 3.42Å; V22-Q26 WeakPolarHBondContact O-CA 3.18Å; V22-Q26 WeakPolarHBondContact O-CB 3.36Å; V22-Q26 PolarHBondContact O-N 3.46Å; V22-T66 HydrophobicContact CG1-CG2 4.23Å; V22-L70 HydrophobicContact CB-CD2 3.69Å; V22-L70 HydrophobicContact CG1-CD2 3.62Å; V22-L70 HydrophobicContact CG1-CG 3.97Å; V22-L70 HydrophobicContact CG2-CD2 4.16Å; V22-N73 HydrophobicContact CG2-CB 4.28Å
23Y96.6Very high94.7Very high117 Ų11726.1 Ų26.146%0.45914%0.144SC..Hα-helixtrans-61.8-39.8-177.4-81.8-68.7000113.5F19 A20 Y63 T66 L70F19-Y23 WeakPolarHBondContact O-CD2 3.33Å; F19-Y23 PolarHBondContact O-N 3.27Å; A20-Y23 PolarHBondContact O-N 3.48Å; Y23-Y63 HydrophobicContact CD1-CD1 4.46Å; Y23-Y63 HydrophobicContact CD1-CE1 4.08Å; Y23-Y63 VanDerWaalsContact O-CE1 3.22Å; Y23-Y63 WeakPolarHBondContact O-CE1 3.14Å; Y23-Y63 PolarHBondContact O-OH 3.36Å; Y23-T66 HydrophobicContact CD1-CG2 4.27Å; Y23-T66 HydrophobicContact CE1-CG2 3.87Å; Y23-L70 HydrophobicContact CE2-CD1 4.42Å; Y23-L70 HydrophobicContact CE2-CD2 4.3Å
24V96.2Very high94.8Very high67 Ų6726.1 Ų26.141%0.40614%0.144SC..Hα-helixtrans-75-37.3177.3175.20000111.1A20 V22 P291 A295A20-V24 WeakPolarHBondContact O-CB 3.11Å; A20-V24 WeakPolarHBondContact O-CG2 3.26Å; A20-V24 PolarHBondContact O-N 3.41Å; V22-V24 VanDerWaalsContact C-N 3.35Å; V22-V24 PolarHBondContact O-N 3.31Å; V24-P291 HydrophobicContact CG1-CB 3.75Å; V24-P291 HydrophobicContact CG1-CG 4.46Å; V24-A295 HydrophobicContact CB-CB 4.04Å; V24-A295 HydrophobicContact CG1-CB 4.47Å; V24-A295 HydrophobicContact CG2-CB 3.64Å
25G95.1Very high95Very high2 Ų225.3 Ų25.32%0.02113%0.133CC..Hα-helixtrans-82.9-22.4-175.900000115.2S21 V22 L28 D29 R288S21-G25 WeakPolarHBondContact O-CA 3.22Å; S21-G25 PolarHBondContact O-N 2.68Å; V22-G25 PolarHBondContact O-N 3.42Å; G25-L28 PolarHBondContact O-N 2.89Å; G25-D29 PolarHBondContact O-N 2.84Å; G25-R288 WeakPolarHBondContact O-CD 3.36Å
26Q95.6Very high95Very high3 Ų323 Ų231%0.01412%0.122CC..Hα-helixtrans-57.5-44.7-169.1-170.569.617.300113.6V22 L28 D29 T30 Y63 A64 G65 S69 Q133V22-Q26 WeakPolarHBondContact O-CA 3.18Å; V22-Q26 WeakPolarHBondContact O-CB 3.36Å; V22-Q26 PolarHBondContact O-N 3.46Å; Q26-L28 VanDerWaalsContact C-N 3.34Å; Q26-L28 PolarHBondContact O-N 3.36Å; Q26-D29 PolarHBondContact O-N 3.42Å; Q26-T30 PolarHBondContact O-N 3.43Å; Q26-T30 PolarHBondContact O-OG1 3.41Å; Q26-Y63 HydrophobicContact CB-CD1 4.03Å; Q26-Y63 HydrophobicContact CB-CE1 4.14Å; Q26-Y63 HydrophobicContact CG-CD1 4.14Å; Q26-A64 PolarHBondContact NE2-O 3.34Å; Q26-G65 VanDerWaalsContact NE2-C 3.34Å; Q26-S69 PolarHBondContact OE1-OG 3.35Å; Q26-Q133 VanDerWaalsContact NE2-NE2 3.14Å
27P95.9Very high94.8Very high27 Ų2720.6 Ų20.618%0.17511%0.109CC..Hα-helixtrans-56.1-47.6179.8-28.838000112.9T30 I31 L62 Y63P27-T30 PolarHBondContact O-N 2.97Å; P27-I31 WeakPolarHBondContact O-CG1 3.32Å; P27-I31 PolarHBondContact O-N 3.45Å; P27-I31 VanDerWaalsContact O-N 3.15Å; P27-L62 HydrophobicContact CB-CB 4.03Å; P27-L62 HydrophobicContact CB-CD1 4.28Å; P27-L62 HydrophobicContact CB-CD2 4.47Å; P27-L62 HydrophobicContact CB-CG 4.49Å; P27-L62 HydrophobicContact CG-CB 4.34Å; P27-Y63 HydrophobicContact CG-CE1 4.45Å; P27-Y63 HydrophobicContact CG-CE2 3.89Å
28L95.2Very high94.7Very high39 Ų3921 Ų2120%0.20411%0.111CC..Hα-helixtrans-71.7-32.4-179.4-70.2171.5000112.2G25 Q26 I31 K32 P284 L287 R288G25-L28 PolarHBondContact O-N 2.89Å; Q26-L28 VanDerWaalsContact C-N 3.34Å; Q26-L28 PolarHBondContact O-N 3.36Å; L28-I31 PolarHBondContact O-N 3.01Å; L28-K32 WeakPolarHBondContact O-CB 3.26Å; L28-K32 PolarHBondContact O-N 3.44Å; L28-P284 HydrophobicContact CD2-CB 4.46Å; L28-L287 HydrophobicContact CD1-CB 4.38Å; L28-L287 HydrophobicContact CD1-CD2 4.28Å; L28-L287 HydrophobicContact CD1-CG 4.03Å; L28-L287 HydrophobicContact CD2-CD2 4.21Å; L28-R288 HydrophobicContact CB-CB 3.77Å; L28-R288 HydrophobicContact CB-CG 3.96Å; L28-R288 VanDerWaalsContact CD1-CA 3.49Å; L28-R288 HydrophobicContact CD1-CB 3.71Å; L28-R288 HydrophobicContact CD1-CG 4.29Å; L28-R288 HydrophobicContact CG-CB 4.4Å
29D94.9Very high94.2Very high10 Ų1021.2 Ų21.25%0.05311%0.112CC..Hα-helixtrans-68.5-39.4175.1-175.976.7000112.3G25 Q26 I31 K32 V33 K129 Q133G25-D29 PolarHBondContact O-N 2.84Å; Q26-D29 PolarHBondContact O-N 3.42Å; D29-I31 PolarHBondContact O-N 3.04Å; D29-K32 WeakPolarHBondContact O-CB 3.31Å; D29-K32 PolarHBondContact O-N 3.05Å; D29-K32 WeakPolarHBondContact OD1-CE 3.42Å; D29-K32 IonicContact OD1-NZ 3.43Å; D29-K32 PolarHBondContact OD1-NZ 2.88Å; D29-V33 WeakPolarHBondContact O-CG2 3.23Å; D29-V33 PolarHBondContact O-N 3.27Å; D29-K129 IonicContact OD1-NZ 2.86Å; D29-K129 WeakPolarHBondContact OD2-CE 3.49Å; D29-K129 IonicContact OD2-NZ 3.75Å; D29-K129 PolarHBondContact OD2-NZ 2.61Å; D29-Q133 PolarHBondContact OD2-NE2 3.01Å
30T95.1Very high93.7Very high0 Ų025.3 Ų25.30%013%0.132CC..Hα-helixtrans-61.9-44.9173-61.30000111.4Q26 P27 K32 V33 K34 G61 L62 A64 Q133Q26-T30 PolarHBondContact O-N 3.43Å; Q26-T30 PolarHBondContact O-OG1 3.41Å; P27-T30 PolarHBondContact O-N 2.97Å; T30-K32 VanDerWaalsContact C-N 3.33Å; T30-K32 PolarHBondContact O-N 3.41Å; T30-V33 PolarHBondContact O-N 2.88Å; T30-K34 HydrophobicContact CG2-CD 4.25Å; T30-K34 WeakPolarHBondContact O-CG 3.3Å; T30-K34 PolarHBondContact O-N 3.39Å; T30-G61 WeakPolarHBondContact CG2-O 3.47Å; T30-L62 WeakPolarHBondContact CB-O 3.44Å; T30-L62 PolarHBondContact OG1-O 2.88Å; T30-A64 PolarHBondContact OG1-O 3.31Å; T30-Q133 HydrophobicContact CG2-CB 4.18Å; T30-Q133 HydrophobicContact CG2-CG 4.11Å; T30-Q133 PolarHBondContact OG1-NE2 2.9Å; T30-Q133 VanDerWaalsContact OG1-NE2 3.13Å
31I95.8Very high93.2Very high3 Ų326.2 Ų26.22%0.01514%0.135CC..Hα-helixtrans-62.9-41.4175.6-62.9-55.3000111.2P27 L28 D29 K34 M35 T45 C48 L49 L62 P284P27-I31 WeakPolarHBondContact O-CG1 3.32Å; P27-I31 PolarHBondContact O-N 3.45Å; P27-I31 VanDerWaalsContact O-N 3.15Å; L28-I31 PolarHBondContact O-N 3.01Å; D29-I31 PolarHBondContact O-N 3.04Å; I31-K34 PolarHBondContact O-N 3.11Å; I31-M35 HydrophobicContact CG2-CG 4.27Å; I31-M35 HydrophobicContact CG2-SD 3.91Å; I31-M35 WeakPolarHBondContact O-CB 3.46Å; I31-M35 VanDerWaalsContact O-CG 3.28Å; I31-M35 WeakPolarHBondContact O-CG 3.48Å; I31-M35 PolarHBondContact O-N 2.86Å; I31-T45 HydrophobicContact CG2-CG2 3.93Å; I31-C48 HydrophobicContact CD1-CB 4.33Å; I31-C48 HydrophobicContact CG2-CB 4.03Å; I31-L49 HydrophobicContact CD1-CB 4.25Å; I31-L49 HydrophobicContact CD1-CD1 4.41Å; I31-L49 HydrophobicContact CG1-CD1 4.47Å; I31-L62 HydrophobicContact CD1-CD2 3.98Å; I31-L62 HydrophobicContact CG1-CD2 4.18Å; I31-P284 HydrophobicContact CG2-CG 4.49Å
32K95.2Very high92.9Very high6 Ų625.3 Ų25.33%0.02613%0.128CC..Hα-helixtrans-54.5-56.5174-179.7-154.172.6165.20110.7L28 D29 T30 K34 M35 Q36 F229 D232 P284 T285L28-K32 WeakPolarHBondContact O-CB 3.26Å; L28-K32 PolarHBondContact O-N 3.44Å; D29-K32 WeakPolarHBondContact O-CB 3.31Å; D29-K32 PolarHBondContact O-N 3.05Å; D29-K32 WeakPolarHBondContact OD1-CE 3.42Å; D29-K32 IonicContact OD1-NZ 3.43Å; D29-K32 PolarHBondContact OD1-NZ 2.88Å; T30-K32 VanDerWaalsContact C-N 3.33Å; T30-K32 PolarHBondContact O-N 3.41Å; K32-K34 VanDerWaalsContact C-N 3.31Å; K32-K34 PolarHBondContact O-N 3.2Å; K32-M35 PolarHBondContact O-N 3.14Å; K32-Q36 VanDerWaalsContact CE-OE1 3.31Å; K32-Q36 HydrophobicContact CG-CG 4.2Å; K32-Q36 WeakPolarHBondContact O-CB 3.1Å; K32-Q36 VanDerWaalsContact O-CG 3.26Å; K32-Q36 WeakPolarHBondContact O-CG 3.32Å; K32-Q36 PolarHBondContact O-N 3.14Å; K32-F229 HydrophobicContact CG-CZ 4.33Å; K32-D232 WeakPolarHBondContact CE-OD2 3.47Å; K32-D232 IonicContact NZ-OD1 3.69Å; K32-D232 IonicContact NZ-OD2 3.79Å; K32-D232 PolarHBondContact NZ-OD2 3.3Å; K32-P284 HydrophobicContact CB-CB 4.5Å; K32-T285 WeakPolarHBondContact CD-OG1 3.39Å; K32-T285 VanDerWaalsContact CG-OG1 3.31Å; K32-T285 WeakPolarHBondContact CG-OG1 3.39Å
33V94.5Very high92.4Very high1 Ų127.9 Ų27.91%0.00615%0.145CC..Hα-helixtrans-61.2-40.7-176.5171.60000111.6D29 T30 Q36 T37 C130 Q133 I240D29-V33 WeakPolarHBondContact O-CG2 3.23Å; D29-V33 PolarHBondContact O-N 3.27Å; T30-V33 PolarHBondContact O-N 2.88Å; V33-Q36 PolarHBondContact O-N 3.06Å; V33-T37 WeakPolarHBondContact O-CB 3.38Å; V33-T37 PolarHBondContact O-N 2.91Å; V33-T37 PolarHBondContact O-OG1 3.44Å; V33-C130 HydrophobicContact CG1-CB 4.09Å; V33-Q133 HydrophobicContact CG1-CB 4.33Å; V33-I240 HydrophobicContact CG1-CD1 3.9Å
34K94Very high92.2Very high1 Ų124.8 Ų24.80%0.00414%0.141CC..Hα-helixtrans-61.8-45.2175.7-73.6-177.8173.1-150.20112.2T30 I31 K32 T37 F38 T52 D56 Q133 E137T30-K34 HydrophobicContact CG2-CD 4.25Å; T30-K34 WeakPolarHBondContact O-CG 3.3Å; T30-K34 PolarHBondContact O-N 3.39Å; I31-K34 PolarHBondContact O-N 3.11Å; K32-K34 VanDerWaalsContact C-N 3.31Å; K32-K34 PolarHBondContact O-N 3.2Å; K34-T37 PolarHBondContact O-N 2.7Å; K34-F38 PolarHBondContact O-N 3.42Å; K34-T52 PolarHBondContact NZ-OG1 3.49Å; K34-T52 VanDerWaalsContact NZ-OG1 3.13Å; K34-D56 IonicContact NZ-OD2 3.72Å; K34-D56 PolarHBondContact NZ-OD2 2.74Å; K34-Q133 WeakPolarHBondContact CE-O 3.26Å; K34-E137 WeakPolarHBondContact CD-OE1 2.76Å; K34-E137 WeakPolarHBondContact CE-OE1 3.06Å; K34-E137 WeakPolarHBondContact CE-OE2 3.16Å; K34-E137 IonicContact NZ-OE1 2.95Å; K34-E137 PolarHBondContact NZ-OE1 2.84Å; K34-E137 IonicContact NZ-OE2 2.63Å; K34-E137 PolarHBondContact NZ-OE2 3.37Å
35M92.6Very high92Very high10 Ų1024 Ų245%0.04914%0.136CC..Hα-helixtrans-67.4-39177.2-71.8-179.572.400113.1I31 K32 T37 H42 T45 C48 P284I31-M35 HydrophobicContact CG2-CG 4.27Å; I31-M35 HydrophobicContact CG2-SD 3.91Å; I31-M35 WeakPolarHBondContact O-CB 3.46Å; I31-M35 VanDerWaalsContact O-CG 3.28Å; I31-M35 WeakPolarHBondContact O-CG 3.48Å; I31-M35 PolarHBondContact O-N 2.86Å; K32-M35 PolarHBondContact O-N 3.14Å; M35-T37 VanDerWaalsContact C-N 3.25Å; M35-T37 PolarHBondContact O-N 3.03Å; M35-H42 HydrophobicContact CG-CB 4.28Å; M35-T45 VanDerWaalsContact SD-CA 3.51Å; M35-T45 HydrophobicContact SD-CG2 4.48Å; M35-T45 PolarHBondContact SD-OG1 3.34Å; M35-T45 VanDerWaalsContact SD-OG1 3.42Å; M35-C48 HydrophobicContact CG-CB 4.17Å; M35-P284 HydrophobicContact SD-CG 3.98Å
36Q92.4Very high91.9Very high0 Ų031 Ų310%016%0.162CC..Hα-helixtrans-64.4-35178.2-75.7175.8-36.300111K32 V33 F229 D232 V233 S236 R237 R280K32-Q36 VanDerWaalsContact CE-OE1 3.31Å; K32-Q36 HydrophobicContact CG-CG 4.2Å; K32-Q36 WeakPolarHBondContact O-CB 3.1Å; K32-Q36 VanDerWaalsContact O-CG 3.26Å; K32-Q36 WeakPolarHBondContact O-CG 3.32Å; K32-Q36 PolarHBondContact O-N 3.14Å; V33-Q36 PolarHBondContact O-N 3.06Å; Q36-F229 HydrophobicContact CG-CE1 4.45Å; Q36-F229 HydrophobicContact CG-CZ 4.44Å; Q36-D232 PolarHBondContact NE2-OD2 3.21Å; Q36-V233 HydrophobicContact CG-CG2 4.05Å; Q36-S236 PolarHBondContact OE1-OG 2.95Å; Q36-R237 PolarHBondContact O-NE 2.64Å; Q36-R237 PolarHBondContact O-NH2 3.45Å; Q36-R280 WeakPolarHBondContact CG-O 3.42Å
37T90.6Very high91.8Very high11 Ų1136 Ų367%0.06718%0.184CC..Hα-helixtrans-95.9-37.5-170.6-46.60000113.7V33 K34 M35 P39 R237 I240V33-T37 WeakPolarHBondContact O-CB 3.38Å; V33-T37 PolarHBondContact O-N 2.91Å; V33-T37 PolarHBondContact O-OG1 3.44Å; K34-T37 PolarHBondContact O-N 2.7Å; M35-T37 VanDerWaalsContact C-N 3.25Å; M35-T37 PolarHBondContact O-N 3.03Å; T37-P39 VanDerWaalsContact C-CD 3.42Å; T37-P39 WeakPolarHBondContact O-CD 3.38Å; T37-R237 VanDerWaalsContact O-CZ 3.23Å; T37-R237 PolarHBondContact O-NE 3.48Å; T37-R237 PolarHBondContact O-NH1 2.97Å; T37-I240 HydrophobicContact CG2-CB 3.63Å; T37-I240 HydrophobicContact CG2-CD1 3.39Å; T37-I240 HydrophobicContact CG2-CG1 4.08Å; T37-I240 HydrophobicContact CG2-CG2 3.46Å; T37-I240 VanDerWaalsContact CG2-CG2 3.46Å; T37-I240 WeakPolarHBondContact OG1-CD1 3.48Å
38F90.6Very high91.7Very high10 Ų1034.8 Ų34.84%0.04418%0.176CC..  trans-120.270.7-176.3-49.1-75.5000110.7K34 E40 V41 H42 S134 E137 M138 L141 I240K34-F38 PolarHBondContact O-N 3.42Å; F38-E40 PolarHBondContact O-N 3.02Å; F38-V41 HydrophobicContact CB-CB 3.96Å; F38-V41 HydrophobicContact CB-CG2 4.07Å; F38-V41 PolarHBondContact O-N 2.91Å; F38-H42 PolarHBondContact O-N 3.45Å; F38-S134 VanDerWaalsContact CE2-CB 3.44Å; F38-E137 HydrophobicContact CD1-CB 4.06Å; F38-E137 HydrophobicContact CD2-CB 3.48Å; F38-E137 VanDerWaalsContact CD2-CB 3.48Å; F38-E137 HydrophobicContact CD2-CG 3.67Å; F38-E137 HydrophobicContact CE1-CB 3.89Å; F38-E137 HydrophobicContact CE2-CB 3.3Å; F38-E137 HydrophobicContact CE2-CG 3.92Å; F38-E137 HydrophobicContact CG-CB 3.84Å; F38-E137 HydrophobicContact CG-CG 4.14Å; F38-E137 HydrophobicContact CZ-CB 3.51Å; F38-M138 HydrophobicContact CE1-CG 4.4Å; F38-M138 HydrophobicContact CZ-CG 3.81Å; F38-L141 HydrophobicContact CD1-CD1 3.37Å; F38-L141 HydrophobicContact CE1-CD1 3.69Å; F38-L141 HydrophobicContact CG-CD1 4.42Å; F38-I240 HydrophobicContact CE1-CG2 4.45Å; F38-I240 HydrophobicContact CZ-CG2 3.91Å
39P85Confident91.7Very high5 Ų534.9 Ų34.93%0.03218%0.176CC..THydrogen-bonded Turntrans-63.2-30.9-174.829-38.7000112.4T37 R237 R280T37-P39 VanDerWaalsContact C-CD 3.42Å; T37-P39 WeakPolarHBondContact O-CD 3.38Å; P39-R237 VanDerWaalsContact CD-CZ 3.4Å; P39-R237 VanDerWaalsContact CD-NH1 3.34Å; P39-R280 VanDerWaalsContact C-NH1 3.35Å; P39-R280 VanDerWaalsContact CA-NH1 3.25Å; P39-R280 VanDerWaalsContact CB-CZ 3.42Å; P39-R280 PolarHBondContact O-NH1 2.96Å
40E85Confident91.7Very high155 Ų15541.7 Ų41.772%0.72420%0.201SC*.THydrogen-bonded Turntrans-74.9-36.9179.4-54.4-50.7144.300112.1F38F38-E40 PolarHBondContact O-N 3.02Å
41V86Confident91.6Very high46 Ų4643.6 Ų43.628%0.27921%0.213SC..THydrogen-bonded Turntrans-79-40.2-179.6-175.60000110.7F38 P43 L141F38-V41 HydrophobicContact CB-CB 3.96Å; F38-V41 HydrophobicContact CB-CG2 4.07Å; F38-V41 PolarHBondContact O-N 2.91Å; V41-P43 VanDerWaalsContact C-CD 3.45Å; V41-P43 VanDerWaalsContact O-CD 3.31Å; V41-P43 WeakPolarHBondContact O-CD 3.26Å; V41-L141 HydrophobicContact CG2-CD1 4.35Å; V41-L141 HydrophobicContact CG2-CD2 4.29Å
42H89.1Confident91.5Very high1 Ų143.5 Ų43.51%0.00521%0.212CC..  trans-124.270-171-65.4-55.9000112.3M35 F38 S44 C48 E137M35-H42 HydrophobicContact CG-CB 4.28Å; F38-H42 PolarHBondContact O-N 3.45Å; H42-S44 VanDerWaalsContact C-N 3.31Å; H42-S44 PolarHBondContact O-N 3.32Å; H42-C48 HydrophobicContact CB-CB 3.9Å; H42-C48 WeakPolarHBondContact ND1-CA 3.4Å; H42-C48 PolarHBondContact ND1-SG 2.96Å; H42-E137 IonicContact CD2-OE1 3.22Å; H42-E137 IonicContact CE1-OE1 2.74Å; H42-E137 IonicContact NE2-OE1 3.5Å; H42-E137 PolarHBondContact NE2-OE1 3.27Å
43P85.2Confident91.4Very high71 Ų7146.5 Ų46.546%0.46123%0.228SC..SBendtrans-71.5-23.3-179.528.2-35.8000113.6V41 K47V41-P43 VanDerWaalsContact C-CD 3.45Å; V41-P43 VanDerWaalsContact O-CD 3.31Å; V41-P43 WeakPolarHBondContact O-CD 3.26Å; P43-K47 HydrophobicContact CG-CD 4.39Å
44S91.4Very high91.3Very high53 Ų5350.7 Ų50.737%0.37126%0.263SS..SBendtrans-131.8143.9-178.970.90000112.4H42 W46 K47 C48H42-S44 VanDerWaalsContact C-N 3.31Å; H42-S44 PolarHBondContact O-N 3.32Å; S44-W46 VanDerWaalsContact C-N 3.31Å; S44-W46 PolarHBondContact O-N 2.81Å; S44-K47 PolarHBondContact O-N 3.18Å; S44-K47 WeakPolarHBondContact OG-CB 3.45Å; S44-K47 PolarHBondContact OG-N 3.34Å; S44-C48 WeakPolarHBondContact O-CB 3.1Å; S44-C48 PolarHBondContact O-N 3.17Å
45T92.8Very high91.2Very high51 Ų5156.3 Ų56.331%0.31329%0.288SS..Hα-helixtrans-53.9-47.7179.4-54.60000111.9I31 M35 C48 L49 P284I31-T45 HydrophobicContact CG2-CG2 3.93Å; M35-T45 VanDerWaalsContact SD-CA 3.51Å; M35-T45 HydrophobicContact SD-CG2 4.48Å; M35-T45 PolarHBondContact SD-OG1 3.34Å; M35-T45 VanDerWaalsContact SD-OG1 3.42Å; T45-C48 WeakPolarHBondContact O-CB 3.36Å; T45-C48 PolarHBondContact O-N 2.95Å; T45-L49 WeakPolarHBondContact O-CB 3.37Å; T45-L49 PolarHBondContact O-N 3.29Å; T45-P284 HydrophobicContact CG2-CG 3.67Å; T45-P284 WeakPolarHBondContact OG1-CG 3.44Å
46W93.5Very high90.9Very high149 Ų14957.6 Ų57.656%0.56429%0.294SS*.Hα-helixtrans-68.4-39.3-175.9-173.5-121.2000112.6S44 L49 R50S44-W46 VanDerWaalsContact C-N 3.31Å; S44-W46 PolarHBondContact O-N 2.81Å; W46-L49 HydrophobicContact CE3-CD2 3.81Å; W46-L49 HydrophobicContact CZ3-CD2 3.64Å; W46-L49 PolarHBondContact O-N 3.08Å; W46-R50 VanDerWaalsContact CE2-NE 3.27Å; W46-R50 HydrophobicContact CZ2-CG 4.48Å; W46-R50 WeakPolarHBondContact O-CG 3.24Å; W46-R50 PolarHBondContact O-N 3.16Å
47K92.8Very high90.8Very high108 Ų10858.9 Ų58.947%0.4731%0.308SS..Hα-helixtrans-64.2-44.8173.3-174.1178.5179-175.30110.4P43 S44 L49 R50 V51P43-K47 HydrophobicContact CG-CD 4.39Å; S44-K47 PolarHBondContact O-N 3.18Å; S44-K47 WeakPolarHBondContact OG-CB 3.45Å; S44-K47 PolarHBondContact OG-N 3.34Å; K47-L49 VanDerWaalsContact C-N 3.32Å; K47-L49 PolarHBondContact O-N 3.41Å; K47-R50 PolarHBondContact O-N 2.83Å; K47-V51 HydrophobicContact CG-CG2 4.22Å; K47-V51 WeakPolarHBondContact O-CB 3.19Å; K47-V51 VanDerWaalsContact O-CG2 3.22Å; K47-V51 WeakPolarHBondContact O-CG2 3.49Å; K47-V51 PolarHBondContact O-N 2.97Å
48C93.6Very high90.9Very high0 Ų063.4 Ų63.40%033%0.331CS..Hα-helixtrans-59.2-43.2177.1-170.90000112.1I31 M35 H42 S44 T45 T52I31-C48 HydrophobicContact CD1-CB 4.33Å; I31-C48 HydrophobicContact CG2-CB 4.03Å; M35-C48 HydrophobicContact CG-CB 4.17Å; H42-C48 HydrophobicContact CB-CB 3.9Å; H42-C48 WeakPolarHBondContact ND1-CA 3.4Å; H42-C48 PolarHBondContact ND1-SG 2.96Å; S44-C48 WeakPolarHBondContact O-CB 3.1Å; S44-C48 PolarHBondContact O-N 3.17Å; T45-C48 WeakPolarHBondContact O-CB 3.36Å; T45-C48 PolarHBondContact O-N 2.95Å; C48-T52 WeakPolarHBondContact O-CB 3.28Å; C48-T52 PolarHBondContact O-N 2.78Å; C48-T52 PolarHBondContact O-OG1 2.93Å
49L95.3Very high90.8Very high42 Ų4266.7 Ų66.722%0.2236%0.36CS..Hα-helixtrans-61.9-52.7176.5177.258.2000111.7I31 T45 W46 K47 V51 T52 L53 L62I31-L49 HydrophobicContact CD1-CB 4.25Å; I31-L49 HydrophobicContact CD1-CD1 4.41Å; I31-L49 HydrophobicContact CG1-CD1 4.47Å; T45-L49 WeakPolarHBondContact O-CB 3.37Å; T45-L49 PolarHBondContact O-N 3.29Å; W46-L49 HydrophobicContact CE3-CD2 3.81Å; W46-L49 HydrophobicContact CZ3-CD2 3.64Å; W46-L49 PolarHBondContact O-N 3.08Å; K47-L49 VanDerWaalsContact C-N 3.32Å; K47-L49 PolarHBondContact O-N 3.41Å; L49-V51 PolarHBondContact O-N 3.43Å; L49-T52 PolarHBondContact O-N 3.13Å; L49-L53 HydrophobicContact CD1-CD1 3.84Å; L49-L53 HydrophobicContact CD1-CG 4.13Å; L49-L53 HydrophobicContact CG-CD1 4.08Å; L49-L53 WeakPolarHBondContact O-CB 3.36Å; L49-L53 WeakPolarHBondContact O-CG 3.4Å; L49-L53 PolarHBondContact O-N 2.87Å; L49-L62 HydrophobicContact CD1-CD1 3.97Å; L49-L62 HydrophobicContact CD1-CD2 3.65Å; L49-L62 HydrophobicContact CD1-CG 4.43Å
50R95.1Very high90.9Very high152 Ų15274.2 Ų74.257%0.57439%0.387SS*.Hα-helixtrans-59.9-45.9178.8-76.5-175.3173.4172.70.4112.3W46 K47 T52 L53 A54W46-R50 VanDerWaalsContact CE2-NE 3.27Å; W46-R50 HydrophobicContact CZ2-CG 4.48Å; W46-R50 WeakPolarHBondContact O-CG 3.24Å; W46-R50 PolarHBondContact O-N 3.16Å; K47-R50 PolarHBondContact O-N 2.83Å; R50-T52 VanDerWaalsContact C-N 3.33Å; R50-T52 PolarHBondContact O-N 2.88Å; R50-L53 PolarHBondContact O-N 2.8Å; R50-A54 VanDerWaalsContact O-CB 3.26Å; R50-A54 WeakPolarHBondContact O-CB 3.38Å; R50-A54 PolarHBondContact O-N 3.33Å
51V93.1Very high91.1Very high41 Ų4166.8 Ų66.825%0.24835%0.353CS..Hα-helixtrans-66.2-37.6179.2173.80000111K47 L49 K55 R136K47-V51 HydrophobicContact CG-CG2 4.22Å; K47-V51 WeakPolarHBondContact O-CB 3.19Å; K47-V51 VanDerWaalsContact O-CG2 3.22Å; K47-V51 WeakPolarHBondContact O-CG2 3.49Å; K47-V51 PolarHBondContact O-N 2.97Å; L49-V51 PolarHBondContact O-N 3.43Å; V51-K55 HydrophobicContact CG1-CD 4.03Å; V51-K55 WeakPolarHBondContact O-CB 3.43Å; V51-K55 PolarHBondContact O-N 3.42Å; V51-K55 VanDerWaalsContact O-N 3.16Å; V51-R136 PolarHBondContact O-NH1 3.29Å
52T93Very high91.5Very high0 Ų065.4 Ų65.40%034%0.344CS..Hα-helixtrans-65.5-47.6175.3-62.20000111.3K34 C48 L49 R50 D56 G57 L62K34-T52 PolarHBondContact NZ-OG1 3.49Å; K34-T52 VanDerWaalsContact NZ-OG1 3.13Å; C48-T52 WeakPolarHBondContact O-CB 3.28Å; C48-T52 PolarHBondContact O-N 2.78Å; C48-T52 PolarHBondContact O-OG1 2.93Å; L49-T52 PolarHBondContact O-N 3.13Å; R50-T52 VanDerWaalsContact C-N 3.33Å; R50-T52 PolarHBondContact O-N 2.88Å; T52-D56 HydrophobicContact CG2-CB 4.46Å; T52-D56 WeakPolarHBondContact O-CA 3.5Å; T52-D56 WeakPolarHBondContact O-CB 3.44Å; T52-D56 PolarHBondContact O-N 2.84Å; T52-G57 PolarHBondContact O-N 3.27Å; T52-L62 HydrophobicContact CG2-CD2 3.98Å
53L94.1Very high91.8Very high69 Ų6969.1 Ų69.136%0.36136%0.358SS..Hα-helixtrans-62.3-44.2177.2-75.6172.2000112.8L49 R50 K55 G57 I58 L62L49-L53 HydrophobicContact CD1-CD1 3.84Å; L49-L53 HydrophobicContact CD1-CG 4.13Å; L49-L53 HydrophobicContact CG-CD1 4.08Å; L49-L53 WeakPolarHBondContact O-CB 3.36Å; L49-L53 WeakPolarHBondContact O-CG 3.4Å; L49-L53 PolarHBondContact O-N 2.87Å; R50-L53 PolarHBondContact O-N 2.8Å; L53-K55 PolarHBondContact O-N 3.16Å; L53-G57 VanDerWaalsContact O-CA 3.31Å; L53-G57 WeakPolarHBondContact O-CA 3.21Å; L53-G57 PolarHBondContact O-N 2.9Å; L53-G57 VanDerWaalsContact O-N 3.15Å; L53-I58 HydrophobicContact CD2-CG1 3.69Å; L53-L62 HydrophobicContact CD2-CD1 3.54Å; L53-L62 HydrophobicContact CD2-CG 4.06Å; L53-L62 HydrophobicContact CG-CD1 4.13Å
54A92.8Very high92.1Very high89 Ų8966.1 Ų66.174%0.73634%0.34SS*.Hα-helixtrans-67.8-34.5-177.100000113.3R50R50-A54 VanDerWaalsContact O-CB 3.26Å; R50-A54 WeakPolarHBondContact O-CB 3.38Å; R50-A54 PolarHBondContact O-N 3.33Å
55K90.2Very high92.1Very high120 Ų12063.8 Ų63.852%0.52232%0.324SS..Hα-helixtrans-101-39.5-174.8-71.3-176.7175.8-168.30114.1V51 L53 E140V51-K55 HydrophobicContact CG1-CD 4.03Å; V51-K55 WeakPolarHBondContact O-CB 3.43Å; V51-K55 PolarHBondContact O-N 3.42Å; V51-K55 VanDerWaalsContact O-N 3.16Å; L53-K55 PolarHBondContact O-N 3.16Å; K55-E140 VanDerWaalsContact NZ-CD 3.3Å; K55-E140 IonicContact NZ-OE1 3.66Å; K55-E140 PolarHBondContact NZ-OE1 3.19Å; K55-E140 IonicContact NZ-OE2 2.68Å; K55-E140 PolarHBondContact NZ-OE2 3.03Å
56D87.3Confident92.2Very high36 Ų3662.1 Ų62.119%0.19331%0.314CS..Hα-helixtrans-104.8-16.5-175.8-58.7-20.5000113.1K34 T52 G61 R136K34-D56 IonicContact NZ-OD2 3.72Å; K34-D56 PolarHBondContact NZ-OD2 2.74Å; T52-D56 HydrophobicContact CG2-CB 4.46Å; T52-D56 WeakPolarHBondContact O-CA 3.5Å; T52-D56 WeakPolarHBondContact O-CB 3.44Å; T52-D56 PolarHBondContact O-N 2.84Å; D56-G61 PolarHBondContact O-N 2.98Å; D56-R136 WeakPolarHBondContact OD1-CD 3.41Å; D56-R136 IonicContact OD1-CZ 3.25Å; D56-R136 IonicContact OD1-NE 2.83Å; D56-R136 IonicContact OD1-NH1 3.17Å; D56-R136 PolarHBondContact OD1-NH1 3.32Å; D56-R136 IonicContact OD2-CZ 3.87Å; D56-R136 VanDerWaalsContact OD2-CZ 3.24Å; D56-R136 IonicContact OD2-NE 3.36Å; D56-R136 IonicContact OD2-NH1 2.82Å; D56-R136 PolarHBondContact OD2-NH1 3.04Å; D56-R136 IonicContact OD2-NH2 3.38Å
57G90.2Very high92.3Very high28 Ų2859.4 Ų59.429%0.28931%0.313SS..Hα-helixtrans67.7-167-169.700000113.5T52 L53 G61T52-G57 PolarHBondContact O-N 3.27Å; L53-G57 VanDerWaalsContact O-CA 3.31Å; L53-G57 WeakPolarHBondContact O-CA 3.21Å; L53-G57 PolarHBondContact O-N 2.9Å; L53-G57 VanDerWaalsContact O-N 3.15Å; G57-G61 VanDerWaalsContact O-CA 3.25Å; G57-G61 WeakPolarHBondContact O-CA 3.47Å; G57-G61 PolarHBondContact O-N 3.42Å
58I92.5Very high92.4Very high105 Ų10554.7 Ų54.754%0.53829%0.294SS..Iπ-helixtrans-79.3-54.4-174.2-62.1171.2000111.2L53 L62 Y63L53-I58 HydrophobicContact CD2-CG1 3.69Å; I58-L62 PolarHBondContact O-N 3.48Å; I58-Y63 HydrophobicContact CG2-CD2 3.85Å; I58-Y63 HydrophobicContact CG2-CE2 4.05Å; I58-Y63 PolarHBondContact O-N 3.15Å
59A88.2Confident92.4Very high79 Ų7955 Ų5565%0.65330%0.296SS*.Iπ-helixtrans-67.2-45.1-171.700000113.1Y63A59-Y63 CarbonylContact O-C 3.58Å
60R86.8Confident92.5Very high163 Ų16354 Ų5462%0.61529%0.291SS*.Iπ-helixtrans-91.8-15.7-179.8-67.6-176.5178.5-163.1-5.9113.9A64 K149R60-A64 WeakPolarHBondContact O-CB 3.31Å; R60-K149 VanDerWaalsContact NH1-CA 3.31Å; R60-K149 PolarHBondContact NH1-O 2.92Å; R60-K149 PolarHBondContact NH2-O 3.2Å
61G91Very high92.5Very high0 Ų050.5 Ų50.50%029%0.286CS..Iπ-helixtrans-93-86173.600000110.4T30 D56 G57 Y63 A64T30-G61 WeakPolarHBondContact CG2-O 3.47Å; D56-G61 PolarHBondContact O-N 2.98Å; G57-G61 VanDerWaalsContact O-CA 3.25Å; G57-G61 WeakPolarHBondContact O-CA 3.47Å; G57-G61 PolarHBondContact O-N 3.42Å; G61-Y63 VanDerWaalsContact C-N 3.32Å; G61-Y63 PolarHBondContact O-N 2.89Å; G61-A64 WeakPolarHBondContact O-CB 3.27Å; G61-A64 PolarHBondContact O-N 2.89Å
62L93.7Very high92.5Very high16 Ų1648.9 Ų48.98%0.08428%0.277CS..Iπ-helixtrans-60.4-38.4-172.2-62.6-176.9000113.9P27 T30 I31 L49 T52 L53 I58P27-L62 HydrophobicContact CB-CB 4.03Å; P27-L62 HydrophobicContact CB-CD1 4.28Å; P27-L62 HydrophobicContact CB-CD2 4.47Å; P27-L62 HydrophobicContact CB-CG 4.49Å; P27-L62 HydrophobicContact CG-CB 4.34Å; T30-L62 WeakPolarHBondContact CB-O 3.44Å; T30-L62 PolarHBondContact OG1-O 2.88Å; I31-L62 HydrophobicContact CD1-CD2 3.98Å; I31-L62 HydrophobicContact CG1-CD2 4.18Å; L49-L62 HydrophobicContact CD1-CD1 3.97Å; L49-L62 HydrophobicContact CD1-CD2 3.65Å; L49-L62 HydrophobicContact CD1-CG 4.43Å; T52-L62 HydrophobicContact CG2-CD2 3.98Å; L53-L62 HydrophobicContact CD2-CD1 3.54Å; L53-L62 HydrophobicContact CD2-CG 4.06Å; L53-L62 HydrophobicContact CG-CD1 4.13Å; I58-L62 PolarHBondContact O-N 3.48Å
63Y94.9Very high92.5Very high79 Ų7950 Ų5031%0.3128%0.283SS..THydrogen-bonded Turntrans-93.410.2178.3-75.2-86.6000113.9Y23 Q26 P27 I58 A59 G61 G65 T66Y23-Y63 HydrophobicContact CD1-CD1 4.46Å; Y23-Y63 HydrophobicContact CD1-CE1 4.08Å; Y23-Y63 VanDerWaalsContact O-CE1 3.22Å; Y23-Y63 WeakPolarHBondContact O-CE1 3.14Å; Y23-Y63 PolarHBondContact O-OH 3.36Å; Q26-Y63 HydrophobicContact CB-CD1 4.03Å; Q26-Y63 HydrophobicContact CB-CE1 4.14Å; Q26-Y63 HydrophobicContact CG-CD1 4.14Å; P27-Y63 HydrophobicContact CG-CE1 4.45Å; P27-Y63 HydrophobicContact CG-CE2 3.89Å; I58-Y63 HydrophobicContact CG2-CD2 3.85Å; I58-Y63 HydrophobicContact CG2-CE2 4.05Å; I58-Y63 PolarHBondContact O-N 3.15Å; A59-Y63 CarbonylContact O-C 3.58Å; G61-Y63 VanDerWaalsContact C-N 3.32Å; G61-Y63 PolarHBondContact O-N 2.89Å; Y63-G65 PolarHBondContact O-N 2.76Å; Y63-T66 WeakPolarHBondContact O-CB 3.31Å; Y63-T66 PolarHBondContact O-N 3.04Å; Y63-T66 VanDerWaalsContact O-N 3.14Å; Y63-T66 PolarHBondContact O-OG1 3.39Å
64A91.5Very high92.5Very high9 Ų949.1 Ų49.17%0.07428%0.28CS..THydrogen-bonded Turntrans-55.1129.6169.800000110Q26 T30 R60 G61 V132 Q133Q26-A64 PolarHBondContact NE2-O 3.34Å; T30-A64 PolarHBondContact OG1-O 3.31Å; R60-A64 WeakPolarHBondContact O-CB 3.31Å; G61-A64 WeakPolarHBondContact O-CB 3.27Å; G61-A64 PolarHBondContact O-N 2.89Å; A64-V132 HydrophobicContact CB-CG1 4.22Å; A64-Q133 HydrophobicContact CB-CG 4.4Å; A64-Q133 WeakPolarHBondContact O-CG 3.38Å
65G92.1Very high92.5Very high4 Ų446.1 Ų46.14%0.04126%0.256CS..THydrogen-bonded Turntrans81.99.4178.600000115Q26 Y63 V67 P68 S69Q26-G65 VanDerWaalsContact NE2-C 3.34Å; Y63-G65 PolarHBondContact O-N 2.76Å; G65-V67 VanDerWaalsContact C-N 3.34Å; G65-V67 PolarHBondContact O-N 3.4Å; G65-P68 WeakPolarHBondContact O-CD 3.32Å; G65-P68 VanDerWaalsContact O-CG 3.23Å; G65-P68 WeakPolarHBondContact O-CG 3.47Å; G65-S69 WeakPolarHBondContact O-CB 3.21Å; G65-S69 PolarHBondContact O-N 2.63Å; G65-S69 PolarHBondContact O-OG 3.35Å; G65-S69 VanDerWaalsContact O-OG 3.09Å
66T95Very high92.5Very high16 Ų1642.2 Ų42.210%0.09824%0.239CC..Hα-helixtrans-55.1-48.2174.6-58.10000111.7V22 Y23 Y63 S69 L70V22-T66 HydrophobicContact CG1-CG2 4.23Å; Y23-T66 HydrophobicContact CD1-CG2 4.27Å; Y23-T66 HydrophobicContact CE1-CG2 3.87Å; Y63-T66 WeakPolarHBondContact O-CB 3.31Å; Y63-T66 PolarHBondContact O-N 3.04Å; Y63-T66 VanDerWaalsContact O-N 3.14Å; Y63-T66 PolarHBondContact O-OG1 3.39Å; T66-S69 WeakPolarHBondContact O-CA 3.32Å; T66-S69 WeakPolarHBondContact O-CB 3.49Å; T66-S69 PolarHBondContact O-N 3.24Å; T66-S69 VanDerWaalsContact O-N 3.12Å; T66-L70 HydrophobicContact CG2-CD1 3.94Å; T66-L70 HydrophobicContact CG2-CG 4.17Å; T66-L70 WeakPolarHBondContact O-CG 3.47Å; T66-L70 PolarHBondContact O-N 2.97Å
67V94.5Very high92.6Very high92 Ų9243 Ų4356%0.55824%0.243SC*.Hα-helixtrans-56.6-55.2-179.91760000112.3G65 S69 L70 V71 P153G65-V67 VanDerWaalsContact C-N 3.34Å; G65-V67 PolarHBondContact O-N 3.4Å; V67-S69 VanDerWaalsContact C-N 3.28Å; V67-S69 PolarHBondContact O-N 3.4Å; V67-L70 PolarHBondContact O-N 3.47Å; V67-V71 WeakPolarHBondContact O-CG2 3.39Å; V67-V71 PolarHBondContact O-N 3.31Å; V67-P153 HydrophobicContact CB-CG 4.31Å
68P94.6Very high92.6Very high8 Ų843.8 Ų43.85%0.05225%0.247CC..Hα-helixtrans-64.6-28.9176.624.1-33.3000113.2G65 A72 V128 K129 P153G65-P68 WeakPolarHBondContact O-CD 3.32Å; G65-P68 VanDerWaalsContact O-CG 3.23Å; G65-P68 WeakPolarHBondContact O-CG 3.47Å; P68-A72 VanDerWaalsContact O-CB 3.23Å; P68-A72 WeakPolarHBondContact O-CB 3.24Å; P68-A72 PolarHBondContact O-N 3.37Å; P68-V128 HydrophobicContact CB-CB 4.4Å; P68-V128 HydrophobicContact CB-CG1 4.21Å; P68-V128 HydrophobicContact CG-CG1 4.3Å; P68-K129 HydrophobicContact CB-CB 3.98Å; P68-K129 HydrophobicContact CG-CB 3.89Å; P68-P153 HydrophobicContact CG-CB 4.38Å; P68-P153 HydrophobicContact CG-CG 4.49Å
69S95.3Very high92.6Very high6 Ų640.3 Ų40.34%0.04223%0.231CC..Hα-helixtrans-62.6-43.9170.3-66.30000112.6Q26 G65 T66 V67 A72 N73 K129Q26-S69 PolarHBondContact OE1-OG 3.35Å; G65-S69 WeakPolarHBondContact O-CB 3.21Å; G65-S69 PolarHBondContact O-N 2.63Å; G65-S69 PolarHBondContact O-OG 3.35Å; G65-S69 VanDerWaalsContact O-OG 3.09Å; T66-S69 WeakPolarHBondContact O-CA 3.32Å; T66-S69 WeakPolarHBondContact O-CB 3.49Å; T66-S69 PolarHBondContact O-N 3.24Å; T66-S69 VanDerWaalsContact O-N 3.12Å; V67-S69 VanDerWaalsContact C-N 3.28Å; V67-S69 PolarHBondContact O-N 3.4Å; S69-A72 PolarHBondContact O-N 3.33Å; S69-N73 WeakPolarHBondContact O-CB 3.41Å; S69-N73 PolarHBondContact O-N 3.39Å; S69-K129 WeakPolarHBondContact OG-CD 3.28Å; S69-K129 WeakPolarHBondContact OG-CE 3.3Å; S69-K129 PolarHBondContact OG-NZ 3.04Å
70L95.8Very high92.7Very high22 Ų2237.9 Ų37.912%0.11521%0.207CC..Hα-helixtrans-65.3-44.6178.1-65.1170.8000110.8F19 V22 Y23 T66 V67 N73 V74F19-L70 HydrophobicContact CB-CD2 4.06Å; F19-L70 HydrophobicContact CD1-CB 4.34Å; F19-L70 HydrophobicContact CD1-CD2 3.37Å; F19-L70 HydrophobicContact CD1-CG 4.36Å; F19-L70 HydrophobicContact CD2-CD2 4.5Å; F19-L70 HydrophobicContact CE1-CB 3.93Å; F19-L70 HydrophobicContact CE1-CD2 3.82Å; F19-L70 HydrophobicContact CE1-CG 4.35Å; F19-L70 HydrophobicContact CG-CD2 3.74Å; V22-L70 HydrophobicContact CB-CD2 3.69Å; V22-L70 HydrophobicContact CG1-CD2 3.62Å; V22-L70 HydrophobicContact CG1-CG 3.97Å; V22-L70 HydrophobicContact CG2-CD2 4.16Å; Y23-L70 HydrophobicContact CE2-CD1 4.42Å; Y23-L70 HydrophobicContact CE2-CD2 4.3Å; T66-L70 HydrophobicContact CG2-CD1 3.94Å; T66-L70 HydrophobicContact CG2-CG 4.17Å; T66-L70 WeakPolarHBondContact O-CG 3.47Å; T66-L70 PolarHBondContact O-N 2.97Å; V67-L70 PolarHBondContact O-N 3.47Å; L70-N73 PolarHBondContact O-N 2.9Å; L70-V74 WeakPolarHBondContact O-CG2 3.47Å; L70-V74 PolarHBondContact O-N 3.4Å
71V95.3Very high92.8Very high78 Ų7836.7 Ų36.747%0.47321%0.206SC..Hα-helixtrans-62.5-43.5176176.60000111.1V67 N73 V74 A75 T125V67-V71 WeakPolarHBondContact O-CG2 3.39Å; V67-V71 PolarHBondContact O-N 3.31Å; V71-N73 VanDerWaalsContact C-N 3.32Å; V71-N73 PolarHBondContact O-N 3.06Å; V71-V74 PolarHBondContact O-N 2.69Å; V71-A75 VanDerWaalsContact O-CB 3.25Å; V71-A75 WeakPolarHBondContact O-CB 3.29Å; V71-A75 PolarHBondContact O-N 2.83Å; V71-T125 HydrophobicContact CB-CG2 4.5Å; V71-T125 HydrophobicContact CG1-CG2 3.87Å
72A94.3Very high92.8Very high7 Ų741 Ų416%0.05824%0.236CC..Hα-helixtrans-56.6-48.4175.800000110.9P68 S69 A75 E76 L122 T125P68-A72 VanDerWaalsContact O-CB 3.23Å; P68-A72 WeakPolarHBondContact O-CB 3.24Å; P68-A72 PolarHBondContact O-N 3.37Å; S69-A72 PolarHBondContact O-N 3.33Å; A72-A75 PolarHBondContact O-N 2.97Å; A72-E76 WeakPolarHBondContact O-CB 3.45Å; A72-E76 PolarHBondContact O-N 3.41Å; A72-L122 HydrophobicContact CB-CD2 4.04Å; A72-T125 VanDerWaalsContact CB-OG1 3.24Å; A72-T125 WeakPolarHBondContact CB-OG1 3.43Å
73N93.1Very high92.8Very high24 Ų2440.9 Ų40.913%0.12824%0.236CC..Hα-helixtrans-65.2-43.1-178.6178.8-94.1000113G18 V22 S69 L70 V71 E76 N77G18-N73 WeakPolarHBondContact CA-OD1 3.45Å; V22-N73 HydrophobicContact CG2-CB 4.28Å; S69-N73 WeakPolarHBondContact O-CB 3.41Å; S69-N73 PolarHBondContact O-N 3.39Å; L70-N73 PolarHBondContact O-N 2.9Å; V71-N73 VanDerWaalsContact C-N 3.32Å; V71-N73 PolarHBondContact O-N 3.06Å; N73-E76 PolarHBondContact O-N 2.89Å; N73-N77 WeakPolarHBondContact O-CB 3.49Å; N73-N77 PolarHBondContact O-N 2.99Å; N73-N77 PolarHBondContact O-ND2 3Å; N73-N77 PolarHBondContact OD1-ND2 3.16Å
74V92.7Very high92.6Very high50 Ų5040 Ų4030%0.30324%0.237SC..Hα-helixtrans-64.5-45.3176.7172.30000110.8I15 F19 L70 V71 N77 A78I15-V74 HydrophobicContact CG2-CG2 4.2Å; F19-V74 HydrophobicContact CE1-CG2 3.64Å; F19-V74 HydrophobicContact CZ-CG2 4.29Å; L70-V74 WeakPolarHBondContact O-CG2 3.47Å; L70-V74 PolarHBondContact O-N 3.4Å; V71-V74 PolarHBondContact O-N 2.69Å; V74-N77 PolarHBondContact O-N 3.12Å; V74-A78 WeakPolarHBondContact O-CB 3.21Å; V74-A78 PolarHBondContact O-N 3.33Å
75A92.6Very high92.6Very high27 Ų2742.3 Ų42.322%0.22325%0.251CS..Hα-helixtrans-63.9-42178.700000111.9V71 A72 A78 V79V71-A75 VanDerWaalsContact O-CB 3.25Å; V71-A75 WeakPolarHBondContact O-CB 3.29Å; V71-A75 PolarHBondContact O-N 2.83Å; A72-A75 PolarHBondContact O-N 2.97Å; A75-A78 PolarHBondContact O-N 3.07Å; A75-V79 VanDerWaalsContact O-CG2 3.3Å; A75-V79 WeakPolarHBondContact O-CG2 3.41Å; A75-V79 PolarHBondContact O-N 3.43Å
76E91.9Very high92.6Very high38 Ų3846 Ų4618%0.17827%0.274CS..Hα-helixtrans-60.9-51.1175.7178.4177.7-154.300111.4A72 N73 A78 V79 L80 L122A72-E76 WeakPolarHBondContact O-CB 3.45Å; A72-E76 PolarHBondContact O-N 3.41Å; N73-E76 PolarHBondContact O-N 2.89Å; E76-A78 VanDerWaalsContact C-N 3.32Å; E76-A78 PolarHBondContact O-N 3.19Å; E76-V79 PolarHBondContact O-N 3.39Å; E76-L80 HydrophobicContact CG-CD1 3.88Å; E76-L80 HydrophobicContact CG-CG 4.4Å; E76-L80 WeakPolarHBondContact O-CB 3.24Å; E76-L80 WeakPolarHBondContact O-CG 3.33Å; E76-L80 PolarHBondContact O-N 3.48Å; E76-L122 HydrophobicContact CB-CD1 4.49Å; E76-L122 HydrophobicContact CB-CD2 3.91Å; E76-L122 HydrophobicContact CB-CG 4.23Å; E76-L122 HydrophobicContact CG-CD1 4.14Å; E76-L122 HydrophobicContact CG-CD2 4.33Å; E76-L122 HydrophobicContact CG-CG 4.43Å
77N88.9Confident92.5Very high51 Ų5145.4 Ų45.427%0.27327%0.271SS..Hα-helixtrans-59.6-42.3178-79.4-27.9000112N73 V74 F81N73-N77 WeakPolarHBondContact O-CB 3.49Å; N73-N77 PolarHBondContact O-N 2.99Å; N73-N77 PolarHBondContact O-ND2 3Å; N73-N77 PolarHBondContact OD1-ND2 3.16Å; V74-N77 PolarHBondContact O-N 3.12Å; N77-F81 VanDerWaalsContact O-CB 3.31Å; N77-F81 WeakPolarHBondContact O-CB 3.45Å; N77-F81 PolarHBondContact O-N 2.85Å
78A90.9Very high92.4Very high46 Ų4642.4 Ų42.438%0.3825%0.251SS..Hα-helixtrans-63.3-44.1177.300000111.9V74 A75 E76 C82V74-A78 WeakPolarHBondContact O-CB 3.21Å; V74-A78 PolarHBondContact O-N 3.33Å; A75-A78 PolarHBondContact O-N 3.07Å; E76-A78 VanDerWaalsContact C-N 3.32Å; E76-A78 PolarHBondContact O-N 3.19Å; A78-C82 PolarHBondContact O-N 3.3Å; A78-C82 PolarHBondContact O-SG 3.27Å; A78-C82 VanDerWaalsContact O-SG 3.39Å
79V92.4Very high92.3Very high31 Ų3148.5 Ų48.519%0.18828%0.278CS..Hα-helixtrans-68.2-44.4178.7173.20000111.4A75 E76 F81 C82 A83 W117 T121A75-V79 VanDerWaalsContact O-CG2 3.3Å; A75-V79 WeakPolarHBondContact O-CG2 3.41Å; A75-V79 PolarHBondContact O-N 3.43Å; E76-V79 PolarHBondContact O-N 3.39Å; V79-F81 VanDerWaalsContact C-N 3.31Å; V79-F81 PolarHBondContact O-N 3.22Å; V79-C82 PolarHBondContact O-N 3.01Å; V79-A83 HydrophobicContact CG1-CB 4.38Å; V79-A83 WeakPolarHBondContact O-CB 3.34Å; V79-A83 PolarHBondContact O-N 2.6Å; V79-W117 VanDerWaalsContact CG1-C 3.5Å; V79-W117 HydrophobicContact CG1-CB 3.63Å; V79-T121 HydrophobicContact CG2-CG2 3.69Å
80L90.2Very high92.2Very high28 Ų2852.4 Ų52.415%0.14730%0.298CS..Hα-helixtrans-61.1-41.8177.7-72.2174.1000111.4E76 C82 A83 L84 A114 Y184E76-L80 HydrophobicContact CG-CD1 3.88Å; E76-L80 HydrophobicContact CG-CG 4.4Å; E76-L80 WeakPolarHBondContact O-CB 3.24Å; E76-L80 WeakPolarHBondContact O-CG 3.33Å; E76-L80 PolarHBondContact O-N 3.48Å; L80-C82 VanDerWaalsContact C-N 3.28Å; L80-C82 PolarHBondContact O-N 2.96Å; L80-A83 PolarHBondContact O-N 3.31Å; L80-L84 WeakPolarHBondContact O-CB 3.46Å; L80-L84 PolarHBondContact O-N 3.45Å; L80-A114 HydrophobicContact CD2-CB 4.03Å; L80-Y184 WeakPolarHBondContact CD1-OH 3.31Å
81F88Confident92Very high138 Ų13852 Ų5261%0.60530%0.296SS*.Hα-helixtrans-58.6-40.1175.8-175.6-96000112.4N77 V79 P85N77-F81 VanDerWaalsContact O-CB 3.31Å; N77-F81 WeakPolarHBondContact O-CB 3.45Å; N77-F81 PolarHBondContact O-N 2.85Å; V79-F81 VanDerWaalsContact C-N 3.31Å; V79-F81 PolarHBondContact O-N 3.22Å; F81-P85 WeakPolarHBondContact O-CD 3.32Å
82C91.2Very high91.9Very high92 Ų9248.6 Ų48.662%0.62228%0.276SS*.Hα-helixtrans-79-37.8178.5-67.60000113.6A78 V79 L80 P86A78-C82 PolarHBondContact O-N 3.3Å; A78-C82 PolarHBondContact O-SG 3.27Å; A78-C82 VanDerWaalsContact O-SG 3.39Å; V79-C82 PolarHBondContact O-N 3.01Å; L80-C82 VanDerWaalsContact C-N 3.28Å; L80-C82 PolarHBondContact O-N 2.96Å; C82-P86 WeakPolarHBondContact O-CD 3.41Å
83A93.1Very high91.8Very high12 Ų1251.3 Ų51.310%0.09931%0.305CS..Hα-helixtrans-90.5-25.9-170.200000113.5V79 L80 P86 S87 A114 W117V79-A83 HydrophobicContact CG1-CB 4.38Å; V79-A83 WeakPolarHBondContact O-CB 3.34Å; V79-A83 PolarHBondContact O-N 2.6Å; L80-A83 PolarHBondContact O-N 3.31Å; A83-P86 WeakPolarHBondContact O-CD 3.15Å; A83-S87 VanDerWaalsContact O-CB 3.31Å; A83-S87 WeakPolarHBondContact O-CB 3.4Å; A83-S87 PolarHBondContact O-N 3.05Å; A83-S87 VanDerWaalsContact O-N 3.14Å; A83-S87 PolarHBondContact O-OG 3.31Å; A83-A114 HydrophobicContact CB-CB 4.02Å; A83-W117 HydrophobicContact CB-CB 4.17Å; A83-W117 HydrophobicContact CB-CG 4.3Å
84L90.7Very high91.7Very high62 Ų6256.2 Ų56.233%0.32533%0.33SS..Hα-helixtrans-65.3-48.2-178.1-173.966.4000112.5L80 S87 E88 A114L80-L84 WeakPolarHBondContact O-CB 3.46Å; L80-L84 PolarHBondContact O-N 3.45Å; L84-S87 WeakPolarHBondContact O-CB 3.26Å; L84-S87 PolarHBondContact O-N 3.49Å; L84-S87 VanDerWaalsContact O-N 3.08Å; L84-E88 HydrophobicContact CD1-CG 4.28Å; L84-E88 HydrophobicContact CG-CG 4.31Å; L84-E88 WeakPolarHBondContact O-CG 3.48Å; L84-E88 PolarHBondContact O-N 3.1Å; L84-A114 HydrophobicContact CB-CB 4.35Å; L84-A114 HydrophobicContact CD1-CB 4.27Å
85P91Very high91.6Very high57 Ų5756.9 Ų56.937%0.3734%0.336SS..Hα-helixtrans-61.4-43.2-178-18.930000114.3F81 S87 E88 H89F81-P85 WeakPolarHBondContact O-CD 3.32Å; P85-S87 VanDerWaalsContact C-N 3.34Å; P85-E88 PolarHBondContact O-N 3.03Å; P85-H89 PolarHBondContact O-N 3.25Å
86P92.7Very high91.4Very high80 Ų8059 Ų5952%0.51936%0.361SS..Hα-helixtrans-63.8-36.7171.8-23.834.4000113.2C82 A83 H89 L90C82-P86 WeakPolarHBondContact O-CD 3.41Å; A83-P86 WeakPolarHBondContact O-CD 3.15Å; P86-H89 PolarHBondContact O-N 3.09Å; P86-L90 WeakPolarHBondContact O-CB 3.42Å; P86-L90 PolarHBondContact O-N 3.35Å
87S92.7Very high91.2Very high5 Ų559.6 Ų59.64%0.03537%0.367CS..Hα-helixtrans-66.6-39.8178.2-57.90000111.8A83 L84 P85 L90 I91 A110 I113 A114A83-S87 VanDerWaalsContact O-CB 3.31Å; A83-S87 WeakPolarHBondContact O-CB 3.4Å; A83-S87 PolarHBondContact O-N 3.05Å; A83-S87 VanDerWaalsContact O-N 3.14Å; A83-S87 PolarHBondContact O-OG 3.31Å; L84-S87 WeakPolarHBondContact O-CB 3.26Å; L84-S87 PolarHBondContact O-N 3.49Å; L84-S87 VanDerWaalsContact O-N 3.08Å; P85-S87 VanDerWaalsContact C-N 3.34Å; S87-L90 PolarHBondContact O-N 3.03Å; S87-I91 WeakPolarHBondContact O-CG1 3.13Å; S87-I91 PolarHBondContact O-N 2.94Å; S87-A110 VanDerWaalsContact CB-O 3.25Å; S87-A110 WeakPolarHBondContact CB-O 3.42Å; S87-I113 WeakPolarHBondContact OG-CG2 3.44Å; S87-A114 PolarHBondContact OG-N 3.44Å
88E92.5Very high91Very high28 Ų2862.7 Ų62.713%0.13138%0.384CS..Hα-helixtrans-64.5-41.7173.1-70.9178.7147.600111.6L84 P85 L90 I91 A92 K99 L102 H107 A110L84-E88 HydrophobicContact CD1-CG 4.28Å; L84-E88 HydrophobicContact CG-CG 4.31Å; L84-E88 WeakPolarHBondContact O-CG 3.48Å; L84-E88 PolarHBondContact O-N 3.1Å; P85-E88 PolarHBondContact O-N 3.03Å; E88-L90 VanDerWaalsContact C-N 3.33Å; E88-L90 PolarHBondContact O-N 3.41Å; E88-I91 PolarHBondContact O-N 3.48Å; E88-A92 WeakPolarHBondContact O-CB 3.4Å; E88-A92 PolarHBondContact O-N 3.26Å; E88-K99 HydrophobicContact CB-CG 4.49Å; E88-K99 WeakPolarHBondContact OE2-CE 3.35Å; E88-K99 IonicContact OE2-NZ 2.91Å; E88-K99 PolarHBondContact OE2-NZ 3.46Å; E88-L102 HydrophobicContact CB-CD1 3.98Å; E88-L102 HydrophobicContact CG-CD1 4.24Å; E88-H107 IonicContact OE1-CE1 3.88Å; E88-H107 PolarHBondContact OE1-CE1 3.02Å; E88-H107 IonicContact OE1-ND1 2.8Å; E88-H107 PolarHBondContact OE1-ND1 3.37Å; E88-H107 VanDerWaalsContact OE1-ND1 3.08Å; E88-A110 HydrophobicContact CB-CB 4.4Å; E88-A110 HydrophobicContact CG-CB 3.8Å
89H92.8Very high90.4Very high137 Ų13765 Ų6563%0.63439%0.385SS*.Hα-helixtrans-62.8-40.7176.7-17371.4000112P85 P86 A92 G93P85-H89 PolarHBondContact O-N 3.25Å; P86-H89 PolarHBondContact O-N 3.09Å; H89-A92 PolarHBondContact O-N 2.9Å; H89-G93 PolarHBondContact O-N 3.49Å
90L93.5Very high89.8Confident88 Ų8868.3 Ų68.346%0.46141%0.41SS..Hα-helixtrans-62-48.5175.2177.861.7000111.6P86 S87 E88 G93 L94 I113P86-L90 WeakPolarHBondContact O-CB 3.42Å; P86-L90 PolarHBondContact O-N 3.35Å; S87-L90 PolarHBondContact O-N 3.03Å; E88-L90 VanDerWaalsContact C-N 3.33Å; E88-L90 PolarHBondContact O-N 3.41Å; L90-G93 PolarHBondContact O-N 3.38Å; L90-L94 HydrophobicContact CD1-CD1 4.16Å; L90-L94 HydrophobicContact CD1-CG 4.32Å; L90-L94 HydrophobicContact CG-CD1 4.12Å; L90-L94 WeakPolarHBondContact O-CB 3.41Å; L90-L94 VanDerWaalsContact O-CG 3.28Å; L90-L94 WeakPolarHBondContact O-CG 3.13Å; L90-L94 PolarHBondContact O-N 3.35Å; L90-I113 HydrophobicContact CD2-CD1 4.18Å
91I91.8Very high89.5Confident13 Ų1373.5 Ų73.57%0.06743%0.433CS..Hα-helixtrans-65.8-41.3178.8-66.3-60.5000111.6S87 E88 G93 L94 C95 L102 Q106 L109 A110 I113S87-I91 WeakPolarHBondContact O-CG1 3.13Å; S87-I91 PolarHBondContact O-N 2.94Å; E88-I91 PolarHBondContact O-N 3.48Å; I91-G93 VanDerWaalsContact C-N 3.35Å; I91-G93 PolarHBondContact O-N 3.37Å; I91-L94 HydrophobicContact CD1-CD1 4.49Å; I91-L94 PolarHBondContact O-N 2.95Å; I91-C95 WeakPolarHBondContact O-CB 3.31Å; I91-C95 PolarHBondContact O-N 3.45Å; I91-C95 PolarHBondContact O-SG 3.15Å; I91-L102 HydrophobicContact CG2-CD2 4.33Å; I91-Q106 HydrophobicContact CG2-CB 3.83Å; I91-Q106 HydrophobicContact CG2-CG 4.1Å; I91-L109 HydrophobicContact CD1-CB 4.18Å; I91-L109 HydrophobicContact CG1-CB 4.48Å; I91-A110 HydrophobicContact CB-CB 4.47Å; I91-A110 HydrophobicContact CG1-CB 3.99Å; I91-I113 HydrophobicContact CD1-CD1 3.68Å; I91-I113 HydrophobicContact CG1-CD1 4.07Å
92A92.6Very high89.3Confident7 Ų767.6 Ų67.66%0.05841%0.408CS..Hα-helixtrans-56-48.6174.300000111.4E88 H89 C95 G96 V97 L102E88-A92 WeakPolarHBondContact O-CB 3.4Å; E88-A92 PolarHBondContact O-N 3.26Å; H89-A92 PolarHBondContact O-N 2.9Å; A92-C95 PolarHBondContact O-N 2.87Å; A92-G96 PolarHBondContact O-N 3.22Å; A92-V97 CarbonylContact C-O 3.44Å; A92-V97 WeakPolarHBondContact CA-O 3.26Å; A92-V97 VanDerWaalsContact CB-O 3.27Å; A92-V97 WeakPolarHBondContact CB-O 3.35Å; A92-V97 PolarHBondContact O-N 2.86Å; A92-L102 HydrophobicContact CB-CD2 4.06Å
93G92.1Very high89.1Confident63 Ų6365.9 Ų65.965%0.64940%0.396SS*.Hα-helixtrans-62.8-42.3176.500000113.4H89 L90 I91 C95 G96H89-G93 PolarHBondContact O-N 3.49Å; L90-G93 PolarHBondContact O-N 3.38Å; I91-G93 VanDerWaalsContact C-N 3.35Å; I91-G93 PolarHBondContact O-N 3.37Å; G93-C95 VanDerWaalsContact C-N 3.33Å; G93-C95 PolarHBondContact O-N 3.04Å; G93-G96 PolarHBondContact O-N 2.88Å
94L92.2Very high88.7Confident128 Ų12868 Ų6867%0.6741%0.408SS*.Hα-helixtrans-67.2-32.1178.1-71.7173.9000113.1L90 I91L90-L94 HydrophobicContact CD1-CD1 4.16Å; L90-L94 HydrophobicContact CD1-CG 4.32Å; L90-L94 HydrophobicContact CG-CD1 4.12Å; L90-L94 WeakPolarHBondContact O-CB 3.41Å; L90-L94 VanDerWaalsContact O-CG 3.28Å; L90-L94 WeakPolarHBondContact O-CG 3.13Å; L90-L94 PolarHBondContact O-N 3.35Å; I91-L94 HydrophobicContact CD1-CD1 4.49Å; I91-L94 PolarHBondContact O-N 2.95Å
95C89.5Confident88.4Confident63 Ų6369 Ų6943%0.42641%0.413SS..Hα-helixtrans-91.9-8.9178.7-66.30000113.7I91 A92 G93 V97 Q106I91-C95 WeakPolarHBondContact O-CB 3.31Å; I91-C95 PolarHBondContact O-N 3.45Å; I91-C95 PolarHBondContact O-SG 3.15Å; A92-C95 PolarHBondContact O-N 2.87Å; G93-C95 VanDerWaalsContact C-N 3.33Å; G93-C95 PolarHBondContact O-N 3.04Å; C95-V97 VanDerWaalsContact C-N 3.26Å; C95-V97 HydrophobicContact CB-CG2 4.01Å; C95-V97 PolarHBondContact O-N 2.79Å; C95-Q106 VanDerWaalsContact CB-NE2 3.26Å; C95-Q106 PolarHBondContact SG-NE2 2.99Å
96G88.3Confident88.3Confident73 Ų7367.7 Ų67.775%0.75340%0.402SS*.THydrogen-bonded Turntrans6331.7-173.800000113.2A92 G93A92-G96 PolarHBondContact O-N 3.22Å; G93-G96 PolarHBondContact O-N 2.88Å
97V87.2Confident88.1Confident49 Ų4967 Ų6730%0.29739%0.392SS..  trans-116.5145.9-179.3-175.10000109.1A92 C95 H101A92-V97 CarbonylContact C-O 3.44Å; A92-V97 WeakPolarHBondContact CA-O 3.26Å; A92-V97 VanDerWaalsContact CB-O 3.27Å; A92-V97 WeakPolarHBondContact CB-O 3.35Å; A92-V97 PolarHBondContact O-N 2.86Å; C95-V97 VanDerWaalsContact C-N 3.26Å; C95-V97 HydrophobicContact CB-CG2 4.01Å; C95-V97 PolarHBondContact O-N 2.79Å; V97-H101 HydrophobicContact CG1-CB 3.78Å
98D85Confident87.9Confident116 Ų11666.8 Ų66.862%0.6239%0.39SS*.  trans-62.6145.1171.7-75.4-47.1000112S100 H101D98-S100 PolarHBondContact O-N 3.15Å; D98-H101 PolarHBondContact O-N 3.44Å
99K78.2Confident87.7Confident95 Ų9569.2 Ų69.241%0.41340%0.404SS..G310 helixtrans-53.9-32.7178.7-176.1-179.7176.2175.90112.9E88 H101E88-K99 HydrophobicContact CB-CG 4.49Å; E88-K99 WeakPolarHBondContact OE2-CE 3.35Å; E88-K99 IonicContact OE2-NZ 2.91Å; E88-K99 PolarHBondContact OE2-NZ 3.46Å; K99-H101 VanDerWaalsContact C-N 3.31Å; K99-H101 PolarHBondContact O-N 3.03Å
100S80.8Confident87.7Confident101 Ų10162.7 Ų62.771%0.70637%0.374SS*.G310 helixtrans-75.2-14.5179.147.80000114.4D98D98-S100 PolarHBondContact O-N 3.15Å
101H83Confident87.6Confident137 Ų13758.8 Ų58.863%0.63436%0.355SS*.G310 helixtrans-114.117.1-175.5-68.2-94.9000113.1V97 D98 K99 S103V97-H101 HydrophobicContact CG1-CB 3.78Å; D98-H101 PolarHBondContact O-N 3.44Å; K99-H101 VanDerWaalsContact C-N 3.31Å; K99-H101 PolarHBondContact O-N 3.03Å; H101-S103 PolarHBondContact O-N 3.23Å
102L84.9Confident87.5Confident14 Ų1458.9 Ų58.97%0.07336%0.357CS..  trans-61.8128176.3-67.8178000110.4E88 I91 A92 Q106 H107E88-L102 HydrophobicContact CB-CD1 3.98Å; E88-L102 HydrophobicContact CG-CD1 4.24Å; I91-L102 HydrophobicContact CG2-CD2 4.33Å; A92-L102 HydrophobicContact CB-CD2 4.06Å; L102-Q106 HydrophobicContact CB-CB 4.2Å; L102-Q106 HydrophobicContact CD2-CB 4Å; L102-H107 WeakPolarHBondContact CB-NE2 3.5Å; L102-H107 PolarHBondContact O-CD2 3.06Å; L102-H107 VanDerWaalsContact O-CD2 3.24Å; L102-H107 PolarHBondContact O-NE2 3.3Å
103S86.6Confident87.4Confident55 Ų5561.1 Ų61.139%0.38537%0.367SS..  trans-63.9160.1171.565.20000111.2H101 L105 Q106 H107H101-S103 PolarHBondContact O-N 3.23Å; S103-L105 PolarHBondContact O-N 3.43Å; S103-Q106 WeakPolarHBondContact O-CB 2.91Å; S103-Q106 PolarHBondContact O-N 3.42Å; S103-Q106 WeakPolarHBondContact OG-CB 3.5Å; S103-Q106 VanDerWaalsContact OG-CD 3.25Å; S103-Q106 VanDerWaalsContact OG-CG 3.27Å; S103-Q106 WeakPolarHBondContact OG-CG 3.29Å; S103-Q106 PolarHBondContact OG-N 3.46Å; S103-Q106 PolarHBondContact OG-OE1 2.93Å; S103-H107 PolarHBondContact O-N 3.5Å
104V84.8Confident87.5Confident56 Ų5658.1 Ų58.134%0.33934%0.336SS..Hα-helixtrans-52.6-40.8177.41770000111.9A108 F188V104-A108 WeakPolarHBondContact O-CB 3.47Å; V104-A108 PolarHBondContact O-N 3.32Å; V104-F188 HydrophobicContact CG1-CB 3.96Å; V104-F188 HydrophobicContact CG1-CD1 3.76Å; V104-F188 HydrophobicContact CG1-CG 4.13Å
105L83.7Confident87.5Confident83 Ų8352 Ų5244%0.43530%0.304SS..Hα-helixtrans-71.1-36.6177.7-68.4178.7000112.6S103 A108 L109 F185S103-L105 PolarHBondContact O-N 3.43Å; L105-A108 WeakPolarHBondContact O-CB 3.35Å; L105-A108 PolarHBondContact O-N 3.3Å; L105-L109 WeakPolarHBondContact O-CG 3.3Å; L105-L109 PolarHBondContact O-N 2.99Å; L105-F185 HydrophobicContact CD2-CE2 4.36Å
106Q89.3Confident87.7Confident31 Ų3152.8 Ų52.815%0.14530%0.301CS..Hα-helixtrans-66.9-41.4175.2-75163.5-37.500111.5I91 C95 L102 S103 A108 L109 A110I91-Q106 HydrophobicContact CG2-CB 3.83Å; I91-Q106 HydrophobicContact CG2-CG 4.1Å; C95-Q106 VanDerWaalsContact CB-NE2 3.26Å; C95-Q106 PolarHBondContact SG-NE2 2.99Å; L102-Q106 HydrophobicContact CB-CB 4.2Å; L102-Q106 HydrophobicContact CD2-CB 4Å; S103-Q106 WeakPolarHBondContact O-CB 2.91Å; S103-Q106 PolarHBondContact O-N 3.42Å; S103-Q106 WeakPolarHBondContact OG-CB 3.5Å; S103-Q106 VanDerWaalsContact OG-CD 3.25Å; S103-Q106 VanDerWaalsContact OG-CG 3.27Å; S103-Q106 WeakPolarHBondContact OG-CG 3.29Å; S103-Q106 PolarHBondContact OG-N 3.46Å; S103-Q106 PolarHBondContact OG-OE1 2.93Å; Q106-A108 VanDerWaalsContact C-N 3.3Å; Q106-A108 PolarHBondContact O-N 2.89Å; Q106-L109 PolarHBondContact O-N 3.24Å; Q106-A110 PolarHBondContact O-N 2.9Å
107H88.6Confident87.9Confident65 Ų6555.7 Ų55.730%0.30129%0.289SS..Hα-helixtrans-61.2-39.4170.1-80.1-62000111.9E88 L102 S103 A110 G111E88-H107 IonicContact OE1-CE1 3.88Å; E88-H107 PolarHBondContact OE1-CE1 3.02Å; E88-H107 IonicContact OE1-ND1 2.8Å; E88-H107 PolarHBondContact OE1-ND1 3.37Å; E88-H107 VanDerWaalsContact OE1-ND1 3.08Å; L102-H107 WeakPolarHBondContact CB-NE2 3.5Å; L102-H107 PolarHBondContact O-CD2 3.06Å; L102-H107 VanDerWaalsContact O-CD2 3.24Å; L102-H107 PolarHBondContact O-NE2 3.3Å; S103-H107 PolarHBondContact O-N 3.5Å; H107-A110 PolarHBondContact O-N 3.31Å; H107-G111 PolarHBondContact O-N 2.99Å
108A88.3Confident88.2Confident0 Ų053.3 Ų53.30%028%0.275CS..Hα-helixtrans-63.2-41.6175.400000112.1V104 L105 Q106 G111 S112 F188V104-A108 WeakPolarHBondContact O-CB 3.47Å; V104-A108 PolarHBondContact O-N 3.32Å; L105-A108 WeakPolarHBondContact O-CB 3.35Å; L105-A108 PolarHBondContact O-N 3.3Å; Q106-A108 VanDerWaalsContact C-N 3.3Å; Q106-A108 PolarHBondContact O-N 2.89Å; A108-G111 CarbonylContact O-C 3.59Å; A108-G111 WeakPolarHBondContact O-CA 3.47Å; A108-G111 PolarHBondContact O-N 3.34Å; A108-S112 PolarHBondContact O-N 3.12Å; A108-S112 PolarHBondContact O-OG 3.3Å; A108-F188 HydrophobicContact CB-CB 3.93Å; A108-F188 HydrophobicContact CB-CD2 3.66Å; A108-F188 HydrophobicContact CB-CG 4.11Å
109L89.4Confident88.7Confident79 Ų7947.8 Ų47.841%0.41425%0.245SC..Hα-helixtrans-64.5-42.2175-71.5172.9000112.1I91 L105 Q106 G111 S112 I113I91-L109 HydrophobicContact CD1-CB 4.18Å; I91-L109 HydrophobicContact CG1-CB 4.48Å; L105-L109 WeakPolarHBondContact O-CG 3.3Å; L105-L109 PolarHBondContact O-N 2.99Å; Q106-L109 PolarHBondContact O-N 3.24Å; L109-G111 VanDerWaalsContact C-N 3.28Å; L109-G111 PolarHBondContact O-N 3.12Å; L109-S112 WeakPolarHBondContact O-CB 3.16Å; L109-S112 PolarHBondContact O-N 3.41Å; L109-S112 VanDerWaalsContact O-N 3.17Å; L109-I113 WeakPolarHBondContact O-CG1 3.35Å; L109-I113 PolarHBondContact O-N 3.27Å
110A91.8Very high89.4Confident0 Ų046.9 Ų46.90%024%0.244CC..Hα-helixtrans-60.6-41.4172.600000111S87 E88 I91 Q106 H107 I113 A114S87-A110 VanDerWaalsContact CB-O 3.25Å; S87-A110 WeakPolarHBondContact CB-O 3.42Å; E88-A110 HydrophobicContact CB-CB 4.4Å; E88-A110 HydrophobicContact CG-CB 3.8Å; I91-A110 HydrophobicContact CB-CB 4.47Å; I91-A110 HydrophobicContact CG1-CB 3.99Å; Q106-A110 PolarHBondContact O-N 2.9Å; H107-A110 PolarHBondContact O-N 3.31Å; A110-I113 PolarHBondContact O-N 3.02Å; A110-A114 PolarHBondContact O-N 2.91Å
111G90.9Very high90Very high7 Ų744.3 Ų44.37%0.07222%0.224CC..Hα-helixtrans-58.6-43.7171.600000112.6H107 A108 L109 I113 A114 A115H107-G111 PolarHBondContact O-N 2.99Å; A108-G111 CarbonylContact O-C 3.59Å; A108-G111 WeakPolarHBondContact O-CA 3.47Å; A108-G111 PolarHBondContact O-N 3.34Å; L109-G111 VanDerWaalsContact C-N 3.28Å; L109-G111 PolarHBondContact O-N 3.12Å; G111-I113 VanDerWaalsContact C-N 3.32Å; G111-I113 PolarHBondContact O-N 3.3Å; G111-A114 PolarHBondContact O-N 3.41Å; G111-A115 WeakPolarHBondContact O-CB 3.25Å; G111-A115 PolarHBondContact O-N 3.48Å
112S90.2Very high90.5Very high15 Ų1538 Ų3811%0.10520%0.195CC..Hα-helixtrans-62.1-35.8175.3-63.40000113.2A108 L109 F116 M181A108-S112 PolarHBondContact O-N 3.12Å; A108-S112 PolarHBondContact O-OG 3.3Å; L109-S112 WeakPolarHBondContact O-CB 3.16Å; L109-S112 PolarHBondContact O-N 3.41Å; L109-S112 VanDerWaalsContact O-N 3.17Å; S112-F116 PolarHBondContact O-N 3.41Å; S112-M181 VanDerWaalsContact CB-O 3.24Å; S112-M181 WeakPolarHBondContact CB-O 3.32Å; S112-M181 PolarHBondContact OG-O 2.89Å
113I91.7Very high91Very high54 Ų5437.3 Ų37.328%0.27719%0.192SC..Hα-helixtrans-71.2-44.4174.3-64.5172000110.5S87 L90 I91 L109 A110 G111 A115 F116S87-I113 WeakPolarHBondContact OG-CG2 3.44Å; L90-I113 HydrophobicContact CD2-CD1 4.18Å; I91-I113 HydrophobicContact CD1-CD1 3.68Å; I91-I113 HydrophobicContact CG1-CD1 4.07Å; L109-I113 WeakPolarHBondContact O-CG1 3.35Å; L109-I113 PolarHBondContact O-N 3.27Å; A110-I113 PolarHBondContact O-N 3.02Å; G111-I113 VanDerWaalsContact C-N 3.32Å; G111-I113 PolarHBondContact O-N 3.3Å; I113-A115 PolarHBondContact O-N 3.05Å; I113-F116 VanDerWaalsContact O-CB 3.26Å; I113-F116 WeakPolarHBondContact O-CB 3.47Å; I113-F116 PolarHBondContact O-N 3.47Å; I113-F116 VanDerWaalsContact O-N 3.16Å
114A93.1Very high91.3Very high0 Ų036.6 Ų36.60%019%0.186CC..Hα-helixtrans-61.1-35.617500000111.9L80 A83 L84 S87 A110 G111 F116 W117 S118L80-A114 HydrophobicContact CD2-CB 4.03Å; A83-A114 HydrophobicContact CB-CB 4.02Å; L84-A114 HydrophobicContact CB-CB 4.35Å; L84-A114 HydrophobicContact CD1-CB 4.27Å; S87-A114 PolarHBondContact OG-N 3.44Å; A110-A114 PolarHBondContact O-N 2.91Å; G111-A114 PolarHBondContact O-N 3.41Å; A114-F116 PolarHBondContact O-N 3.26Å; A114-W117 PolarHBondContact O-N 3.39Å; A114-S118 PolarHBondContact O-N 3.18Å; A114-S118 VanDerWaalsContact O-N 3.16Å
115A92.7Very high91.8Very high0 Ų035 Ų350%018%0.176CC..Hα-helixtrans-65.1-24.1178.100000113.5G111 I113 W117 S118 S119 E180 Y184G111-A115 WeakPolarHBondContact O-CB 3.25Å; G111-A115 PolarHBondContact O-N 3.48Å; I113-A115 PolarHBondContact O-N 3.05Å; A115-W117 VanDerWaalsContact C-N 3.34Å; A115-S118 WeakPolarHBondContact CA-OG 3.46Å; A115-S118 PolarHBondContact O-OG 3.21Å; A115-S118 VanDerWaalsContact O-OG 3.07Å; A115-S119 WeakPolarHBondContact O-CB 3.39Å; A115-S119 PolarHBondContact O-N 3.04Å; A115-S119 PolarHBondContact O-OG 3.27Å; A115-E180 HydrophobicContact CB-CB 4.07Å; A115-Y184 HydrophobicContact CB-CD2 4.03Å; A115-Y184 HydrophobicContact CB-CE2 3.93Å
116F93.2Very high92.2Very high79 Ų7931.6 Ų31.635%0.34616%0.158SC..Hα-helixtrans-60.3-46.6169.4175.5-92.7000110.7S112 I113 A114 S119 L120 F177 M181S112-F116 PolarHBondContact O-N 3.41Å; I113-F116 VanDerWaalsContact O-CB 3.26Å; I113-F116 WeakPolarHBondContact O-CB 3.47Å; I113-F116 PolarHBondContact O-N 3.47Å; I113-F116 VanDerWaalsContact O-N 3.16Å; A114-F116 PolarHBondContact O-N 3.26Å; F116-S119 WeakPolarHBondContact O-CB 3.4Å; F116-S119 PolarHBondContact O-N 3.21Å; F116-L120 HydrophobicContact CE1-CD1 4.38Å; F116-F177 AromaticContact CD2-CD1 3.9Å; F116-F177 HydrophobicContact CD2-CD1 3.9Å; F116-F177 AromaticContact CD2-CE1 3.47Å; F116-F177 HydrophobicContact CD2-CE1 3.47Å; F116-F177 VanDerWaalsContact CD2-CE1 3.47Å; F116-F177 AromaticContact CD2-CZ 3.98Å; F116-F177 HydrophobicContact CD2-CZ 3.98Å; F116-F177 HydrophobicContact CE2-CD1 4.34Å; F116-F177 AromaticContact CE2-CE1 3.65Å; F116-F177 HydrophobicContact CE2-CE1 3.65Å; F116-F177 HydrophobicContact CE2-CE2 4.31Å; F116-F177 AromaticContact CE2-CZ 3.64Å; F116-F177 HydrophobicContact CE2-CZ 3.64Å; F116-F177 HydrophobicContact CG-CE1 4.09Å; F116-F177 HydrophobicContact CZ-CE1 4.39Å; F116-F177 HydrophobicContact CZ-CZ 4.19Å; F116-F177 WeakPolarHBondContact O-CE1 3.23Å; F116-M181 HydrophobicContact CD2-SD 4.33Å
117W93.5Very high92.4Very high133 Ų13330.1 Ų30.150%0.50415%0.151SC..Hα-helixtrans-69.2-39.9179.3-60.1108.8000111.8V79 A83 A114 A115 S119 L120V79-W117 VanDerWaalsContact CG1-C 3.5Å; V79-W117 HydrophobicContact CG1-CB 3.63Å; A83-W117 HydrophobicContact CB-CB 4.17Å; A83-W117 HydrophobicContact CB-CG 4.3Å; A114-W117 PolarHBondContact O-N 3.39Å; A115-W117 VanDerWaalsContact C-N 3.34Å; W117-S119 VanDerWaalsContact C-N 3.29Å; W117-S119 PolarHBondContact O-N 3.46Å; W117-L120 HydrophobicContact CE3-CD1 3.92Å; W117-L120 HydrophobicContact CZ3-CD1 4.2Å; W117-L120 PolarHBondContact O-N 3.46Å
118S93.6Very high92.7Very high0 Ų027.4 Ų27.40%014%0.139CC..Hα-helixtrans-65.6-33.617772.80000111.9A114 A115 L120 T121 L122A114-S118 PolarHBondContact O-N 3.18Å; A114-S118 VanDerWaalsContact O-N 3.16Å; A115-S118 WeakPolarHBondContact CA-OG 3.46Å; A115-S118 PolarHBondContact O-OG 3.21Å; A115-S118 VanDerWaalsContact O-OG 3.07Å; S118-L120 PolarHBondContact O-N 3.43Å; S118-T121 PolarHBondContact O-N 3.2Å; S118-T121 VanDerWaalsContact O-N 3.08Å; S118-T121 PolarHBondContact O-OG1 3.41Å; S118-L122 WeakPolarHBondContact O-CB 3.04Å; S118-L122 VanDerWaalsContact O-CG 3.31Å; S118-L122 WeakPolarHBondContact O-CG 3.39Å; S118-L122 PolarHBondContact O-N 2.64Å
119S94.2Very high92.9Very high0 Ų028.6 Ų28.60%014%0.144CC..Hα-helixtrans-58.9-33.9177.1-66.60000113.2A115 F116 W117 T121 C123 F177 E180A115-S119 WeakPolarHBondContact O-CB 3.39Å; A115-S119 PolarHBondContact O-N 3.04Å; A115-S119 PolarHBondContact O-OG 3.27Å; F116-S119 WeakPolarHBondContact O-CB 3.4Å; F116-S119 PolarHBondContact O-N 3.21Å; W117-S119 VanDerWaalsContact C-N 3.29Å; W117-S119 PolarHBondContact O-N 3.46Å; S119-T121 VanDerWaalsContact C-N 3.32Å; S119-T121 PolarHBondContact O-N 3.2Å; S119-C123 WeakPolarHBondContact O-CB 3.19Å; S119-C123 PolarHBondContact O-N 2.91Å; S119-F177 VanDerWaalsContact CB-CE1 3.41Å; S119-E180 VanDerWaalsContact OG-CB 3.27Å; S119-E180 WeakPolarHBondContact OG-CB 3.22Å; S119-E180 VanDerWaalsContact OG-CG 3.23Å; S119-E180 WeakPolarHBondContact OG-CG 3.32Å
120L93.8Very high93.1Very high76 Ų7624.9 Ų24.940%0.39813%0.125SC..Hα-helixtrans-67.2-32.6178.2-67.5171.4000112.2F116 W117 S118 P124 L173 F177F116-L120 HydrophobicContact CE1-CD1 4.38Å; W117-L120 HydrophobicContact CE3-CD1 3.92Å; W117-L120 HydrophobicContact CZ3-CD1 4.2Å; W117-L120 PolarHBondContact O-N 3.46Å; S118-L120 PolarHBondContact O-N 3.43Å; L120-P124 WeakPolarHBondContact O-CD 3.43Å; L120-L173 HydrophobicContact CD2-CD1 4.1Å; L120-L173 HydrophobicContact CD2-CD2 4.1Å; L120-F177 HydrophobicContact CD2-CE1 4.49Å; L120-F177 HydrophobicContact CD2-CZ 3.86Å; L120-F177 HydrophobicContact CG-CE1 4.46Å; L120-F177 HydrophobicContact CG-CZ 4.29Å
121T92.8Very high93Very high46 Ų4624.9 Ų24.928%0.28213%0.125SC..Hα-helixtrans-89.3-29.3177.461.40000112.6V79 S118 S119 P124 T125V79-T121 HydrophobicContact CG2-CG2 3.69Å; S118-T121 PolarHBondContact O-N 3.2Å; S118-T121 VanDerWaalsContact O-N 3.08Å; S118-T121 PolarHBondContact O-OG1 3.41Å; S119-T121 VanDerWaalsContact C-N 3.32Å; S119-T121 PolarHBondContact O-N 3.2Å; T121-P124 WeakPolarHBondContact O-CD 3.42Å; T121-P124 WeakPolarHBondContact O-CG 3.4Å; T121-T125 PolarHBondContact O-OG1 3.01Å
122L94.1Very high93.1Very high4 Ų425.5 Ų25.52%0.02113%0.127CC..Hα-helixtrans-70.8-42.8175.5-77.2170.9000112.7A72 E76 S118 T125 E126 T176 E180A72-L122 HydrophobicContact CB-CD2 4.04Å; E76-L122 HydrophobicContact CB-CD1 4.49Å; E76-L122 HydrophobicContact CB-CD2 3.91Å; E76-L122 HydrophobicContact CB-CG 4.23Å; E76-L122 HydrophobicContact CG-CD1 4.14Å; E76-L122 HydrophobicContact CG-CD2 4.33Å; E76-L122 HydrophobicContact CG-CG 4.43Å; S118-L122 WeakPolarHBondContact O-CB 3.04Å; S118-L122 VanDerWaalsContact O-CG 3.31Å; S118-L122 WeakPolarHBondContact O-CG 3.39Å; S118-L122 PolarHBondContact O-N 2.64Å; L122-T125 PolarHBondContact O-N 3.29Å; L122-T125 PolarHBondContact O-OG1 2.76Å; L122-E126 VanDerWaalsContact O-CB 3.32Å; L122-E126 WeakPolarHBondContact O-CB 3.41Å; L122-E126 WeakPolarHBondContact O-CG 3.43Å; L122-E126 PolarHBondContact O-N 2.9Å; L122-T176 HydrophobicContact CB-CG2 4.32Å; L122-E180 HydrophobicContact CD1-CG 4.07Å
123C94.6Very high93.2Very high1 Ų124.9 Ų24.91%0.00712%0.123CC..Hα-helixtrans-50.5-53.4-177.7-178.70000114.2S119 T125 L127 F169 L173S119-C123 WeakPolarHBondContact O-CB 3.19Å; S119-C123 PolarHBondContact O-N 2.91Å; C123-T125 PolarHBondContact O-N 2.84Å; C123-L127 VanDerWaalsContact O-CB 3.28Å; C123-L127 WeakPolarHBondContact O-CB 3.34Å; C123-L127 PolarHBondContact O-N 3.36Å; C123-F169 PolarHBondContact SG-O 3.09Å; C123-L173 HydrophobicContact CB-CB 4.48Å; C123-L173 HydrophobicContact CB-CD1 3.79Å; C123-L173 VanDerWaalsContact SG-CA 3.59Å
124P93.6Very high93.1Very high40 Ų4022.3 Ų22.326%0.2611%0.109SC..Hα-helixtrans-63.1-41.7179.721.3-32.6000113.2L120 T121 L127 V128 F169L120-P124 WeakPolarHBondContact O-CD 3.43Å; T121-P124 WeakPolarHBondContact O-CD 3.42Å; T121-P124 WeakPolarHBondContact O-CG 3.4Å; P124-L127 PolarHBondContact O-N 3.31Å; P124-V128 WeakPolarHBondContact O-CG2 3.18Å; P124-V128 PolarHBondContact O-N 2.91Å; P124-F169 HydrophobicContact CB-CB 4.06Å; P124-F169 HydrophobicContact CB-CD1 4.06Å; P124-F169 HydrophobicContact CB-CG 4.36Å
125T94.3Very high92.8Very high21 Ų2122.7 Ų22.713%0.12911%0.111CC..Hα-helixtrans-71.3-41.7-176.251.90000111V71 A72 T121 L122 C123 V128 K129V71-T125 HydrophobicContact CB-CG2 4.5Å; V71-T125 HydrophobicContact CG1-CG2 3.87Å; A72-T125 VanDerWaalsContact CB-OG1 3.24Å; A72-T125 WeakPolarHBondContact CB-OG1 3.43Å; T121-T125 PolarHBondContact O-OG1 3.01Å; L122-T125 PolarHBondContact O-N 3.29Å; L122-T125 PolarHBondContact O-OG1 2.76Å; C123-T125 PolarHBondContact O-N 2.84Å; T125-V128 PolarHBondContact O-N 3.13Å; T125-K129 VanDerWaalsContact O-CB 3.32Å; T125-K129 WeakPolarHBondContact O-CB 3.4Å; T125-K129 PolarHBondContact O-N 2.96Å
126E93.6Very high92.5Very high13 Ų1323.3 Ų23.36%0.06111%0.114CC..Hα-helixtrans-67.2-35.6174.1-71.5-159120.900113.4L122 K129 C130 R179 K235L122-E126 VanDerWaalsContact O-CB 3.32Å; L122-E126 WeakPolarHBondContact O-CB 3.41Å; L122-E126 WeakPolarHBondContact O-CG 3.43Å; L122-E126 PolarHBondContact O-N 2.9Å; E126-K129 WeakPolarHBondContact O-CB 3.22Å; E126-K129 PolarHBondContact O-N 3.23Å; E126-C130 WeakPolarHBondContact O-CB 3.14Å; E126-C130 PolarHBondContact O-N 2.82Å; E126-C130 PolarHBondContact O-SG 3.43Å; E126-R179 IonicContact OE1-CZ 3.67Å; E126-R179 IonicContact OE1-NH1 3.75Å; E126-R179 PolarHBondContact OE1-NH1 2.88Å; E126-R179 IonicContact OE1-NH2 3.24Å; E126-R179 PolarHBondContact OE1-NH2 3.05Å; E126-R179 IonicContact OE2-CZ 3.7Å; E126-R179 IonicContact OE2-NH1 2.97Å; E126-R179 IonicContact OE2-NH2 2.93Å; E126-R179 PolarHBondContact OE2-NH2 3.09Å; E126-K235 IonicContact OE1-NZ 3.86Å; E126-K235 PolarHBondContact OE1-NZ 2.9Å; E126-K235 WeakPolarHBondContact OE2-CD 3.49Å; E126-K235 IonicContact OE2-NZ 2.87Å; E126-K235 PolarHBondContact OE2-NZ 3.28Å
127L93.6Very high92.2Very high0 Ų019.6 Ų19.60%010%0.098CC..Hα-helixtrans-59.1-48.9174.1171.567.7000110.6C123 P124 K131 I160 G168 F169 Q239C123-L127 VanDerWaalsContact O-CB 3.28Å; C123-L127 WeakPolarHBondContact O-CB 3.34Å; C123-L127 PolarHBondContact O-N 3.36Å; P124-L127 PolarHBondContact O-N 3.31Å; L127-K131 WeakPolarHBondContact O-CG 3.31Å; L127-K131 PolarHBondContact O-N 3.39Å; L127-I160 HydrophobicContact CD2-CD1 3.96Å; L127-I160 HydrophobicContact CD2-CG2 4.48Å; L127-I160 HydrophobicContact CG-CD1 4.12Å; L127-G168 WeakPolarHBondContact CD2-O 3.32Å; L127-F169 HydrophobicContact CD2-CD1 4.28Å; L127-Q239 HydrophobicContact CB-CG 4.26Å; L127-Q239 HydrophobicContact CD1-CB 3.61Å; L127-Q239 HydrophobicContact CD1-CG 3.76Å; L127-Q239 VanDerWaalsContact CD1-O 3.24Å; L127-Q239 WeakPolarHBondContact CD1-O 3.46Å
128V93Very high91.8Very high8 Ų813.4 Ų13.45%0.0487%0.074CC..Hα-helixtrans-63.7-45.5177.9175.50000110.3P68 P124 T125 K131 V132 P153 V156 T157 I160 F169P68-V128 HydrophobicContact CB-CB 4.4Å; P68-V128 HydrophobicContact CB-CG1 4.21Å; P68-V128 HydrophobicContact CG-CG1 4.3Å; P124-V128 WeakPolarHBondContact O-CG2 3.18Å; P124-V128 PolarHBondContact O-N 2.91Å; T125-V128 PolarHBondContact O-N 3.13Å; V128-K131 PolarHBondContact O-N 2.86Å; V128-V132 HydrophobicContact CG1-CG2 4.29Å; V128-V132 VanDerWaalsContact O-CG2 3.28Å; V128-V132 WeakPolarHBondContact O-CG2 3.44Å; V128-V132 PolarHBondContact O-N 2.93Å; V128-P153 HydrophobicContact CG1-CB 4.16Å; V128-V156 HydrophobicContact CG1-CB 4.38Å; V128-V156 HydrophobicContact CG1-CG1 4.26Å; V128-T157 WeakPolarHBondContact CG2-OG1 3.47Å; V128-I160 HydrophobicContact CG2-CD1 4.03Å; V128-F169 HydrophobicContact CG2-CE1 4.36Å
129K94.3Very high91.3Very high24 Ų2415.2 Ų15.210%0.1049%0.085CC..Hα-helixtrans-55.1-55176.9176.3-172.2168.6175.40112.2D29 P68 S69 T125 E126 K131 V132 Q133D29-K129 IonicContact OD1-NZ 2.86Å; D29-K129 WeakPolarHBondContact OD2-CE 3.49Å; D29-K129 IonicContact OD2-NZ 3.75Å; D29-K129 PolarHBondContact OD2-NZ 2.61Å; P68-K129 HydrophobicContact CB-CB 3.98Å; P68-K129 HydrophobicContact CG-CB 3.89Å; S69-K129 WeakPolarHBondContact OG-CD 3.28Å; S69-K129 WeakPolarHBondContact OG-CE 3.3Å; S69-K129 PolarHBondContact OG-NZ 3.04Å; T125-K129 VanDerWaalsContact O-CB 3.32Å; T125-K129 WeakPolarHBondContact O-CB 3.4Å; T125-K129 PolarHBondContact O-N 2.96Å; E126-K129 WeakPolarHBondContact O-CB 3.22Å; E126-K129 PolarHBondContact O-N 3.23Å; K129-K131 VanDerWaalsContact C-N 3.27Å; K129-K131 PolarHBondContact O-N 3.24Å; K129-V132 PolarHBondContact O-N 3.04Å; K129-V132 VanDerWaalsContact O-N 3.13Å; K129-Q133 WeakPolarHBondContact O-CG 3.48Å; K129-Q133 PolarHBondContact O-N 3.19Å
130C92.7Very high90.8Very high2 Ų219.9 Ų19.91%0.01411%0.107CC..Hα-helixtrans-60.5-39.8-176.5-69.80000111.2V33 E126 Q133 S134 Q239 I240V33-C130 HydrophobicContact CG1-CB 4.09Å; E126-C130 WeakPolarHBondContact O-CB 3.14Å; E126-C130 PolarHBondContact O-N 2.82Å; E126-C130 PolarHBondContact O-SG 3.43Å; C130-Q133 PolarHBondContact O-N 3.39Å; C130-S134 WeakPolarHBondContact O-CB 3.5Å; C130-S134 PolarHBondContact O-N 3.27Å; C130-S134 VanDerWaalsContact O-N 3.09Å; C130-S134 PolarHBondContact O-OG 2.9Å; C130-Q239 HydrophobicContact CB-CB 4.32Å; C130-Q239 PolarHBondContact SG-OE1 2.87Å; C130-I240 HydrophobicContact CB-CD1 4.14Å; C130-I240 HydrophobicContact CB-CG1 4.24Å
131K90.4Very high90.2Very high0 Ų020.3 Ų20.30%011%0.109CC..Hα-helixtrans-65.2-43.6174.8-76.5-173-179.6-165.90113.4L127 V128 K129 Q133 S134 M135 M138 V156 I160 H243L127-K131 WeakPolarHBondContact O-CG 3.31Å; L127-K131 PolarHBondContact O-N 3.39Å; V128-K131 PolarHBondContact O-N 2.86Å; K129-K131 VanDerWaalsContact C-N 3.27Å; K129-K131 PolarHBondContact O-N 3.24Å; K131-Q133 VanDerWaalsContact C-N 3.31Å; K131-Q133 PolarHBondContact O-N 2.99Å; K131-S134 WeakPolarHBondContact CA-OG 3.41Å; K131-S134 PolarHBondContact O-N 3.47Å; K131-S134 PolarHBondContact O-OG 3.13Å; K131-M135 WeakPolarHBondContact O-CA 3.49Å; K131-M135 WeakPolarHBondContact O-CB 3.32Å; K131-M135 PolarHBondContact O-N 3.48Å; K131-M138 HydrophobicContact CB-CE 4.12Å; K131-M138 HydrophobicContact CG-CE 4.35Å; K131-M138 WeakPolarHBondContact O-CE 3.36Å; K131-V156 HydrophobicContact CB-CG1 3.82Å; K131-V156 HydrophobicContact CD-CG1 3.63Å; K131-V156 HydrophobicContact CG-CG1 4.45Å; K131-I160 HydrophobicContact CD-CD1 4.11Å; K131-I160 HydrophobicContact CD-CG1 4.49Å; K131-H243 VanDerWaalsContact CE-CD2 3.47Å; K131-H243 WeakPolarHBondContact CE-CD2 3.45Å; K131-H243 PolarHBondContact NZ-CD2 2.91Å; K131-H243 PolarHBondContact NZ-ND1 3.21Å
132V91.6Very high89.4Confident19 Ų1920.6 Ų20.612%0.11512%0.121CC..Hα-helixtrans-63-41.7177.3174.30000110.3A64 V128 K129 S134 P153 V156A64-V132 HydrophobicContact CB-CG1 4.22Å; V128-V132 HydrophobicContact CG1-CG2 4.29Å; V128-V132 VanDerWaalsContact O-CG2 3.28Å; V128-V132 WeakPolarHBondContact O-CG2 3.44Å; V128-V132 PolarHBondContact O-N 2.93Å; K129-V132 PolarHBondContact O-N 3.04Å; K129-V132 VanDerWaalsContact O-N 3.13Å; V132-S134 VanDerWaalsContact C-N 3.29Å; V132-S134 PolarHBondContact O-N 2.78Å; V132-P153 HydrophobicContact CG2-CB 4.26Å; V132-P153 HydrophobicContact CG2-CG 4.25Å; V132-V156 HydrophobicContact CG2-CB 4.28Å; V132-V156 HydrophobicContact CG2-CG2 3.8Å
133Q92.3Very high88.4Confident2 Ų225.1 Ų25.11%0.00914%0.142CC..Hα-helixtrans-65.1-28.7177.8-75.7173.3-39.500113.9Q26 D29 T30 V33 K34 A64 K129 C130 K131Q26-Q133 VanDerWaalsContact NE2-NE2 3.14Å; D29-Q133 PolarHBondContact OD2-NE2 3.01Å; T30-Q133 HydrophobicContact CG2-CB 4.18Å; T30-Q133 HydrophobicContact CG2-CG 4.11Å; T30-Q133 PolarHBondContact OG1-NE2 2.9Å; T30-Q133 VanDerWaalsContact OG1-NE2 3.13Å; V33-Q133 HydrophobicContact CG1-CB 4.33Å; K34-Q133 WeakPolarHBondContact CE-O 3.26Å; A64-Q133 HydrophobicContact CB-CG 4.4Å; A64-Q133 WeakPolarHBondContact O-CG 3.38Å; K129-Q133 WeakPolarHBondContact O-CG 3.48Å; K129-Q133 PolarHBondContact O-N 3.19Å; C130-Q133 PolarHBondContact O-N 3.39Å; K131-Q133 VanDerWaalsContact C-N 3.31Å; K131-Q133 PolarHBondContact O-N 2.99Å
134S89.8Confident87.4Confident0 Ų025.3 Ų25.30%014%0.143CC..THydrogen-bonded Turntrans-106.24.5-174.653.50000114.3F38 C130 K131 V132 R136 E137 M138 I240F38-S134 VanDerWaalsContact CE2-CB 3.44Å; C130-S134 WeakPolarHBondContact O-CB 3.5Å; C130-S134 PolarHBondContact O-N 3.27Å; C130-S134 VanDerWaalsContact O-N 3.09Å; C130-S134 PolarHBondContact O-OG 2.9Å; K131-S134 WeakPolarHBondContact CA-OG 3.41Å; K131-S134 PolarHBondContact O-N 3.47Å; K131-S134 PolarHBondContact O-OG 3.13Å; V132-S134 VanDerWaalsContact C-N 3.29Å; V132-S134 PolarHBondContact O-N 2.78Å; S134-R136 VanDerWaalsContact C-N 3.34Å; S134-R136 PolarHBondContact O-N 3.34Å; S134-E137 PolarHBondContact O-N 2.68Å; S134-M138 WeakPolarHBondContact O-CG 3.1Å; S134-M138 PolarHBondContact O-N 2.91Å; S134-M138 WeakPolarHBondContact OG-CE 3.28Å; S134-I240 VanDerWaalsContact OG-CD1 3.24Å; S134-I240 WeakPolarHBondContact OG-CD1 3.29Å; S134-I240 WeakPolarHBondContact OG-CG1 3.35Å
135M87Confident86.2Confident8 Ų831.3 Ų31.34%0.03917%0.165CC..Hα-helixtrans-60.9-40.8-165.9-170.1176.6-62.500113.9K131 M138 T139 V148 L151 V156K131-M135 WeakPolarHBondContact O-CA 3.49Å; K131-M135 WeakPolarHBondContact O-CB 3.32Å; K131-M135 PolarHBondContact O-N 3.48Å; M135-M138 HydrophobicContact CB-CE 4.33Å; M135-M138 PolarHBondContact O-N 2.84Å; M135-T139 PolarHBondContact O-N 3.29Å; M135-T139 PolarHBondContact O-OG1 2.73Å; M135-V148 HydrophobicContact CG-CG1 4.4Å; M135-V148 HydrophobicContact SD-CG1 4.43Å; M135-L151 HydrophobicContact CE-CB 3.75Å; M135-L151 HydrophobicContact CE-CD2 3.76Å; M135-L151 HydrophobicContact CE-CG 4.29Å; M135-L151 HydrophobicContact SD-CB 3.32Å; M135-L151 WeakPolarHBondContact SD-CB 3.46Å; M135-L151 HydrophobicContact SD-CD2 3.58Å; M135-L151 VanDerWaalsContact SD-CD2 3.58Å; M135-L151 HydrophobicContact SD-CG 4.09Å; M135-V156 HydrophobicContact CE-CG2 3.26Å
136R85.9Confident85.1Confident14 Ų1431.5 Ų31.55%0.05317%0.166CC..Hα-helixtrans-60.2-54.2176.1179.1-162.754.5-153.111.9110.1V51 D56 S134 M138 T139 E140 V148V51-R136 PolarHBondContact O-NH1 3.29Å; D56-R136 WeakPolarHBondContact OD1-CD 3.41Å; D56-R136 IonicContact OD1-CZ 3.25Å; D56-R136 IonicContact OD1-NE 2.83Å; D56-R136 IonicContact OD1-NH1 3.17Å; D56-R136 PolarHBondContact OD1-NH1 3.32Å; D56-R136 IonicContact OD2-CZ 3.87Å; D56-R136 VanDerWaalsContact OD2-CZ 3.24Å; D56-R136 IonicContact OD2-NE 3.36Å; D56-R136 IonicContact OD2-NH1 2.82Å; D56-R136 PolarHBondContact OD2-NH1 3.04Å; D56-R136 IonicContact OD2-NH2 3.38Å; S134-R136 VanDerWaalsContact C-N 3.34Å; S134-R136 PolarHBondContact O-N 3.34Å; R136-M138 VanDerWaalsContact C-N 3.26Å; R136-M138 PolarHBondContact O-N 3.09Å; R136-T139 CarbonylContact O-C 3.55Å; R136-T139 WeakPolarHBondContact O-CA 3.38Å; R136-T139 WeakPolarHBondContact O-CB 3.49Å; R136-T139 PolarHBondContact O-N 3.14Å; R136-E140 HydrophobicContact CG-CG 4.12Å; R136-E140 PolarHBondContact O-N 3.36Å; R136-V148 HydrophobicContact CB-CG1 4.5Å
137E87.5Confident84Confident1 Ų134.9 Ų34.91%0.00519%0.185CC..Hα-helixtrans-58.9-39.6-178.2-71.777.1-171.300111.7K34 F38 H42 S134 T139 E140 L141K34-E137 WeakPolarHBondContact CD-OE1 2.76Å; K34-E137 WeakPolarHBondContact CE-OE1 3.06Å; K34-E137 WeakPolarHBondContact CE-OE2 3.16Å; K34-E137 IonicContact NZ-OE1 2.95Å; K34-E137 PolarHBondContact NZ-OE1 2.84Å; K34-E137 IonicContact NZ-OE2 2.63Å; K34-E137 PolarHBondContact NZ-OE2 3.37Å; F38-E137 HydrophobicContact CD1-CB 4.06Å; F38-E137 HydrophobicContact CD2-CB 3.48Å; F38-E137 VanDerWaalsContact CD2-CB 3.48Å; F38-E137 HydrophobicContact CD2-CG 3.67Å; F38-E137 HydrophobicContact CE1-CB 3.89Å; F38-E137 HydrophobicContact CE2-CB 3.3Å; F38-E137 HydrophobicContact CE2-CG 3.92Å; F38-E137 HydrophobicContact CG-CB 3.84Å; F38-E137 HydrophobicContact CG-CG 4.14Å; F38-E137 HydrophobicContact CZ-CB 3.51Å; H42-E137 IonicContact CD2-OE1 3.22Å; H42-E137 IonicContact CE1-OE1 2.74Å; H42-E137 IonicContact NE2-OE1 3.5Å; H42-E137 PolarHBondContact NE2-OE1 3.27Å; S134-E137 PolarHBondContact O-N 2.68Å; E137-T139 VanDerWaalsContact C-N 3.26Å; E137-T139 PolarHBondContact O-N 2.72Å; E137-E140 PolarHBondContact O-N 2.88Å; E137-L141 WeakPolarHBondContact O-CB 3.45Å; E137-L141 WeakPolarHBondContact O-CG 3.48Å; E137-L141 PolarHBondContact O-N 3.34Å
138M84.5Confident82.9Confident2 Ų237.3 Ų37.31%0.0120%0.2CC..Hα-helixtrans-62.6-33.2173.4-67-170.9-72.900112.7F38 K131 S134 M135 R136 G142 H143 I144 I240F38-M138 HydrophobicContact CE1-CG 4.4Å; F38-M138 HydrophobicContact CZ-CG 3.81Å; K131-M138 HydrophobicContact CB-CE 4.12Å; K131-M138 HydrophobicContact CG-CE 4.35Å; K131-M138 WeakPolarHBondContact O-CE 3.36Å; S134-M138 WeakPolarHBondContact O-CG 3.1Å; S134-M138 PolarHBondContact O-N 2.91Å; S134-M138 WeakPolarHBondContact OG-CE 3.28Å; M135-M138 HydrophobicContact CB-CE 4.33Å; M135-M138 PolarHBondContact O-N 2.84Å; R136-M138 VanDerWaalsContact C-N 3.26Å; R136-M138 PolarHBondContact O-N 3.09Å; M138-G142 PolarHBondContact O-N 3.27Å; M138-H143 HydrophobicContact CB-CB 4.38Å; M138-H143 WeakPolarHBondContact O-CA 3.48Å; M138-H143 WeakPolarHBondContact O-CB 3.5Å; M138-H143 PolarHBondContact O-N 3.06Å; M138-I144 HydrophobicContact CB-CB 4.36Å; M138-I144 HydrophobicContact CB-CD1 3.59Å; M138-I144 HydrophobicContact CB-CG1 4.05Å; M138-I144 HydrophobicContact CE-CD1 3.53Å; M138-I144 HydrophobicContact CG-CD1 4.13Å; M138-I144 PolarHBondContact O-N 3.24Å; M138-I144 VanDerWaalsContact O-N 3.14Å; M138-I144 HydrophobicContact SD-CD1 3.45Å; M138-I144 WeakPolarHBondContact SD-CD1 3.39Å; M138-I240 HydrophobicContact CG-CG2 3.75Å; M138-I240 HydrophobicContact SD-CB 4.45Å; M138-I240 HydrophobicContact SD-CG2 3.51Å; M138-I240 VanDerWaalsContact SD-CG2 3.51Å
139T83.9Confident81.6Confident38 Ų3844 Ų4423%0.23323%0.228CC..Hα-helixtrans-76.3-43.7177.6-530000111.4M135 R136 E137 L141 G142 I144 V148M135-T139 PolarHBondContact O-N 3.29Å; M135-T139 PolarHBondContact O-OG1 2.73Å; R136-T139 CarbonylContact O-C 3.55Å; R136-T139 WeakPolarHBondContact O-CA 3.38Å; R136-T139 WeakPolarHBondContact O-CB 3.49Å; R136-T139 PolarHBondContact O-N 3.14Å; E137-T139 VanDerWaalsContact C-N 3.26Å; E137-T139 PolarHBondContact O-N 2.72Å; T139-L141 VanDerWaalsContact C-N 3.34Å; T139-L141 PolarHBondContact O-N 3.15Å; T139-G142 PolarHBondContact O-N 2.8Å; T139-G142 VanDerWaalsContact O-N 3.07Å; T139-I144 WeakPolarHBondContact CA-O 3.4Å; T139-V148 HydrophobicContact CG2-CG2 4.01Å; T139-V148 WeakPolarHBondContact OG1-CG2 3.18Å
140E83.4Confident80.2Confident99 Ų9948.7 Ų48.746%0.46325%0.254SS..Hα-helixtrans-63.9-37177.7-71.2-174.8165.800112.3K55 R136 E137 G142K55-E140 VanDerWaalsContact NZ-CD 3.3Å; K55-E140 IonicContact NZ-OE1 3.66Å; K55-E140 PolarHBondContact NZ-OE1 3.19Å; K55-E140 IonicContact NZ-OE2 2.68Å; K55-E140 PolarHBondContact NZ-OE2 3.03Å; R136-E140 HydrophobicContact CG-CG 4.12Å; R136-E140 PolarHBondContact O-N 3.36Å; E137-E140 PolarHBondContact O-N 2.88Å; E140-G142 PolarHBondContact O-N 2.66Å
141L82.5Confident79.2Confident85 Ų8550.5 Ų50.545%0.44526%0.263SS..THydrogen-bonded Turntrans-80.41.4175.2-66.6173.6000113.4F38 V41 E137 T139 H143F38-L141 HydrophobicContact CD1-CD1 3.37Å; F38-L141 HydrophobicContact CE1-CD1 3.69Å; F38-L141 HydrophobicContact CG-CD1 4.42Å; V41-L141 HydrophobicContact CG2-CD1 4.35Å; V41-L141 HydrophobicContact CG2-CD2 4.29Å; E137-L141 WeakPolarHBondContact O-CB 3.45Å; E137-L141 WeakPolarHBondContact O-CG 3.48Å; E137-L141 PolarHBondContact O-N 3.34Å; T139-L141 VanDerWaalsContact C-N 3.34Å; T139-L141 PolarHBondContact O-N 3.15Å; L141-H143 VanDerWaalsContact C-N 3.25Å; L141-H143 PolarHBondContact O-N 3.27Å
142G75.4Confident78.9Confident52 Ų5252 Ų5254%0.53628%0.28SS..THydrogen-bonded Turntrans72.611.5177.600000115.1M138 T139 E140 I144M138-G142 PolarHBondContact O-N 3.27Å; T139-G142 PolarHBondContact O-N 2.8Å; T139-G142 VanDerWaalsContact O-N 3.07Å; E140-G142 PolarHBondContact O-N 2.66Å; G142-I144 PolarHBondContact O-N 3.02Å
143H73.5Confident78.7Confident98 Ų9852.9 Ų52.945%0.45429%0.285SS..SBendtrans-70.3-25.6173.9-63.3-178.8000111.8M138 L141 T244M138-H143 HydrophobicContact CB-CB 4.38Å; M138-H143 WeakPolarHBondContact O-CA 3.48Å; M138-H143 WeakPolarHBondContact O-CB 3.5Å; M138-H143 PolarHBondContact O-N 3.06Å; L141-H143 VanDerWaalsContact C-N 3.25Å; L141-H143 PolarHBondContact O-N 3.27Å; H143-T244 WeakPolarHBondContact O-CG2 3.47Å
144I73.2Confident78.7Confident5 Ų562.2 Ų62.23%0.02632%0.321CS..  trans-135.5133-177.3-67.6175.5000108.3M138 T139 G142 V146 V245M138-I144 HydrophobicContact CB-CB 4.36Å; M138-I144 HydrophobicContact CB-CD1 3.59Å; M138-I144 HydrophobicContact CB-CG1 4.05Å; M138-I144 HydrophobicContact CE-CD1 3.53Å; M138-I144 HydrophobicContact CG-CD1 4.13Å; M138-I144 PolarHBondContact O-N 3.24Å; M138-I144 VanDerWaalsContact O-N 3.14Å; M138-I144 HydrophobicContact SD-CD1 3.45Å; M138-I144 WeakPolarHBondContact SD-CD1 3.39Å; T139-I144 WeakPolarHBondContact CA-O 3.4Å; G142-I144 PolarHBondContact O-N 3.02Å; I144-V146 HydrophobicContact CG2-CB 3.69Å; I144-V146 HydrophobicContact CG2-CG2 3.43Å; I144-V146 VanDerWaalsContact CG2-CG2 3.43Å; I144-V245 HydrophobicContact CD1-CB 3.65Å; I144-V245 HydrophobicContact CD1-CG2 3.56Å; I144-V245 HydrophobicContact CG1-CB 3.95Å; I144-V245 HydrophobicContact CG1-CG2 4.33Å; I144-V245 HydrophobicContact CG2-CB 3.97Å; I144-V245 WeakPolarHBondContact CG2-O 2.95Å
145K68.5Low78.6Confident167 Ų16763.8 Ų63.873%0.72633%0.334SS*.  trans-107.775173.2-68.2-173.5-179.5-177.30109.6
146V70Confident78.7Confident24 Ų2463.4 Ų63.415%0.14533%0.332CS..SBendtrans-138.1144.4-177.3-176.20000110.3I144 V148 L151 V245I144-V146 HydrophobicContact CG2-CB 3.69Å; I144-V146 HydrophobicContact CG2-CG2 3.43Å; I144-V146 VanDerWaalsContact CG2-CG2 3.43Å; V146-V148 PolarHBondContact O-N 3.07Å; V146-V148 VanDerWaalsContact O-N 3.08Å; V146-L151 HydrophobicContact CB-CD2 4.25Å; V146-L151 HydrophobicContact CG1-CD1 3.26Å; V146-L151 HydrophobicContact CG1-CD2 3.54Å; V146-L151 HydrophobicContact CG1-CG 3.94Å; V146-V245 HydrophobicContact CG2-CG1 4.23Å; V146-V245 WeakPolarHBondContact CG2-O 3.41Å
147D70.2Confident78.9Confident84 Ų8464.7 Ų64.745%0.44934%0.341SS..  trans-68.8104.8169.2-174-0.3000109.8K149 N150D147-K149 PolarHBondContact O-N 3.28Å; D147-K149 VanDerWaalsContact OD1-CB 3.29Å; D147-K149 WeakPolarHBondContact OD1-CB 3.12Å; D147-K149 WeakPolarHBondContact OD1-CG 3.36Å; D147-K149 PolarHBondContact OD1-N 3.18Å; D147-N150 PolarHBondContact O-N 3.18Å; D147-N150 VanDerWaalsContact O-N 3.1Å; D147-N150 PolarHBondContact OD2-ND2 3.04Å
148V70.7Confident79.1Confident52 Ų5269.9 Ų69.932%0.31536%0.364SS..G310 helixtrans-53.5-25.6177.7-170.50000111.2M135 R136 T139 V146 N150M135-V148 HydrophobicContact CG-CG1 4.4Å; M135-V148 HydrophobicContact SD-CG1 4.43Å; R136-V148 HydrophobicContact CB-CG1 4.5Å; T139-V148 HydrophobicContact CG2-CG2 4.01Å; T139-V148 WeakPolarHBondContact OG1-CG2 3.18Å; V146-V148 PolarHBondContact O-N 3.07Å; V146-V148 VanDerWaalsContact O-N 3.08Å; V148-N150 VanDerWaalsContact C-N 3.28Å; V148-N150 PolarHBondContact O-N 2.89Å
149K66.9Low79.1Confident147 Ų14770.9 Ų70.964%0.63937%0.371SS*.G310 helixtrans-69.8-23-177.9-65.1-179.7178.7177.70114.2R60 D147R60-K149 VanDerWaalsContact NH1-CA 3.31Å; R60-K149 PolarHBondContact NH1-O 2.92Å; R60-K149 PolarHBondContact NH2-O 3.2Å; D147-K149 PolarHBondContact O-N 3.28Å; D147-K149 VanDerWaalsContact OD1-CB 3.29Å; D147-K149 WeakPolarHBondContact OD1-CB 3.12Å; D147-K149 WeakPolarHBondContact OD1-CG 3.36Å; D147-K149 PolarHBondContact OD1-N 3.18Å
150N64.5Low79.3Confident123 Ų12369.1 Ų69.166%0.65836%0.36SS*.G310 helixtrans-108.91.4-172.2-68.2-31.5000114D147 V148D147-N150 PolarHBondContact O-N 3.18Å; D147-N150 VanDerWaalsContact O-N 3.1Å; D147-N150 PolarHBondContact OD2-ND2 3.04Å; V148-N150 VanDerWaalsContact C-N 3.28Å; V148-N150 PolarHBondContact O-N 2.89Å
151L71.6Confident79.6Confident40 Ų4070 Ų7021%0.20936%0.36CS..  trans-103.5106.8-175.8-108.764.1000112.6M135 V146 A155 V245M135-L151 HydrophobicContact CE-CB 3.75Å; M135-L151 HydrophobicContact CE-CD2 3.76Å; M135-L151 HydrophobicContact CE-CG 4.29Å; M135-L151 HydrophobicContact SD-CB 3.32Å; M135-L151 WeakPolarHBondContact SD-CB 3.46Å; M135-L151 HydrophobicContact SD-CD2 3.58Å; M135-L151 VanDerWaalsContact SD-CD2 3.58Å; M135-L151 HydrophobicContact SD-CG 4.09Å; V146-L151 HydrophobicContact CB-CD2 4.25Å; V146-L151 HydrophobicContact CG1-CD1 3.26Å; V146-L151 HydrophobicContact CG1-CD2 3.54Å; V146-L151 HydrophobicContact CG1-CG 3.94Å; L151-A155 HydrophobicContact CD1-CB 4.16Å; L151-A155 HydrophobicContact CG-CB 3.83Å; L151-V245 HydrophobicContact CD2-CG1 3.91Å
152G83.9Confident79.8Confident33 Ų3373.6 Ų73.634%0.3437%0.372SS..  trans-91.4175.9165.900000113.1W154 A155 V156G152-W154 PolarHBondContact O-N 3.5Å; G152-A155 WeakPolarHBondContact O-CB 3.37Å; G152-A155 PolarHBondContact O-N 2.97Å; G152-V156 PolarHBondContact O-N 2.87Å
153P88.5Confident80.2Confident37 Ų3774.8 Ų74.824%0.2436%0.364CS..Hα-helixtrans-51.8-39.8175.6-26.133.9000113.3V67 P68 V128 V132 A155 V156 T157V67-P153 HydrophobicContact CB-CG 4.31Å; P68-P153 HydrophobicContact CG-CB 4.38Å; P68-P153 HydrophobicContact CG-CG 4.49Å; V128-P153 HydrophobicContact CG1-CB 4.16Å; V132-P153 HydrophobicContact CG2-CB 4.26Å; V132-P153 HydrophobicContact CG2-CG 4.25Å; P153-A155 PolarHBondContact O-N 3.01Å; P153-V156 WeakPolarHBondContact O-CB 3.35Å; P153-V156 PolarHBondContact O-N 3.38Å; P153-T157 PolarHBondContact O-N 2.98Å; P153-T157 PolarHBondContact O-OG1 2.86Å; P153-T157 VanDerWaalsContact O-OG1 3.04Å
154W90.5Very high80.6Confident197 Ų19772.1 Ų72.175%0.74635%0.351SS*.Hα-helixtrans-62.6-41.6177.6-179.5-114000113.3G152 V156 T157 K158G152-W154 PolarHBondContact O-N 3.5Å; W154-V156 VanDerWaalsContact C-N 3.31Å; W154-V156 PolarHBondContact O-N 2.96Å; W154-T157 PolarHBondContact O-N 2.91Å; W154-K158 WeakPolarHBondContact O-CB 3.42Å; W154-K158 PolarHBondContact O-N 3.22Å
155A88.3Confident81.3Confident34 Ų3473 Ų7328%0.28136%0.361SS..Hα-helixtrans-64.7-38.8177.800000111L151 G152 P153 K158 S159L151-A155 HydrophobicContact CD1-CB 4.16Å; L151-A155 HydrophobicContact CG-CB 3.83Å; G152-A155 WeakPolarHBondContact O-CB 3.37Å; G152-A155 PolarHBondContact O-N 2.97Å; P153-A155 PolarHBondContact O-N 3.01Å; A155-K158 PolarHBondContact O-N 3.38Å; A155-S159 WeakPolarHBondContact O-CB 3.23Å; A155-S159 PolarHBondContact O-N 3.04Å
156V89.2Confident82.3Confident0 Ų072.3 Ų72.30%036%0.358CS..Hα-helixtrans-62.7-49.1172.9176.80000111V128 K131 V132 M135 G152 P153 W154 K158 S159 I160V128-V156 HydrophobicContact CG1-CB 4.38Å; V128-V156 HydrophobicContact CG1-CG1 4.26Å; K131-V156 HydrophobicContact CB-CG1 3.82Å; K131-V156 HydrophobicContact CD-CG1 3.63Å; K131-V156 HydrophobicContact CG-CG1 4.45Å; V132-V156 HydrophobicContact CG2-CB 4.28Å; V132-V156 HydrophobicContact CG2-CG2 3.8Å; M135-V156 HydrophobicContact CE-CG2 3.26Å; G152-V156 PolarHBondContact O-N 2.87Å; P153-V156 WeakPolarHBondContact O-CB 3.35Å; P153-V156 PolarHBondContact O-N 3.38Å; W154-V156 VanDerWaalsContact C-N 3.31Å; W154-V156 PolarHBondContact O-N 2.96Å; V156-K158 VanDerWaalsContact C-N 3.34Å; V156-K158 PolarHBondContact O-N 3.48Å; V156-S159 PolarHBondContact O-N 2.93Å; V156-S159 PolarHBondContact O-OG 3.47Å; V156-I160 HydrophobicContact CG1-CD1 3.99Å; V156-I160 WeakPolarHBondContact O-CG1 3.27Å; V156-I160 PolarHBondContact O-N 3.31Å
157T90.8Very high83.1Confident40 Ų4079.4 Ų79.425%0.24539%0.387CS..Hα-helixtrans-57-47.2176.6-57.10000111.6V128 P153 W154 S159 I160 Y161 F169V128-T157 WeakPolarHBondContact CG2-OG1 3.47Å; P153-T157 PolarHBondContact O-N 2.98Å; P153-T157 PolarHBondContact O-OG1 2.86Å; P153-T157 VanDerWaalsContact O-OG1 3.04Å; W154-T157 PolarHBondContact O-N 2.91Å; T157-S159 VanDerWaalsContact C-N 3.32Å; T157-S159 PolarHBondContact O-N 3.3Å; T157-I160 PolarHBondContact O-N 2.97Å; T157-Y161 PolarHBondContact O-N 2.84Å; T157-F169 HydrophobicContact CG2-CE1 4.01Å; T157-F169 HydrophobicContact CG2-CZ 3.82Å
158K90.3Very high83.9Confident111 Ų11175.4 Ų75.448%0.48337%0.365SS..Hα-helixtrans-62.1-38.8178-170.9174.8-176175.60111.9W154 A155 V156 Y161 K162W154-K158 WeakPolarHBondContact O-CB 3.42Å; W154-K158 PolarHBondContact O-N 3.22Å; A155-K158 PolarHBondContact O-N 3.38Å; V156-K158 VanDerWaalsContact C-N 3.34Å; V156-K158 PolarHBondContact O-N 3.48Å; K158-Y161 PolarHBondContact O-N 3.4Å; K158-K162 HydrophobicContact CG-CD 4.47Å; K158-K162 WeakPolarHBondContact O-CB 3.41Å; K158-K162 WeakPolarHBondContact O-CG 3.43Å; K158-K162 PolarHBondContact O-N 2.95Å
159S85.9Confident84.8Confident23 Ų2374.5 Ų74.516%0.16136%0.357CS..Hα-helixtrans-64.9-44.1176.973.90000112.3A155 V156 T157 Y161 K162 E163A155-S159 WeakPolarHBondContact O-CB 3.23Å; A155-S159 PolarHBondContact O-N 3.04Å; V156-S159 PolarHBondContact O-N 2.93Å; V156-S159 PolarHBondContact O-OG 3.47Å; T157-S159 VanDerWaalsContact C-N 3.32Å; T157-S159 PolarHBondContact O-N 3.3Å; S159-Y161 VanDerWaalsContact C-N 3.33Å; S159-Y161 PolarHBondContact O-N 2.86Å; S159-K162 PolarHBondContact O-N 3.49Å; S159-E163 WeakPolarHBondContact O-CB 3.34Å; S159-E163 PolarHBondContact O-N 3.24Å
160I87.3Confident85.9Confident0 Ų070.5 Ų70.50%035%0.345CS..Hα-helixtrans-59.4-48176.9-69.1162.5000110.2L127 V128 K131 V156 T157 E163 K164 F169L127-I160 HydrophobicContact CD2-CD1 3.96Å; L127-I160 HydrophobicContact CD2-CG2 4.48Å; L127-I160 HydrophobicContact CG-CD1 4.12Å; V128-I160 HydrophobicContact CG2-CD1 4.03Å; K131-I160 HydrophobicContact CD-CD1 4.11Å; K131-I160 HydrophobicContact CD-CG1 4.49Å; V156-I160 HydrophobicContact CG1-CD1 3.99Å; V156-I160 WeakPolarHBondContact O-CG1 3.27Å; V156-I160 PolarHBondContact O-N 3.31Å; T157-I160 PolarHBondContact O-N 2.97Å; I160-E163 PolarHBondContact O-N 3.36Å; I160-K164 PolarHBondContact O-N 3.39Å; I160-F169 HydrophobicContact CB-CE1 4.04Å; I160-F169 HydrophobicContact CB-CZ 3.99Å; I160-F169 HydrophobicContact CD1-CE1 4.08Å; I160-F169 HydrophobicContact CG2-CD1 3.9Å; I160-F169 HydrophobicContact CG2-CD2 4.12Å; I160-F169 HydrophobicContact CG2-CE1 3.67Å; I160-F169 HydrophobicContact CG2-CE2 3.91Å; I160-F169 HydrophobicContact CG2-CG 4.11Å; I160-F169 HydrophobicContact CG2-CZ 3.68Å
161Y89.8Confident87.1Confident118 Ų11864.7 Ų64.746%0.46331%0.314SS..Hα-helixtrans-63.6-41.8-179.5-175-102.9000112T157 K158 S159 G165 F166 F169T157-Y161 PolarHBondContact O-N 2.84Å; K158-Y161 PolarHBondContact O-N 3.4Å; S159-Y161 VanDerWaalsContact C-N 3.33Å; S159-Y161 PolarHBondContact O-N 2.86Å; Y161-G165 WeakPolarHBondContact O-CA 3.35Å; Y161-G165 PolarHBondContact O-N 3.48Å; Y161-F166 HydrophobicContact CE2-CD1 4.38Å; Y161-F166 AromaticContact CE2-CD2 3.95Å; Y161-F166 HydrophobicContact CE2-CD2 3.95Å; Y161-F166 HydrophobicContact CE2-CE1 4.07Å; Y161-F166 AromaticContact CE2-CE2 3.61Å; Y161-F166 HydrophobicContact CE2-CE2 3.61Å; Y161-F166 HydrophobicContact CE2-CG 4.32Å; Y161-F166 AromaticContact CE2-CZ 3.67Å; Y161-F166 HydrophobicContact CE2-CZ 3.67Å; Y161-F169 HydrophobicContact CD2-CE2 4.27Å
162K87.2Confident87.9Confident160 Ų16062.8 Ų62.870%0.69630%0.304SS*.Hα-helixtrans-66-37.2177.3-78.6-175.4170.5-165.10113.3K158 S159K158-K162 HydrophobicContact CG-CD 4.47Å; K158-K162 WeakPolarHBondContact O-CB 3.41Å; K158-K162 WeakPolarHBondContact O-CG 3.43Å; K158-K162 PolarHBondContact O-N 2.95Å; S159-K162 PolarHBondContact O-N 3.49Å
163E82.5Confident88.2Confident78 Ų7862.8 Ų62.836%0.36430%0.296SS..Hα-helixtrans-81.8-40.9-174.6-167.4-170.9152.100112.6S159 I160S159-E163 WeakPolarHBondContact O-CB 3.34Å; S159-E163 PolarHBondContact O-N 3.24Å; I160-E163 PolarHBondContact O-N 3.36Å
164K82Confident88.4Confident42 Ų4262.7 Ų62.718%0.18330%0.302CS..Hα-helixtrans-132.72.5-171-70.2-178.9-178.1155.10114.7I160 G168 H242I160-K164 PolarHBondContact O-N 3.39Å; K164-G168 PolarHBondContact O-N 3.16Å; K164-H242 PolarHBondContact NZ-CE1 3.43Å; K164-H242 PolarHBondContact NZ-ND1 2.74Å; K164-H242 PolarHBondContact NZ-NE2 3.47Å; K164-H242 PolarHBondContact NZ-O 2.95Å
165G88.3Confident88.4Confident22 Ų2253.3 Ų53.323%0.22727%0.266CS..G310 helixtrans57.2-150.5-173.400000112.2Y161 K167 G168Y161-G165 WeakPolarHBondContact O-CA 3.35Å; Y161-G165 PolarHBondContact O-N 3.48Å; G165-K167 VanDerWaalsContact C-N 3.25Å; G165-K167 PolarHBondContact O-N 2.95Å; G165-G168 PolarHBondContact O-N 3.37Å; G165-G168 VanDerWaalsContact O-N 3.07Å
166F89.1Confident88.6Confident153 Ų15351.7 Ų51.767%0.67125%0.253SS*.G310 helixtrans-61.8-30-179.8-69.2-75.2000113.9Y161 G168 F169Y161-F166 HydrophobicContact CE2-CD1 4.38Å; Y161-F166 AromaticContact CE2-CD2 3.95Å; Y161-F166 HydrophobicContact CE2-CD2 3.95Å; Y161-F166 HydrophobicContact CE2-CE1 4.07Å; Y161-F166 AromaticContact CE2-CE2 3.61Å; Y161-F166 HydrophobicContact CE2-CE2 3.61Å; Y161-F166 HydrophobicContact CE2-CG 4.32Å; Y161-F166 AromaticContact CE2-CZ 3.67Å; Y161-F166 HydrophobicContact CE2-CZ 3.67Å; F166-G168 PolarHBondContact O-N 3.29Å; F166-F169 PolarHBondContact O-N 3.42Å
167K86.8Confident88.9Confident173 Ų17353.6 Ų53.675%0.75226%0.261SS*.G310 helixtrans-65.3-22176.4-67.5-176179.9178.30112.6G165 F169 T170G165-K167 VanDerWaalsContact C-N 3.25Å; G165-K167 PolarHBondContact O-N 2.95Å; K167-F169 PolarHBondContact O-N 3.47Å; K167-T170 PolarHBondContact O-N 2.94Å; K167-T170 PolarHBondContact O-OG1 2.93Å
168G86.9Confident89Confident0 Ų052.7 Ų52.70%026%0.258CS..G310 helixtrans-61.8-30175.400000113.4L127 K164 G165 F166 H243L127-G168 WeakPolarHBondContact CD2-O 3.32Å; K164-G168 PolarHBondContact O-N 3.16Å; G165-G168 PolarHBondContact O-N 3.37Å; G165-G168 VanDerWaalsContact O-N 3.07Å; F166-G168 PolarHBondContact O-N 3.29Å; G168-H243 PolarHBondContact O-CE1 3.39Å; G168-H243 PolarHBondContact O-NE2 3.47Å; G168-H243 VanDerWaalsContact O-NE2 3.12Å
169F91Very high89Confident34 Ų3448.2 Ų48.215%0.14924%0.238CC..G310 helixtrans-82.9-15.1-176-66.6-73.2000114.6C123 P124 L127 V128 T157 I160 Y161 F166 K167 C171C123-F169 PolarHBondContact SG-O 3.09Å; P124-F169 HydrophobicContact CB-CB 4.06Å; P124-F169 HydrophobicContact CB-CD1 4.06Å; P124-F169 HydrophobicContact CB-CG 4.36Å; L127-F169 HydrophobicContact CD2-CD1 4.28Å; V128-F169 HydrophobicContact CG2-CE1 4.36Å; T157-F169 HydrophobicContact CG2-CE1 4.01Å; T157-F169 HydrophobicContact CG2-CZ 3.82Å; I160-F169 HydrophobicContact CB-CE1 4.04Å; I160-F169 HydrophobicContact CB-CZ 3.99Å; I160-F169 HydrophobicContact CD1-CE1 4.08Å; I160-F169 HydrophobicContact CG2-CD1 3.9Å; I160-F169 HydrophobicContact CG2-CD2 4.12Å; I160-F169 HydrophobicContact CG2-CE1 3.67Å; I160-F169 HydrophobicContact CG2-CE2 3.91Å; I160-F169 HydrophobicContact CG2-CG 4.11Å; I160-F169 HydrophobicContact CG2-CZ 3.68Å; Y161-F169 HydrophobicContact CD2-CE2 4.27Å; F166-F169 PolarHBondContact O-N 3.42Å; K167-F169 PolarHBondContact O-N 3.47Å; F169-C171 PolarHBondContact O-N 2.77Å
170T90.1Very high89.2Confident63 Ų6348.2 Ų48.239%0.38724%0.236SC..G310 helixtrans-87.25.7176.162.60000112.6K167 G172 L173 Q259K167-T170 PolarHBondContact O-N 2.94Å; K167-T170 PolarHBondContact O-OG1 2.93Å; T170-G172 PolarHBondContact O-N 2.98Å; T170-L173 WeakPolarHBondContact O-CB 3.42Å; T170-L173 PolarHBondContact O-N 3.14Å; T170-L173 VanDerWaalsContact O-N 3.12Å; T170-Q259 PolarHBondContact O-NE2 2.92Å
171C88.3Confident89.4Confident1 Ų151.6 Ų51.61%0.00725%0.252CS..THydrogen-bonded Turntrans-68.9121175.9-173.40000110.7F169 M238 H242F169-C171 PolarHBondContact O-N 2.77Å; C171-M238 PolarHBondContact SG-O 3.26Å; C171-M238 VanDerWaalsContact SG-O 3.4Å; C171-H242 VanDerWaalsContact SG-CB 3.52Å; C171-H242 PolarHBondContact SG-ND1 3.12Å
172G88.6Confident89.3Confident0 Ų047.8 Ų47.80%024%0.242CC..THydrogen-bonded Turntrans90.4-3-174.400000114.1T170 G174 A175 T176T170-G172 PolarHBondContact O-N 2.98Å; G172-G174 VanDerWaalsContact C-N 3.33Å; G172-G174 PolarHBondContact O-N 3Å; G172-A175 CarbonylContact O-C 3.56Å; G172-A175 WeakPolarHBondContact O-CA 3.46Å; G172-A175 WeakPolarHBondContact O-CB 3.36Å; G172-A175 PolarHBondContact O-N 2.86Å; G172-T176 PolarHBondContact O-N 3.35Å; G172-T176 PolarHBondContact O-OG1 2.87Å
173L91.8Very high89.3Confident32 Ų3240.3 Ų40.317%0.16821%0.211CC..Hα-helixtrans-54.9-44.4-175.6178.560.8000113.3L120 C123 T170 A175 T176 F177L120-L173 HydrophobicContact CD2-CD1 4.1Å; L120-L173 HydrophobicContact CD2-CD2 4.1Å; C123-L173 HydrophobicContact CB-CB 4.48Å; C123-L173 HydrophobicContact CB-CD1 3.79Å; C123-L173 VanDerWaalsContact SG-CA 3.59Å; T170-L173 WeakPolarHBondContact O-CB 3.42Å; T170-L173 PolarHBondContact O-N 3.14Å; T170-L173 VanDerWaalsContact O-N 3.12Å; L173-A175 VanDerWaalsContact C-N 3.26Å; L173-A175 PolarHBondContact O-N 3.39Å; L173-T176 WeakPolarHBondContact O-CB 3.49Å; L173-T176 PolarHBondContact O-N 3.4Å; L173-F177 HydrophobicContact CD1-CD2 4.27Å; L173-F177 HydrophobicContact CD1-CE1 4.25Å; L173-F177 HydrophobicContact CD1-CE2 3.75Å; L173-F177 HydrophobicContact CD1-CZ 3.72Å; L173-F177 HydrophobicContact CD2-CE2 3.89Å; L173-F177 HydrophobicContact CD2-CZ 4.22Å; L173-F177 HydrophobicContact CG-CD2 4.03Å; L173-F177 HydrophobicContact CG-CE2 3.49Å; L173-F177 VanDerWaalsContact CG-CE2 3.49Å; L173-F177 HydrophobicContact CG-CZ 3.96Å; L173-F177 WeakPolarHBondContact O-CD2 3.32Å; L173-F177 PolarHBondContact O-N 3.36Å
174G91.9Very high89.4Confident35 Ų3539.7 Ų39.736%0.36121%0.205SC..Hα-helixtrans-57.6-42.1175.400000112.1G172 T176 F177 A178 M262G172-G174 VanDerWaalsContact C-N 3.33Å; G172-G174 PolarHBondContact O-N 3Å; G174-T176 VanDerWaalsContact C-N 3.34Å; G174-F177 PolarHBondContact O-N 3.03Å; G174-A178 PolarHBondContact O-N 3.35Å; G174-M262 WeakPolarHBondContact O-CE 3.27Å
175A90.9Very high89.6Confident0 Ų041.8 Ų41.80%022%0.215CC..Hα-helixtrans-72.4-31.9-179.100000111.1G172 L173 A178 R179 V234 K235 M238 M262G172-A175 CarbonylContact O-C 3.56Å; G172-A175 WeakPolarHBondContact O-CA 3.46Å; G172-A175 WeakPolarHBondContact O-CB 3.36Å; G172-A175 PolarHBondContact O-N 2.86Å; L173-A175 VanDerWaalsContact C-N 3.26Å; L173-A175 PolarHBondContact O-N 3.39Å; A175-A178 PolarHBondContact O-N 2.91Å; A175-R179 WeakPolarHBondContact O-CB 3.46Å; A175-R179 PolarHBondContact O-N 2.78Å; A175-V234 HydrophobicContact CB-CG1 4.42Å; A175-K235 HydrophobicContact CB-CB 3.62Å; A175-K235 HydrophobicContact CB-CG 4.09Å; A175-M238 HydrophobicContact CB-SD 4.36Å; A175-M262 HydrophobicContact CB-CE 4.24Å; A175-M262 HydrophobicContact CB-CG 4.01Å; A175-M262 HydrophobicContact CB-SD 4.28Å; A175-M262 VanDerWaalsContact N-CE 3.34Å
176T93Very high89.7Confident0 Ų044.9 Ų44.90%022%0.222CC..Hα-helixtrans-60.7-49.4168.7-55.30000110.7L122 G172 L173 G174 A178 R179 E180L122-T176 HydrophobicContact CB-CG2 4.32Å; G172-T176 PolarHBondContact O-N 3.35Å; G172-T176 PolarHBondContact O-OG1 2.87Å; L173-T176 WeakPolarHBondContact O-CB 3.49Å; L173-T176 PolarHBondContact O-N 3.4Å; G174-T176 VanDerWaalsContact C-N 3.34Å; T176-A178 PolarHBondContact O-N 3.27Å; T176-R179 WeakPolarHBondContact O-CB 3.37Å; T176-R179 PolarHBondContact O-N 3.23Å; T176-E180 HydrophobicContact CG2-CG 4.05Å; T176-E180 WeakPolarHBondContact O-CG 3.5Å; T176-E180 PolarHBondContact O-N 3.31Å
177F94.3Very high89.7Confident40 Ų4040.7 Ų40.718%0.17520%0.204CC..Hα-helixtrans-57.9-46.1175.8-69.5-50000112.8F116 S119 L120 L173 G174 R179 E180 M181F116-F177 AromaticContact CD2-CD1 3.9Å; F116-F177 HydrophobicContact CD2-CD1 3.9Å; F116-F177 AromaticContact CD2-CE1 3.47Å; F116-F177 HydrophobicContact CD2-CE1 3.47Å; F116-F177 VanDerWaalsContact CD2-CE1 3.47Å; F116-F177 AromaticContact CD2-CZ 3.98Å; F116-F177 HydrophobicContact CD2-CZ 3.98Å; F116-F177 HydrophobicContact CE2-CD1 4.34Å; F116-F177 AromaticContact CE2-CE1 3.65Å; F116-F177 HydrophobicContact CE2-CE1 3.65Å; F116-F177 HydrophobicContact CE2-CE2 4.31Å; F116-F177 AromaticContact CE2-CZ 3.64Å; F116-F177 HydrophobicContact CE2-CZ 3.64Å; F116-F177 HydrophobicContact CG-CE1 4.09Å; F116-F177 HydrophobicContact CZ-CE1 4.39Å; F116-F177 HydrophobicContact CZ-CZ 4.19Å; F116-F177 WeakPolarHBondContact O-CE1 3.23Å; S119-F177 VanDerWaalsContact CB-CE1 3.41Å; L120-F177 HydrophobicContact CD2-CE1 4.49Å; L120-F177 HydrophobicContact CD2-CZ 3.86Å; L120-F177 HydrophobicContact CG-CE1 4.46Å; L120-F177 HydrophobicContact CG-CZ 4.29Å; L173-F177 HydrophobicContact CD1-CD2 4.27Å; L173-F177 HydrophobicContact CD1-CE1 4.25Å; L173-F177 HydrophobicContact CD1-CE2 3.75Å; L173-F177 HydrophobicContact CD1-CZ 3.72Å; L173-F177 HydrophobicContact CD2-CE2 3.89Å; L173-F177 HydrophobicContact CD2-CZ 4.22Å; L173-F177 HydrophobicContact CG-CD2 4.03Å; L173-F177 HydrophobicContact CG-CE2 3.49Å; L173-F177 VanDerWaalsContact CG-CE2 3.49Å; L173-F177 HydrophobicContact CG-CZ 3.96Å; L173-F177 WeakPolarHBondContact O-CD2 3.32Å; L173-F177 PolarHBondContact O-N 3.36Å; G174-F177 PolarHBondContact O-N 3.03Å; F177-R179 PolarHBondContact O-N 3.36Å; F177-E180 PolarHBondContact O-N 3.37Å; F177-M181 HydrophobicContact CB-SD 4.17Å; F177-M181 HydrophobicContact CD1-SD 4.41Å; F177-M181 WeakPolarHBondContact O-CB 3.5Å; F177-M181 WeakPolarHBondContact O-CG 3.48Å; F177-M181 PolarHBondContact O-N 3.34Å
178A92.8Very high89.7Confident21 Ų2135.5 Ų35.517%0.17418%0.181CC..Hα-helixtrans-65-19.3178.400000113.4G174 A175 T176 P182 F231 M262G174-A178 PolarHBondContact O-N 3.35Å; A175-A178 PolarHBondContact O-N 2.91Å; T176-A178 PolarHBondContact O-N 3.27Å; A178-P182 VanDerWaalsContact O-CD 3.22Å; A178-P182 WeakPolarHBondContact O-CD 3.31Å; A178-P182 WeakPolarHBondContact O-CG 3.23Å; A178-F231 HydrophobicContact CB-CB 4.24Å; A178-F231 HydrophobicContact CB-CD1 3.6Å; A178-F231 HydrophobicContact CB-CD2 4.2Å; A178-F231 HydrophobicContact CB-CE1 3.92Å; A178-F231 HydrophobicContact CB-CE2 4.49Å; A178-F231 HydrophobicContact CB-CG 3.75Å; A178-F231 HydrophobicContact CB-CZ 4.36Å; A178-F231 WeakPolarHBondContact O-CD2 3.28Å; A178-M262 HydrophobicContact CB-CE 3.91Å; A178-M262 HydrophobicContact CB-SD 4.04Å
179R90.9Very high89.7Confident18 Ų1836.6 Ų36.67%0.06819%0.192CC..Hα-helixtrans-86.8-50.3173.6-173.2-172.974.9166.9-1111.9E126 A175 T176 F177 G183 I228 F231 D232E126-R179 IonicContact OE1-CZ 3.67Å; E126-R179 IonicContact OE1-NH1 3.75Å; E126-R179 PolarHBondContact OE1-NH1 2.88Å; E126-R179 IonicContact OE1-NH2 3.24Å; E126-R179 PolarHBondContact OE1-NH2 3.05Å; E126-R179 IonicContact OE2-CZ 3.7Å; E126-R179 IonicContact OE2-NH1 2.97Å; E126-R179 IonicContact OE2-NH2 2.93Å; E126-R179 PolarHBondContact OE2-NH2 3.09Å; A175-R179 WeakPolarHBondContact O-CB 3.46Å; A175-R179 PolarHBondContact O-N 2.78Å; T176-R179 WeakPolarHBondContact O-CB 3.37Å; T176-R179 PolarHBondContact O-N 3.23Å; F177-R179 PolarHBondContact O-N 3.36Å; R179-G183 PolarHBondContact O-N 2.9Å; R179-I228 HydrophobicContact CG-CB 4.2Å; R179-I228 HydrophobicContact CG-CD1 3.71Å; R179-I228 HydrophobicContact CG-CG1 4.07Å; R179-F231 HydrophobicContact CB-CB 4.42Å; R179-D232 VanDerWaalsContact CD-OD1 3.26Å; R179-D232 WeakPolarHBondContact CD-OD1 3.42Å; R179-D232 IonicContact CZ-OD1 3.08Å; R179-D232 IonicContact NE-OD1 3.43Å; R179-D232 IonicContact NH1-OD1 3.4Å; R179-D232 PolarHBondContact NH1-OD1 3.16Å
180E90.8Very high89.6Confident22 Ų2235.5 Ų35.510%0.10319%0.191CC..Hα-helixtrans-73.9-47.8-171.8-64.4-46.8137.400112.9A115 S119 L122 T176 F177 G183A115-E180 HydrophobicContact CB-CB 4.07Å; S119-E180 VanDerWaalsContact OG-CB 3.27Å; S119-E180 WeakPolarHBondContact OG-CB 3.22Å; S119-E180 VanDerWaalsContact OG-CG 3.23Å; S119-E180 WeakPolarHBondContact OG-CG 3.32Å; L122-E180 HydrophobicContact CD1-CG 4.07Å; T176-E180 HydrophobicContact CG2-CG 4.05Å; T176-E180 WeakPolarHBondContact O-CG 3.5Å; T176-E180 PolarHBondContact O-N 3.31Å; F177-E180 PolarHBondContact O-N 3.37Å; E180-G183 PolarHBondContact O-N 3.43Å
181M90.9Very high89.5Confident71 Ų7134.5 Ų34.535%0.3518%0.18SC..Hα-helixtrans-65.1-47.4-171.9-58.7173.964.900112S112 F116 F177 G183S112-M181 VanDerWaalsContact CB-O 3.24Å; S112-M181 WeakPolarHBondContact CB-O 3.32Å; S112-M181 PolarHBondContact OG-O 2.89Å; F116-M181 HydrophobicContact CD2-SD 4.33Å; F177-M181 HydrophobicContact CB-SD 4.17Å; F177-M181 HydrophobicContact CD1-SD 4.41Å; F177-M181 WeakPolarHBondContact O-CB 3.5Å; F177-M181 WeakPolarHBondContact O-CG 3.48Å; F177-M181 PolarHBondContact O-N 3.34Å; M181-G183 VanDerWaalsContact C-N 3.3Å; M181-G183 PolarHBondContact O-N 3.17Å
182P88.4Confident89.4Confident38 Ų3836.2 Ų36.225%0.24719%0.188CC..Hα-helixtrans-76.7-18.9177.8-14.733.1000112.9A178 Y184 F185 F186A178-P182 VanDerWaalsContact O-CD 3.22Å; A178-P182 WeakPolarHBondContact O-CD 3.31Å; A178-P182 WeakPolarHBondContact O-CG 3.23Å; P182-Y184 PolarHBondContact O-N 2.89Å; P182-F185 WeakPolarHBondContact O-CB 3.18Å; P182-F185 PolarHBondContact O-N 3.4Å; P182-F185 VanDerWaalsContact O-N 3.16Å; P182-F186 HydrophobicContact CB-CD2 3.8Å; P182-F186 HydrophobicContact CB-CE2 3.61Å; P182-F186 WeakPolarHBondContact O-CD2 3.28Å; P182-F186 PolarHBondContact O-N 2.94Å
183G87.3Confident89.4Confident4 Ų438.7 Ų38.74%0.04121%0.209CC..Hα-helixtrans-53.2-53.9-175.500000112.2R179 E180 M181 F185 F186 F187 L224R179-G183 PolarHBondContact O-N 2.9Å; E180-G183 PolarHBondContact O-N 3.43Å; M181-G183 VanDerWaalsContact C-N 3.3Å; M181-G183 PolarHBondContact O-N 3.17Å; G183-F185 VanDerWaalsContact C-N 3.34Å; G183-F185 PolarHBondContact O-N 3.29Å; G183-F186 PolarHBondContact O-N 2.9Å; G183-F187 WeakPolarHBondContact O-CB 3.2Å; G183-F187 PolarHBondContact O-N 2.88Å; G183-L224 WeakPolarHBondContact O-CD1 3.29Å
184Y84.4Confident89.2Confident64 Ų6437.8 Ų37.825%0.25121%0.205SC..Hα-helixtrans-60.1-42.2178.1-72.1-73.3000112.9L80 A115 P182 F186 F187 F188L80-Y184 WeakPolarHBondContact CD1-OH 3.31Å; A115-Y184 HydrophobicContact CB-CD2 4.03Å; A115-Y184 HydrophobicContact CB-CE2 3.93Å; P182-Y184 PolarHBondContact O-N 2.89Å; Y184-F186 PolarHBondContact O-N 3.04Å; Y184-F187 PolarHBondContact O-N 2.91Å; Y184-F188 HydrophobicContact CD1-CE2 4.2Å; Y184-F188 VanDerWaalsContact O-CD2 3.26Å; Y184-F188 WeakPolarHBondContact O-CD2 3.3Å; Y184-F188 PolarHBondContact O-N 3.01Å
185F86Confident89Confident87 Ų8738.1 Ų38.138%0.38220%0.195SC..Hα-helixtrans-59.5-48177.8-179.6-93.2000111.8L105 P182 G183 G189L105-F185 HydrophobicContact CD2-CE2 4.36Å; P182-F185 WeakPolarHBondContact O-CB 3.18Å; P182-F185 PolarHBondContact O-N 3.4Å; P182-F185 VanDerWaalsContact O-N 3.16Å; G183-F185 VanDerWaalsContact C-N 3.34Å; G183-F185 PolarHBondContact O-N 3.29Å; F185-G189 WeakPolarHBondContact O-CA 3.44Å; F185-G189 PolarHBondContact O-N 3.46Å
186F89.2Confident88.8Confident86 Ų8641.5 Ų41.538%0.37722%0.216SC..Hα-helixtrans-70.3-34179.4-72.7-65.2000113.2P182 G183 Y184 G190 A227 I228P182-F186 HydrophobicContact CB-CD2 3.8Å; P182-F186 HydrophobicContact CB-CE2 3.61Å; P182-F186 WeakPolarHBondContact O-CD2 3.28Å; P182-F186 PolarHBondContact O-N 2.94Å; G183-F186 PolarHBondContact O-N 2.9Å; Y184-F186 PolarHBondContact O-N 3.04Å; F186-G190 PolarHBondContact O-N 2.64Å; F186-A227 HydrophobicContact CB-CB 4.08Å; F186-A227 HydrophobicContact CD1-CB 3.82Å; F186-A227 HydrophobicContact CD2-CB 3.47Å; F186-A227 VanDerWaalsContact CD2-CB 3.47Å; F186-A227 HydrophobicContact CE1-CB 4.09Å; F186-A227 HydrophobicContact CE2-CB 3.77Å; F186-A227 HydrophobicContact CG-CB 3.51Å; F186-A227 HydrophobicContact CZ-CB 4.07Å; F186-I228 HydrophobicContact CD2-CG2 4.46Å
187F89Confident88.5Confident66 Ų6648.8 Ų48.829%0.28925%0.254SS..Hα-helixtrans-61.6-56.4174.4178.9-95.4000111.4G183 Y184 G190 Y191 G220 L224G183-F187 WeakPolarHBondContact O-CB 3.2Å; G183-F187 PolarHBondContact O-N 2.88Å; Y184-F187 PolarHBondContact O-N 2.91Å; F187-G190 PolarHBondContact O-N 3.49Å; F187-Y191 VanDerWaalsContact O-CB 3.31Å; F187-Y191 WeakPolarHBondContact O-CB 3.09Å; F187-Y191 PolarHBondContact O-N 3.45Å; F187-G220 WeakPolarHBondContact O-CA 3.15Å; F187-L224 HydrophobicContact CB-CB 4.01Å; F187-L224 HydrophobicContact CB-CD1 3.77Å; F187-L224 HydrophobicContact CD2-CD1 4.36Å; F187-L224 HydrophobicContact CG-CD1 4.43Å
188F86.9Confident88.2Confident63 Ų6349.4 Ų49.428%0.27626%0.258SS..Hα-helixtrans-68.4-37.8-178.2-77.4-66.4000111.9V104 A108 Y184 Y191 E192V104-F188 HydrophobicContact CG1-CB 3.96Å; V104-F188 HydrophobicContact CG1-CD1 3.76Å; V104-F188 HydrophobicContact CG1-CG 4.13Å; A108-F188 HydrophobicContact CB-CB 3.93Å; A108-F188 HydrophobicContact CB-CD2 3.66Å; A108-F188 HydrophobicContact CB-CG 4.11Å; Y184-F188 HydrophobicContact CD1-CE2 4.2Å; Y184-F188 VanDerWaalsContact O-CD2 3.26Å; Y184-F188 WeakPolarHBondContact O-CD2 3.3Å; Y184-F188 PolarHBondContact O-N 3.01Å; F188-Y191 PolarHBondContact O-N 2.99Å; F188-E192 VanDerWaalsContact O-CB 3.23Å; F188-E192 WeakPolarHBondContact O-CB 3.49Å; F188-E192 PolarHBondContact O-N 2.97Å
189G87.2Confident87.8Confident23 Ų2349.5 Ų49.524%0.23726%0.257CS..Hα-helixtrans-60.9-46.6174.300000112.4F185 E192 A193F185-G189 WeakPolarHBondContact O-CA 3.44Å; F185-G189 PolarHBondContact O-N 3.46Å; G189-E192 PolarHBondContact O-N 3.33Å; G189-A193 VanDerWaalsContact O-CB 3.23Å; G189-A193 WeakPolarHBondContact O-CB 3.45Å; G189-A193 PolarHBondContact O-N 3.39Å
190G89.1Confident87.2Confident11 Ų1152.7 Ų52.711%0.11328%0.28CS..Hα-helixtrans-65.5-41.3176.500000112.9F186 F187 C194F186-G190 PolarHBondContact O-N 2.64Å; F187-G190 PolarHBondContact O-N 3.49Å; G190-C194 VanDerWaalsContact O-CB 3.31Å; G190-C194 WeakPolarHBondContact O-CB 3.32Å; G190-C194 PolarHBondContact O-N 2.7Å
191Y87.5Confident86.4Confident42 Ų4258.8 Ų58.817%0.16532%0.318CS..Hα-helixtrans-59.7-49.6174.5174.9-102.7000111.8F187 F188 C194 R195 T213 A216F187-Y191 VanDerWaalsContact O-CB 3.31Å; F187-Y191 WeakPolarHBondContact O-CB 3.09Å; F187-Y191 PolarHBondContact O-N 3.45Å; F188-Y191 PolarHBondContact O-N 2.99Å; Y191-C194 PolarHBondContact O-N 3.31Å; Y191-R195 VanDerWaalsContact CE1-CD 3.42Å; Y191-R195 HydrophobicContact CE1-CG 4.43Å; Y191-R195 HydrophobicContact CE2-CG 4.43Å; Y191-R195 WeakPolarHBondContact O-CG 3.41Å; Y191-R195 PolarHBondContact O-N 3.16Å; Y191-R195 WeakPolarHBondContact OH-CD 3.34Å; Y191-R195 PolarHBondContact OH-NH1 3.16Å; Y191-R195 VanDerWaalsContact OH-NH1 3.16Å; Y191-T213 HydrophobicContact CE2-CG2 4.46Å; Y191-A216 HydrophobicContact CD2-CB 3.82Å; Y191-A216 HydrophobicContact CE2-CB 3.95Å
192E86.3Confident85.7Confident38 Ų3863.3 Ų63.318%0.17834%0.344CS..Hα-helixtrans-70.3-39.7-175.9-168.760.5-156.300112.3F188 G189 C194 R195 T196 K205F188-E192 VanDerWaalsContact O-CB 3.23Å; F188-E192 WeakPolarHBondContact O-CB 3.49Å; F188-E192 PolarHBondContact O-N 2.97Å; G189-E192 PolarHBondContact O-N 3.33Å; E192-C194 VanDerWaalsContact C-N 3.34Å; E192-R195 PolarHBondContact O-N 3.4Å; E192-T196 WeakPolarHBondContact O-CB 3.38Å; E192-T196 PolarHBondContact O-N 2.93Å; E192-T196 PolarHBondContact O-OG1 3.23Å; E192-K205 WeakPolarHBondContact OE1-CD 3.22Å; E192-K205 WeakPolarHBondContact OE1-CE 3.31Å; E192-K205 IonicContact OE1-NZ 3.62Å; E192-K205 PolarHBondContact OE1-NZ 3.43Å
193A88.9Confident85Confident52 Ų5262.9 Ų62.943%0.4335%0.347SS..Hα-helixtrans-60.4-4617300000110.7G189 T196 L197G189-A193 VanDerWaalsContact O-CB 3.23Å; G189-A193 WeakPolarHBondContact O-CB 3.45Å; G189-A193 PolarHBondContact O-N 3.39Å; A193-T196 PolarHBondContact O-N 3.17Å; A193-L197 VanDerWaalsContact O-CG 3.29Å; A193-L197 WeakPolarHBondContact O-CG 3.45Å; A193-L197 PolarHBondContact O-N 2.84Å
194C88.6Confident84.5Confident12 Ų1269.7 Ų69.78%0.08137%0.371CS..Hα-helixtrans-62.2-45.7177.3-173.20000112.1G190 Y191 E192 T196 L197 M198 A216 I219G190-C194 VanDerWaalsContact O-CB 3.31Å; G190-C194 WeakPolarHBondContact O-CB 3.32Å; G190-C194 PolarHBondContact O-N 2.7Å; Y191-C194 PolarHBondContact O-N 3.31Å; E192-C194 VanDerWaalsContact C-N 3.34Å; C194-T196 VanDerWaalsContact C-N 3.34Å; C194-T196 PolarHBondContact O-N 3.07Å; C194-L197 PolarHBondContact O-N 3.3Å; C194-M198 VanDerWaalsContact O-CG 3.28Å; C194-M198 WeakPolarHBondContact O-CG 3.26Å; C194-M198 PolarHBondContact O-N 3.42Å; C194-M198 VanDerWaalsContact SG-SD 3.68Å; C194-A216 HydrophobicContact CB-CB 3.99Å; C194-I219 HydrophobicContact CB-CB 4.34Å; C194-I219 HydrophobicContact CB-CD1 4.47Å; C194-I219 HydrophobicContact CB-CG2 4.13Å; C194-I219 WeakPolarHBondContact SG-CD1 3.18Å
195R85.8Confident83.9Confident43 Ų4370.4 Ų70.416%0.16238%0.375CS..Hα-helixtrans-60.9-45.3177.2-73.6-173.477179.611.7111.6Y191 E192 L197 M198 T199 K205 L208 A216Y191-R195 VanDerWaalsContact CE1-CD 3.42Å; Y191-R195 HydrophobicContact CE1-CG 4.43Å; Y191-R195 HydrophobicContact CE2-CG 4.43Å; Y191-R195 WeakPolarHBondContact O-CG 3.41Å; Y191-R195 PolarHBondContact O-N 3.16Å; Y191-R195 WeakPolarHBondContact OH-CD 3.34Å; Y191-R195 PolarHBondContact OH-NH1 3.16Å; Y191-R195 VanDerWaalsContact OH-NH1 3.16Å; E192-R195 PolarHBondContact O-N 3.4Å; R195-L197 VanDerWaalsContact C-N 3.29Å; R195-L197 PolarHBondContact O-N 3.48Å; R195-M198 PolarHBondContact O-N 2.94Å; R195-M198 VanDerWaalsContact O-N 3.09Å; R195-T199 WeakPolarHBondContact O-CB 3.22Å; R195-T199 PolarHBondContact O-N 2.85Å; R195-T199 PolarHBondContact O-OG1 3.08Å; R195-K205 PolarHBondContact NH2-O 2.86Å; R195-L208 HydrophobicContact CB-CD1 3.67Å; R195-L208 HydrophobicContact CG-CD1 3.71Å; R195-A216 HydrophobicContact CG-CB 3.72Å
196T86.7Confident83.2Confident71 Ų7172.6 Ų72.644%0.43639%0.387SS..Hα-helixtrans-61-38.6179.5-56.50000111.6E192 A193 C194 K205E192-T196 WeakPolarHBondContact O-CB 3.38Å; E192-T196 PolarHBondContact O-N 2.93Å; E192-T196 PolarHBondContact O-OG1 3.23Å; A193-T196 PolarHBondContact O-N 3.17Å; C194-T196 VanDerWaalsContact C-N 3.34Å; C194-T196 PolarHBondContact O-N 3.07Å; T196-K205 WeakPolarHBondContact OG1-CE 3.43Å; T196-K205 PolarHBondContact OG1-NZ 3.45Å; T196-K205 VanDerWaalsContact OG1-NZ 3.15Å
197L88.2Confident82.5Confident152 Ų15273.9 Ų73.980%0.79640%0.398SS*.Hα-helixtrans-70.7-28.6175.2-69.1172.1000113.7A193 C194 R195A193-L197 VanDerWaalsContact O-CG 3.29Å; A193-L197 WeakPolarHBondContact O-CG 3.45Å; A193-L197 PolarHBondContact O-N 2.84Å; C194-L197 PolarHBondContact O-N 3.3Å; R195-L197 VanDerWaalsContact C-N 3.29Å; R195-L197 PolarHBondContact O-N 3.48Å
198M87.6Confident81.9Confident53 Ų5371.3 Ų71.326%0.26139%0.387SS..Hα-helixtrans-91-15.4-179-67.4-178.985.800114C194 R195 P200 L208 K212 I215C194-M198 VanDerWaalsContact O-CG 3.28Å; C194-M198 WeakPolarHBondContact O-CG 3.26Å; C194-M198 PolarHBondContact O-N 3.42Å; C194-M198 VanDerWaalsContact SG-SD 3.68Å; R195-M198 PolarHBondContact O-N 2.94Å; R195-M198 VanDerWaalsContact O-N 3.09Å; M198-P200 WeakPolarHBondContact O-CD 3.4Å; M198-L208 HydrophobicContact CB-CD2 3.82Å; M198-K212 HydrophobicContact CE-CB 3.67Å; M198-K212 HydrophobicContact CE-CD 3.92Å; M198-K212 HydrophobicContact CE-CG 3.54Å; M198-K212 HydrophobicContact SD-CB 4.29Å; M198-I215 HydrophobicContact SD-CG2 4.41Å
199T84.5Confident81.7Confident24 Ų2470 Ų7015%0.14739%0.391CS..SBendtrans-78.6119.7174.8-66.60000108.9R195 G203 K205 L208R195-T199 WeakPolarHBondContact O-CB 3.22Å; R195-T199 PolarHBondContact O-N 2.85Å; R195-T199 PolarHBondContact O-OG1 3.08Å; T199-G203 WeakPolarHBondContact CG2-O 3.36Å; T199-K205 HydrophobicContact CG2-CG 4.44Å; T199-L208 WeakPolarHBondContact OG1-CD1 3.24Å
200P78.2Confident81.4Confident85 Ų8574 Ų7455%0.55241%0.413SS*.  trans-57.9151.7172.6-20.632.3000110.9M198 N202 G203M198-P200 WeakPolarHBondContact O-CD 3.4Å; P200-N202 PolarHBondContact O-N 3.23Å; P200-G203 PolarHBondContact O-N 3.2Å
201T74.5Confident81.3Confident149 Ų14979.6 Ų79.691%0.91444%0.439SS*.THydrogen-bonded Turntrans-53-28.1-175.8-42.50000114.3
202N75.4Confident81.2Confident167 Ų16781.7 Ų81.789%0.89345%0.449SS*.THydrogen-bonded Turntrans-106.56177.8-68.9-7.8000114.2P200P200-N202 PolarHBondContact O-N 3.23Å
203G73.8Confident81.1Confident29 Ų2982 Ų8230%0.29945%0.453SS..SBendtrans-97.4159.5-179.800000112.5T199 P200T199-G203 WeakPolarHBondContact CG2-O 3.36Å; P200-G203 PolarHBondContact O-N 3.2Å
204R76.2Confident81Confident147 Ų14784.6 Ų84.656%0.55546%0.463SS*.  trans-89.8151170.1-62.2175.863.9173-3.5109.8E206 D207R204-E206 HydrophobicContact CB-CB 4.48Å; R204-E206 IonicContact CZ-OE1 3.29Å; R204-E206 IonicContact CZ-OE2 2.9Å; R204-E206 IonicContact NE-OE1 2.9Å; R204-E206 IonicContact NE-OE2 2.76Å; R204-E206 IonicContact NH2-OE1 2.75Å; R204-E206 PolarHBondContact NH2-OE1 3.41Å; R204-E206 IonicContact NH2-OE2 2.86Å; R204-E206 PolarHBondContact NH2-OE2 3Å; R204-E206 PolarHBondContact O-N 2.86Å; R204-D207 WeakPolarHBondContact CB-OD2 3.33Å; R204-D207 PolarHBondContact N-OD2 2.84Å; R204-D207 WeakPolarHBondContact O-CB 3.2Å; R204-D207 PolarHBondContact O-N 3.41Å
205K71.5Confident81Confident78 Ų7887.8 Ų87.834%0.33948%0.479SS..G310 helixtrans-59.2-28.7172.6-69.7177.1179176.40111.9E192 R195 T196 T199 D207 L208E192-K205 WeakPolarHBondContact OE1-CD 3.22Å; E192-K205 WeakPolarHBondContact OE1-CE 3.31Å; E192-K205 IonicContact OE1-NZ 3.62Å; E192-K205 PolarHBondContact OE1-NZ 3.43Å; R195-K205 PolarHBondContact NH2-O 2.86Å; T196-K205 WeakPolarHBondContact OG1-CE 3.43Å; T196-K205 PolarHBondContact OG1-NZ 3.45Å; T196-K205 VanDerWaalsContact OG1-NZ 3.15Å; T199-K205 HydrophobicContact CG2-CG 4.44Å; K205-D207 VanDerWaalsContact C-N 3.27Å; K205-D207 PolarHBondContact O-N 3.43Å; K205-L208 WeakPolarHBondContact O-CB 3.33Å; K205-L208 WeakPolarHBondContact O-CD1 3.33Å; K205-L208 WeakPolarHBondContact O-CG 3.36Å; K205-L208 PolarHBondContact O-N 2.93Å
206E71.4Confident81.1Confident134 Ų13485.7 Ų85.763%0.62647%0.471SS*.G310 helixtrans-67.4-25.4176.5-66.9158-130.400112.9R204 L208R204-E206 HydrophobicContact CB-CB 4.48Å; R204-E206 IonicContact CZ-OE1 3.29Å; R204-E206 IonicContact CZ-OE2 2.9Å; R204-E206 IonicContact NE-OE1 2.9Å; R204-E206 IonicContact NE-OE2 2.76Å; R204-E206 IonicContact NH2-OE1 2.75Å; R204-E206 PolarHBondContact NH2-OE1 3.41Å; R204-E206 IonicContact NH2-OE2 2.86Å; R204-E206 PolarHBondContact NH2-OE2 3Å; R204-E206 PolarHBondContact O-N 2.86Å; E206-L208 PolarHBondContact O-N 3.31Å
207D74.7Confident81.1Confident112 Ų11283.4 Ų83.460%0.59946%0.462SS*.G310 helixtrans-78.9-1.6179.7-52.6-32.5000112.5R204 K205 G209R204-D207 WeakPolarHBondContact CB-OD2 3.33Å; R204-D207 PolarHBondContact N-OD2 2.84Å; R204-D207 WeakPolarHBondContact O-CB 3.2Å; R204-D207 PolarHBondContact O-N 3.41Å; K205-D207 VanDerWaalsContact C-N 3.27Å; K205-D207 PolarHBondContact O-N 3.43Å; D207-G209 PolarHBondContact O-N 3Å
208L76.7Confident81.1Confident12 Ų1277.3 Ų77.36%0.06344%0.435CS..  trans-66.5104.7173-71167.8000108.7R195 M198 T199 K205 E206 K212 T213R195-L208 HydrophobicContact CB-CD1 3.67Å; R195-L208 HydrophobicContact CG-CD1 3.71Å; M198-L208 HydrophobicContact CB-CD2 3.82Å; T199-L208 WeakPolarHBondContact OG1-CD1 3.24Å; K205-L208 WeakPolarHBondContact O-CB 3.33Å; K205-L208 WeakPolarHBondContact O-CD1 3.33Å; K205-L208 WeakPolarHBondContact O-CG 3.36Å; K205-L208 PolarHBondContact O-N 2.93Å; E206-L208 PolarHBondContact O-N 3.31Å; L208-K212 HydrophobicContact CB-CB 4.25Å; L208-K212 HydrophobicContact CD2-CB 3.97Å; L208-K212 HydrophobicContact CD2-CD 3.45Å; L208-K212 VanDerWaalsContact CD2-CD 3.45Å; L208-K212 HydrophobicContact CD2-CG 4.37Å; L208-T213 PolarHBondContact O-OG1 2.91Å
209G82Confident81.2Confident35 Ų3578.3 Ų78.336%0.36144%0.441SS..  trans-53.1160.9174.800000113.2D207 I211 K212 T213D207-G209 PolarHBondContact O-N 3Å; G209-I211 PolarHBondContact O-N 3.01Å; G209-K212 PolarHBondContact O-N 3.18Å; G209-T213 PolarHBondContact O-N 2.99Å
210P82.3Confident81.5Confident108 Ų10877.1 Ų77.170%0.70143%0.434SS*.Hα-helixtrans-54.2-37.6-168.219.5-32.9000113.7K212 T213 V214P210-K212 PolarHBondContact O-N 3.15Å; P210-T213 PolarHBondContact O-N 2.63Å; P210-V214 WeakPolarHBondContact O-CG2 3.46Å; P210-V214 PolarHBondContact O-N 3.47Å
211I85.9Confident82Confident129 Ų12973.5 Ų73.566%0.66241%0.412SS*.Hα-helixtrans-63.1-43.4178.7-62.3172.4000111.6G209 T213 V214 I215G209-I211 PolarHBondContact O-N 3.01Å; I211-T213 VanDerWaalsContact C-N 3.32Å; I211-T213 PolarHBondContact O-N 2.78Å; I211-V214 PolarHBondContact O-N 3.39Å; I211-I215 HydrophobicContact CG2-CD1 3.99Å; I211-I215 WeakPolarHBondContact O-CG1 3.42Å; I211-I215 PolarHBondContact O-N 3.18Å
212K86.2Confident82.8Confident86 Ų8669 Ų6937%0.37438%0.384SS..Hα-helixtrans-66.5-37.8179.9-63.6-171.6174.8-177.90111.1M198 L208 G209 P210 I215 A216M198-K212 HydrophobicContact CE-CB 3.67Å; M198-K212 HydrophobicContact CE-CD 3.92Å; M198-K212 HydrophobicContact CE-CG 3.54Å; M198-K212 HydrophobicContact SD-CB 4.29Å; L208-K212 HydrophobicContact CB-CB 4.25Å; L208-K212 HydrophobicContact CD2-CB 3.97Å; L208-K212 HydrophobicContact CD2-CD 3.45Å; L208-K212 VanDerWaalsContact CD2-CD 3.45Å; L208-K212 HydrophobicContact CD2-CG 4.37Å; G209-K212 PolarHBondContact O-N 3.18Å; P210-K212 PolarHBondContact O-N 3.15Å; K212-I215 PolarHBondContact O-N 2.92Å; K212-A216 WeakPolarHBondContact O-CB 3.44Å; K212-A216 PolarHBondContact O-N 2.86Å
213T84.9Confident83.5Confident43 Ų4363 Ų6326%0.26436%0.355SS..Hα-helixtrans-64.6-40.7175-60.20000111.8Y191 L208 G209 P210 I211 A216 G217Y191-T213 HydrophobicContact CE2-CG2 4.46Å; L208-T213 PolarHBondContact O-OG1 2.91Å; G209-T213 PolarHBondContact O-N 2.99Å; P210-T213 PolarHBondContact O-N 2.63Å; I211-T213 VanDerWaalsContact C-N 3.32Å; I211-T213 PolarHBondContact O-N 2.78Å; T213-A216 PolarHBondContact O-N 3.43Å; T213-G217 PolarHBondContact O-N 3.42Å
214V86.4Confident84.4Confident107 Ų10763 Ų6365%0.64835%0.348SS*.Hα-helixtrans-62.9-44.1173.6170.40000111.4P210 I211 G217 G218P210-V214 WeakPolarHBondContact O-CG2 3.46Å; P210-V214 PolarHBondContact O-N 3.47Å; I211-V214 PolarHBondContact O-N 3.39Å; V214-G217 PolarHBondContact O-N 2.94Å; V214-G218 PolarHBondContact O-N 2.96Å
215I88.3Confident85.2Confident79 Ų7957.6 Ų57.641%0.40533%0.328SS..Hα-helixtrans-61.4-46.4176.6-68.5166.8000110.6M198 I211 K212 G217 G218 I219M198-I215 HydrophobicContact SD-CG2 4.41Å; I211-I215 HydrophobicContact CG2-CD1 3.99Å; I211-I215 WeakPolarHBondContact O-CG1 3.42Å; I211-I215 PolarHBondContact O-N 3.18Å; K212-I215 PolarHBondContact O-N 2.92Å; I215-G217 VanDerWaalsContact C-N 3.32Å; I215-G217 PolarHBondContact O-N 3.45Å; I215-G218 PolarHBondContact O-N 2.83Å; I215-G218 VanDerWaalsContact O-N 3.17Å; I215-I219 HydrophobicContact CG2-CD1 3.91Å; I215-I219 WeakPolarHBondContact O-CG1 3.37Å; I215-I219 PolarHBondContact O-N 3.03Å
216A88.1Confident86.2Confident0 Ų056.7 Ų56.70%033%0.328CS..Hα-helixtrans-60.8-41.3176.800000111.9Y191 C194 R195 K212 T213 I219 G220Y191-A216 HydrophobicContact CD2-CB 3.82Å; Y191-A216 HydrophobicContact CE2-CB 3.95Å; C194-A216 HydrophobicContact CB-CB 3.99Å; R195-A216 HydrophobicContact CG-CB 3.72Å; K212-A216 WeakPolarHBondContact O-CB 3.44Å; K212-A216 PolarHBondContact O-N 2.86Å; T213-A216 PolarHBondContact O-N 3.43Å; A216-I219 PolarHBondContact O-N 2.9Å; A216-G220 PolarHBondContact O-N 3.01Å
217G87.1Confident87.2Confident23 Ų2351.9 Ų51.924%0.23731%0.312CS..Hα-helixtrans-61.4-42.5173.900000112.5T213 V214 I215 G220 G221T213-G217 PolarHBondContact O-N 3.42Å; V214-G217 PolarHBondContact O-N 2.94Å; I215-G217 VanDerWaalsContact C-N 3.32Å; I215-G217 PolarHBondContact O-N 3.45Å; G217-G220 PolarHBondContact O-N 3.49Å; G217-G221 PolarHBondContact O-N 3.28Å
218G88.6Confident88.1Confident23 Ų2346.9 Ų46.924%0.23729%0.285CS..Hα-helixtrans-60.9-45.5174.200000112.7V214 I215 G221 V222V214-G218 PolarHBondContact O-N 2.96Å; I215-G218 PolarHBondContact O-N 2.83Å; I215-G218 VanDerWaalsContact O-N 3.17Å; G218-G221 PolarHBondContact O-N 2.96Å; G218-V222 WeakPolarHBondContact O-CG2 3.24Å; G218-V222 PolarHBondContact O-N 3.47Å
219I89.6Confident88.9Confident74 Ų7446.3 Ų46.338%0.37928%0.282SS..Hα-helixtrans-66.4-39.6177.5-70.9170.9000111.3C194 I215 A216 V222 S223C194-I219 HydrophobicContact CB-CB 4.34Å; C194-I219 HydrophobicContact CB-CD1 4.47Å; C194-I219 HydrophobicContact CB-CG2 4.13Å; C194-I219 WeakPolarHBondContact SG-CD1 3.18Å; I215-I219 HydrophobicContact CG2-CD1 3.91Å; I215-I219 WeakPolarHBondContact O-CG1 3.37Å; I215-I219 PolarHBondContact O-N 3.03Å; A216-I219 PolarHBondContact O-N 2.9Å; I219-V222 PolarHBondContact O-N 2.9Å; I219-S223 VanDerWaalsContact O-CB 3.32Å; I219-S223 WeakPolarHBondContact O-CB 3.23Å; I219-S223 PolarHBondContact O-N 3.43Å; I219-S223 PolarHBondContact O-OG 2.94Å
220G89.5Confident89.5Confident0 Ų045.4 Ų45.40%027%0.27CS..Hα-helixtrans-58.8-46.3171.500000111.9F187 A216 G217 S223 L224F187-G220 WeakPolarHBondContact O-CA 3.15Å; A216-G220 PolarHBondContact O-N 3.01Å; G217-G220 PolarHBondContact O-N 3.49Å; G220-S223 PolarHBondContact O-N 3.37Å; G220-L224 PolarHBondContact O-N 3.5Å
221G89.1Confident90.1Very high9 Ų943.2 Ų43.29%0.09325%0.249CC..Hα-helixtrans-60.3-45.3175.200000113.4G217 G218 L224 W225G217-G221 PolarHBondContact O-N 3.28Å; G218-G221 PolarHBondContact O-N 2.96Å; G221-L224 PolarHBondContact O-N 3.06Å; G221-W225 PolarHBondContact O-N 3.28Å
222V90.6Very high90.4Very high54 Ų5437.1 Ų37.133%0.32722%0.218SC..Hα-helixtrans-64-41.9175.9172.50000110.9G218 I219 W225 V226 I286G218-V222 WeakPolarHBondContact O-CG2 3.24Å; G218-V222 PolarHBondContact O-N 3.47Å; I219-V222 PolarHBondContact O-N 2.9Å; V222-W225 PolarHBondContact O-N 3.28Å; V222-V226 HydrophobicContact CG1-CG2 4.06Å; V222-V226 WeakPolarHBondContact O-CB 3.4Å; V222-V226 VanDerWaalsContact O-CG2 3.26Å; V222-V226 WeakPolarHBondContact O-CG2 3.25Å; V222-V226 PolarHBondContact O-N 2.99Å; V222-I286 HydrophobicContact CG2-CG2 4.46Å
223S90.4Very high90.8Very high41 Ų4133 Ų3329%0.28720%0.2SC..Hα-helixtrans-61.5-45.7178.2-58.50000111.6I219 G220 A227I219-S223 VanDerWaalsContact O-CB 3.32Å; I219-S223 WeakPolarHBondContact O-CB 3.23Å; I219-S223 PolarHBondContact O-N 3.43Å; I219-S223 PolarHBondContact O-OG 2.94Å; G220-S223 PolarHBondContact O-N 3.37Å; S223-A227 VanDerWaalsContact O-CB 3.3Å; S223-A227 WeakPolarHBondContact O-CB 3.23Å; S223-A227 PolarHBondContact O-N 2.92Å
224L92.7Very high91.1Very high30 Ų3031 Ų3116%0.15719%0.188CC..Hα-helixtrans-54.1-55.6171.3169.1157.8000110.3G183 F187 G220 G221 V226 A227 I228G183-L224 WeakPolarHBondContact O-CD1 3.29Å; F187-L224 HydrophobicContact CB-CB 4.01Å; F187-L224 HydrophobicContact CB-CD1 3.77Å; F187-L224 HydrophobicContact CD2-CD1 4.36Å; F187-L224 HydrophobicContact CG-CD1 4.43Å; G220-L224 PolarHBondContact O-N 3.5Å; G221-L224 PolarHBondContact O-N 3.06Å; L224-V226 PolarHBondContact O-N 3.47Å; L224-A227 PolarHBondContact O-N 3.35Å; L224-I228 HydrophobicContact CD2-CD1 3.47Å; L224-I228 VanDerWaalsContact CD2-CD1 3.47Å; L224-I228 HydrophobicContact CD2-CG1 4.27Å; L224-I228 HydrophobicContact CG-CD1 3.91Å; L224-I228 VanDerWaalsContact O-CG1 3.31Å; L224-I228 WeakPolarHBondContact O-CG1 3.26Å; L224-I228 PolarHBondContact O-N 3.36Å
225W92.5Very high91.4Very high33 Ų3325.9 Ų25.913%0.12516%0.157CC..Hα-helixtrans-63.2-45.8-173.9-78.6118.7000111.4G221 V222 A227 I228 F229 L282 T285 R288 T289G221-W225 PolarHBondContact O-N 3.28Å; V222-W225 PolarHBondContact O-N 3.28Å; W225-A227 VanDerWaalsContact C-N 3.31Å; W225-A227 PolarHBondContact O-N 2.97Å; W225-I228 HydrophobicContact CE3-CD1 4.26Å; W225-I228 HydrophobicContact CE3-CG1 4.33Å; W225-I228 HydrophobicContact CZ3-CD1 4.35Å; W225-I228 PolarHBondContact O-N 2.93Å; W225-F229 HydrophobicContact CE3-CD2 4.25Å; W225-F229 WeakPolarHBondContact O-CA 3.45Å; W225-F229 WeakPolarHBondContact O-CB 3.4Å; W225-F229 PolarHBondContact O-N 3.45Å; W225-L282 HydrophobicContact CB-CD1 4.09Å; W225-T285 HydrophobicContact CD2-CG2 3.37Å; W225-T285 VanDerWaalsContact CE2-CG2 3.48Å; W225-T285 HydrophobicContact CE3-CG2 3.49Å; W225-T285 VanDerWaalsContact CE3-CG2 3.49Å; W225-T285 HydrophobicContact CG-CG2 3.98Å; W225-T285 HydrophobicContact CH2-CG2 3.88Å; W225-T285 HydrophobicContact CZ2-CG2 3.77Å; W225-T285 HydrophobicContact CZ3-CG2 3.73Å; W225-R288 VanDerWaalsContact CZ2-NH2 3.25Å; W225-T289 PolarHBondContact NE1-OG1 3.46Å; W225-T289 VanDerWaalsContact NE1-OG1 3.09Å
226V92.8Very high91.6Very high58 Ų5822.1 Ų22.135%0.35214%0.138SC..Hα-helixtrans-61-39.9179.4170.80000111.7V222 L224 Y279 L282V222-V226 HydrophobicContact CG1-CG2 4.06Å; V222-V226 WeakPolarHBondContact O-CB 3.4Å; V222-V226 VanDerWaalsContact O-CG2 3.26Å; V222-V226 WeakPolarHBondContact O-CG2 3.25Å; V222-V226 PolarHBondContact O-N 2.99Å; L224-V226 PolarHBondContact O-N 3.47Å; V226-Y279 HydrophobicContact CG1-CE1 4.4Å; V226-Y279 WeakPolarHBondContact O-CE1 3.48Å; V226-L282 HydrophobicContact CG2-CD2 4.27Å
227A92.8Very high91.6Very high33 Ų3324.1 Ų24.127%0.27315%0.145SC..Hα-helixtrans-70.5-43.8-179.400000112.5F186 S223 L224 W225F186-A227 HydrophobicContact CB-CB 4.08Å; F186-A227 HydrophobicContact CD1-CB 3.82Å; F186-A227 HydrophobicContact CD2-CB 3.47Å; F186-A227 VanDerWaalsContact CD2-CB 3.47Å; F186-A227 HydrophobicContact CE1-CB 4.09Å; F186-A227 HydrophobicContact CE2-CB 3.77Å; F186-A227 HydrophobicContact CG-CB 3.51Å; F186-A227 HydrophobicContact CZ-CB 4.07Å; S223-A227 VanDerWaalsContact O-CB 3.3Å; S223-A227 WeakPolarHBondContact O-CB 3.23Å; S223-A227 PolarHBondContact O-N 2.92Å; L224-A227 PolarHBondContact O-N 3.35Å; W225-A227 VanDerWaalsContact C-N 3.31Å; W225-A227 PolarHBondContact O-N 2.97Å
228I93.5Very high91.6Very high7 Ų723.7 Ų23.74%0.03614%0.137CC..Hα-helixtrans-92.3-12.4-173.677.1-175.5000113.7R179 F186 L224 W225 P230 F231 D232R179-I228 HydrophobicContact CG-CB 4.2Å; R179-I228 HydrophobicContact CG-CD1 3.71Å; R179-I228 HydrophobicContact CG-CG1 4.07Å; F186-I228 HydrophobicContact CD2-CG2 4.46Å; L224-I228 HydrophobicContact CD2-CD1 3.47Å; L224-I228 VanDerWaalsContact CD2-CD1 3.47Å; L224-I228 HydrophobicContact CD2-CG1 4.27Å; L224-I228 HydrophobicContact CG-CD1 3.91Å; L224-I228 VanDerWaalsContact O-CG1 3.31Å; L224-I228 WeakPolarHBondContact O-CG1 3.26Å; L224-I228 PolarHBondContact O-N 3.36Å; W225-I228 HydrophobicContact CE3-CD1 4.26Å; W225-I228 HydrophobicContact CE3-CG1 4.33Å; W225-I228 HydrophobicContact CZ3-CD1 4.35Å; W225-I228 PolarHBondContact O-N 2.93Å; I228-P230 VanDerWaalsContact C-CD 3.47Å; I228-F231 WeakPolarHBondContact O-CB 3.47Å; I228-F231 PolarHBondContact O-N 2.91Å; I228-D232 PolarHBondContact O-N 2.81Å; I228-D232 VanDerWaalsContact O-N 3.16Å
229F94.1Very high91.5Very high0 Ų022.6 Ų22.60%013%0.126CC..Hα-helixtrans-53.6-44.2-173.3-145.1-98.3000114K32 Q36 W225 F231 D232 V233 L278 Y279 R280 L282 T285K32-F229 HydrophobicContact CG-CZ 4.33Å; Q36-F229 HydrophobicContact CG-CE1 4.45Å; Q36-F229 HydrophobicContact CG-CZ 4.44Å; W225-F229 HydrophobicContact CE3-CD2 4.25Å; W225-F229 WeakPolarHBondContact O-CA 3.45Å; W225-F229 WeakPolarHBondContact O-CB 3.4Å; W225-F229 PolarHBondContact O-N 3.45Å; F229-F231 PolarHBondContact O-N 3.47Å; F229-D232 WeakPolarHBondContact O-CA 3.34Å; F229-D232 WeakPolarHBondContact O-CB 3.43Å; F229-D232 PolarHBondContact O-N 3.06Å; F229-V233 HydrophobicContact CD1-CG2 3.8Å; F229-V233 HydrophobicContact CE1-CG2 3.74Å; F229-V233 WeakPolarHBondContact O-CG2 3.29Å; F229-V233 PolarHBondContact O-N 3.02Å; F229-L278 VanDerWaalsContact CD1-O 3.3Å; F229-L278 WeakPolarHBondContact CD1-O 3.23Å; F229-Y279 HydrophobicContact CB-CD1 4.08Å; F229-Y279 HydrophobicContact CB-CE1 4.19Å; F229-Y279 HydrophobicContact CD1-CD1 4.4Å; F229-R280 VanDerWaalsContact CE1-O 3.24Å; F229-R280 WeakPolarHBondContact CE1-O 3.46Å; F229-L282 HydrophobicContact CD1-CB 4.34Å; F229-L282 HydrophobicContact CD2-CB 4.38Å; F229-L282 HydrophobicContact CD2-CD1 3.62Å; F229-L282 HydrophobicContact CE1-CB 4.16Å; F229-L282 HydrophobicContact CE2-CB 4.22Å; F229-L282 HydrophobicContact CE2-CD1 4.05Å; F229-L282 HydrophobicContact CG-CB 4.44Å; F229-L282 HydrophobicContact CG-CD1 4.01Å; F229-L282 HydrophobicContact CZ-CB 4.12Å; F229-T285 HydrophobicContact CE2-CG2 4.14Å; F229-T285 WeakPolarHBondContact CE2-OG1 3.34Å
230P94.6Very high91.2Very high17 Ų1719.2 Ų19.211%0.1111%0.109CC..Hα-helixtrans-55.6-37.6178-28.637.9000113I228 V233 V234 L278 Y279I228-P230 VanDerWaalsContact C-CD 3.47Å; P230-V233 PolarHBondContact O-N 3.27Å; P230-V234 WeakPolarHBondContact O-CG2 3.16Å; P230-V234 PolarHBondContact O-N 2.98Å; P230-L278 HydrophobicContact CB-CB 4.11Å; P230-L278 HydrophobicContact CB-CD1 4.31Å; P230-L278 HydrophobicContact CB-CD2 4.48Å; P230-L278 HydrophobicContact CG-CB 4.33Å; P230-Y279 HydrophobicContact CG-CE1 4.27Å; P230-Y279 HydrophobicContact CG-CE2 4.28Å
231F94Very high90.2Very high62 Ų6222 Ų2227%0.27214%0.137SC..Hα-helixtrans-71.3-36.1176.3-58.2-64.4000112A178 R179 I228 F229 V234 K235 M262A178-F231 HydrophobicContact CB-CB 4.24Å; A178-F231 HydrophobicContact CB-CD1 3.6Å; A178-F231 HydrophobicContact CB-CD2 4.2Å; A178-F231 HydrophobicContact CB-CE1 3.92Å; A178-F231 HydrophobicContact CB-CE2 4.49Å; A178-F231 HydrophobicContact CB-CG 3.75Å; A178-F231 HydrophobicContact CB-CZ 4.36Å; A178-F231 WeakPolarHBondContact O-CD2 3.28Å; R179-F231 HydrophobicContact CB-CB 4.42Å; I228-F231 WeakPolarHBondContact O-CB 3.47Å; I228-F231 PolarHBondContact O-N 2.91Å; F229-F231 PolarHBondContact O-N 3.47Å; F231-V234 PolarHBondContact O-N 3.41Å; F231-K235 WeakPolarHBondContact O-CB 3.45Å; F231-K235 PolarHBondContact O-N 3.24Å; F231-M262 HydrophobicContact CD1-SD 3.62Å; F231-M262 HydrophobicContact CE1-SD 3.92Å
232D93.6Very high88.6Confident0 Ų022.5 Ų22.50%014%0.137CC..Hα-helixtrans-63.3-41.5174.1-161.357.9000111.2K32 Q36 R179 I228 F229 K235 S236K32-D232 WeakPolarHBondContact CE-OD2 3.47Å; K32-D232 IonicContact NZ-OD1 3.69Å; K32-D232 IonicContact NZ-OD2 3.79Å; K32-D232 PolarHBondContact NZ-OD2 3.3Å; Q36-D232 PolarHBondContact NE2-OD2 3.21Å; R179-D232 VanDerWaalsContact CD-OD1 3.26Å; R179-D232 WeakPolarHBondContact CD-OD1 3.42Å; R179-D232 IonicContact CZ-OD1 3.08Å; R179-D232 IonicContact NE-OD1 3.43Å; R179-D232 IonicContact NH1-OD1 3.4Å; R179-D232 PolarHBondContact NH1-OD1 3.16Å; I228-D232 PolarHBondContact O-N 2.81Å; I228-D232 VanDerWaalsContact O-N 3.16Å; F229-D232 WeakPolarHBondContact O-CA 3.34Å; F229-D232 WeakPolarHBondContact O-CB 3.43Å; F229-D232 PolarHBondContact O-N 3.06Å; D232-K235 PolarHBondContact O-N 3.18Å; D232-K235 IonicContact OD1-NZ 2.68Å; D232-K235 PolarHBondContact OD1-NZ 3.47Å; D232-S236 PolarHBondContact O-N 2.93Å; D232-S236 PolarHBondContact O-OG 3.33Å
233V93.4Very high86.7Confident0 Ų020.2 Ų20.20%012%0.122CC..Hα-helixtrans-61.4-49.9174-1790000111.2Q36 F229 P230 K235 S236 R237 I269 L278Q36-V233 HydrophobicContact CG-CG2 4.05Å; F229-V233 HydrophobicContact CD1-CG2 3.8Å; F229-V233 HydrophobicContact CE1-CG2 3.74Å; F229-V233 WeakPolarHBondContact O-CG2 3.29Å; F229-V233 PolarHBondContact O-N 3.02Å; P230-V233 PolarHBondContact O-N 3.27Å; V233-K235 VanDerWaalsContact C-N 3.3Å; V233-K235 PolarHBondContact O-N 2.83Å; V233-S236 PolarHBondContact O-N 2.86Å; V233-R237 HydrophobicContact CG1-CG 4.45Å; V233-R237 VanDerWaalsContact O-CG 3.31Å; V233-R237 WeakPolarHBondContact O-CG 3.49Å; V233-R237 PolarHBondContact O-N 3.45Å; V233-I269 HydrophobicContact CG1-CD1 4.04Å; V233-L278 VanDerWaalsContact CG2-O 3.23Å; V233-L278 WeakPolarHBondContact CG2-O 3.28Å
234V92.6Very high84.5Confident0 Ų021.6 Ų21.60%013%0.129CC..Hα-helixtrans-60.2-43.4179.3170.90000110.9A175 P230 F231 R237 M238 M262 V265 L266 I269 L278A175-V234 HydrophobicContact CB-CG1 4.42Å; P230-V234 WeakPolarHBondContact O-CG2 3.16Å; P230-V234 PolarHBondContact O-N 2.98Å; F231-V234 PolarHBondContact O-N 3.41Å; V234-R237 PolarHBondContact O-N 2.89Å; V234-M238 HydrophobicContact CG1-CG 4.27Å; V234-M238 HydrophobicContact CG1-SD 3.82Å; V234-M238 WeakPolarHBondContact O-CB 3.18Å; V234-M238 VanDerWaalsContact O-CG 3.27Å; V234-M238 WeakPolarHBondContact O-CG 3.48Å; V234-M238 PolarHBondContact O-N 3.24Å; V234-M262 HydrophobicContact CB-CG 4.41Å; V234-M262 HydrophobicContact CG1-CB 4.27Å; V234-M262 HydrophobicContact CG1-CG 3.46Å; V234-M262 VanDerWaalsContact CG1-CG 3.46Å; V234-V265 HydrophobicContact CB-CG1 4.47Å; V234-V265 HydrophobicContact CG1-CB 3.96Å; V234-V265 HydrophobicContact CG1-CG1 3.9Å; V234-V265 HydrophobicContact CG2-CG1 4.45Å; V234-L266 HydrophobicContact CG2-CB 3.94Å; V234-L266 HydrophobicContact CG2-CD1 3.81Å; V234-I269 HydrophobicContact CG2-CD1 4.15Å; V234-L278 HydrophobicContact CG2-CD2 4.42Å
235K92.2Very high82.2Confident1 Ų120.4 Ų20.40%0.00412%0.124CC..Hα-helixtrans-58.5-51.6177.1-171.8-155.973.3178.70111.2E126 A175 F231 D232 V233 R237 M238 Q239E126-K235 IonicContact OE1-NZ 3.86Å; E126-K235 PolarHBondContact OE1-NZ 2.9Å; E126-K235 WeakPolarHBondContact OE2-CD 3.49Å; E126-K235 IonicContact OE2-NZ 2.87Å; E126-K235 PolarHBondContact OE2-NZ 3.28Å; A175-K235 HydrophobicContact CB-CB 3.62Å; A175-K235 HydrophobicContact CB-CG 4.09Å; F231-K235 WeakPolarHBondContact O-CB 3.45Å; F231-K235 PolarHBondContact O-N 3.24Å; D232-K235 PolarHBondContact O-N 3.18Å; D232-K235 IonicContact OD1-NZ 2.68Å; D232-K235 PolarHBondContact OD1-NZ 3.47Å; V233-K235 VanDerWaalsContact C-N 3.3Å; V233-K235 PolarHBondContact O-N 2.83Å; K235-R237 VanDerWaalsContact C-N 3.33Å; K235-R237 PolarHBondContact O-N 3.23Å; K235-M238 PolarHBondContact O-N 2.97Å; K235-Q239 VanDerWaalsContact CE-OE1 3.31Å; K235-Q239 HydrophobicContact CG-CG 4.41Å; K235-Q239 WeakPolarHBondContact O-CB 3.15Å; K235-Q239 VanDerWaalsContact O-CG 3.29Å; K235-Q239 WeakPolarHBondContact O-CG 3.49Å; K235-Q239 PolarHBondContact O-N 3.26Å
236S91Very high79.8Confident0 Ų021.4 Ų21.40%013%0.133CC..Hα-helixtrans-60.4-40.9178.8-68.50000112.2Q36 D232 V233 Q239 I240Q36-S236 PolarHBondContact OE1-OG 2.95Å; D232-S236 PolarHBondContact O-N 2.93Å; D232-S236 PolarHBondContact O-OG 3.33Å; V233-S236 PolarHBondContact O-N 2.86Å; S236-Q239 PolarHBondContact O-N 3.17Å; S236-I240 WeakPolarHBondContact O-CB 3.45Å; S236-I240 WeakPolarHBondContact O-CG1 3.36Å; S236-I240 PolarHBondContact O-N 2.85Å; S236-I240 VanDerWaalsContact O-N 3.12Å
237R89Confident77.2Confident42 Ų4224 Ų2416%0.15815%0.154CC..Hα-helixtrans-63.1-42.2174.7-69.6-73.3180126.525112.8Q36 T37 P39 V233 V234 K235 G241 V265 I269 E273Q36-R237 PolarHBondContact O-NE 2.64Å; Q36-R237 PolarHBondContact O-NH2 3.45Å; T37-R237 VanDerWaalsContact O-CZ 3.23Å; T37-R237 PolarHBondContact O-NE 3.48Å; T37-R237 PolarHBondContact O-NH1 2.97Å; P39-R237 VanDerWaalsContact CD-CZ 3.4Å; P39-R237 VanDerWaalsContact CD-NH1 3.34Å; V233-R237 HydrophobicContact CG1-CG 4.45Å; V233-R237 VanDerWaalsContact O-CG 3.31Å; V233-R237 WeakPolarHBondContact O-CG 3.49Å; V233-R237 PolarHBondContact O-N 3.45Å; V234-R237 PolarHBondContact O-N 2.89Å; K235-R237 VanDerWaalsContact C-N 3.33Å; K235-R237 PolarHBondContact O-N 3.23Å; R237-G241 PolarHBondContact O-N 3.38Å; R237-V265 HydrophobicContact CB-CG1 4.02Å; R237-I269 HydrophobicContact CG-CD1 4.08Å; R237-E273 IonicContact CZ-OE1 2.78Å; R237-E273 IonicContact CZ-OE2 3.76Å; R237-E273 IonicContact NH1-OE1 3.34Å; R237-E273 PolarHBondContact NH1-OE1 3.4Å; R237-E273 IonicContact NH1-OE2 3.67Å; R237-E273 IonicContact NH2-OE1 2.84Å; R237-E273 PolarHBondContact NH2-OE1 3.08Å; R237-E273 IonicContact NH2-OE2 3.94Å; R237-E273 PolarHBondContact NH2-OE2 3.35Å
238M87.4Confident74.5Confident13 Ų1325.4 Ų25.46%0.06416%0.162CC..Hα-helixtrans-65.4-45.5176.9-72.8178.36800111.7C171 A175 V234 K235 I240 H242 R260 M262 V265C171-M238 PolarHBondContact SG-O 3.26Å; C171-M238 VanDerWaalsContact SG-O 3.4Å; A175-M238 HydrophobicContact CB-SD 4.36Å; V234-M238 HydrophobicContact CG1-CG 4.27Å; V234-M238 HydrophobicContact CG1-SD 3.82Å; V234-M238 WeakPolarHBondContact O-CB 3.18Å; V234-M238 VanDerWaalsContact O-CG 3.27Å; V234-M238 WeakPolarHBondContact O-CG 3.48Å; V234-M238 PolarHBondContact O-N 3.24Å; K235-M238 PolarHBondContact O-N 2.97Å; M238-I240 VanDerWaalsContact C-N 3.27Å; M238-I240 PolarHBondContact O-N 3.37Å; M238-H242 WeakPolarHBondContact O-CB 3.4Å; M238-H242 PolarHBondContact O-N 2.85Å; M238-R260 WeakPolarHBondContact CE-O 3.3Å; M238-M262 HydrophobicContact SD-CB 4.14Å; M238-V265 HydrophobicContact CG-CB 4.31Å; M238-V265 HydrophobicContact CG-CG1 4.37Å; M238-V265 HydrophobicContact CG-CG2 3.82Å; M238-V265 HydrophobicContact SD-CG2 4.5Å
239Q86.8Confident71.8Confident0 Ų029.6 Ų29.60%019%0.192CC..Hα-helixtrans-65.3-30.4-177.2-75.1178.2-30.500112.7L127 C130 K235 S236L127-Q239 HydrophobicContact CB-CG 4.26Å; L127-Q239 HydrophobicContact CD1-CB 3.61Å; L127-Q239 HydrophobicContact CD1-CG 3.76Å; L127-Q239 VanDerWaalsContact CD1-O 3.24Å; L127-Q239 WeakPolarHBondContact CD1-O 3.46Å; C130-Q239 HydrophobicContact CB-CB 4.32Å; C130-Q239 PolarHBondContact SG-OE1 2.87Å; K235-Q239 VanDerWaalsContact CE-OE1 3.31Å; K235-Q239 HydrophobicContact CG-CG 4.41Å; K235-Q239 WeakPolarHBondContact O-CB 3.15Å; K235-Q239 VanDerWaalsContact O-CG 3.29Å; K235-Q239 WeakPolarHBondContact O-CG 3.49Å; K235-Q239 PolarHBondContact O-N 3.26Å; S236-Q239 PolarHBondContact O-N 3.17Å
240I82.7Confident68.9Low4 Ų437.8 Ų37.82%0.02123%0.234CC..Hα-helixtrans-93.4-44.6-179.9-68.8162.7000112.1V33 T37 F38 C130 S134 M138 S236 M238 H242V33-I240 HydrophobicContact CG1-CD1 3.9Å; T37-I240 HydrophobicContact CG2-CB 3.63Å; T37-I240 HydrophobicContact CG2-CD1 3.39Å; T37-I240 HydrophobicContact CG2-CG1 4.08Å; T37-I240 HydrophobicContact CG2-CG2 3.46Å; T37-I240 VanDerWaalsContact CG2-CG2 3.46Å; T37-I240 WeakPolarHBondContact OG1-CD1 3.48Å; F38-I240 HydrophobicContact CE1-CG2 4.45Å; F38-I240 HydrophobicContact CZ-CG2 3.91Å; C130-I240 HydrophobicContact CB-CD1 4.14Å; C130-I240 HydrophobicContact CB-CG1 4.24Å; S134-I240 VanDerWaalsContact OG-CD1 3.24Å; S134-I240 WeakPolarHBondContact OG-CD1 3.29Å; S134-I240 WeakPolarHBondContact OG-CG1 3.35Å; M138-I240 HydrophobicContact CG-CG2 3.75Å; M138-I240 HydrophobicContact SD-CB 4.45Å; M138-I240 HydrophobicContact SD-CG2 3.51Å; M138-I240 VanDerWaalsContact SD-CG2 3.51Å; S236-I240 WeakPolarHBondContact O-CB 3.45Å; S236-I240 WeakPolarHBondContact O-CG1 3.36Å; S236-I240 PolarHBondContact O-N 2.85Å; S236-I240 VanDerWaalsContact O-N 3.12Å; M238-I240 VanDerWaalsContact C-N 3.27Å; M238-I240 PolarHBondContact O-N 3.37Å; I240-H242 VanDerWaalsContact C-N 3.31Å; I240-H242 PolarHBondContact O-N 2.92Å
241G67.9Low66.1Low58 Ų5841 Ų4160%0.59826%0.261SS*.Hα-helixtrans-73.4-14.7-174.400000115.4R237R237-G241 PolarHBondContact O-N 3.38Å
242H55Low63Low20 Ų2045.2 Ų45.29%0.09328%0.282CS..THydrogen-bonded Turntrans-87.5-18.6-174.1-165.9-129.5000114.2K164 C171 M238 I240 S257 Q259K164-H242 PolarHBondContact NZ-CE1 3.43Å; K164-H242 PolarHBondContact NZ-ND1 2.74Å; K164-H242 PolarHBondContact NZ-NE2 3.47Å; K164-H242 PolarHBondContact NZ-O 2.95Å; C171-H242 VanDerWaalsContact SG-CB 3.52Å; C171-H242 PolarHBondContact SG-ND1 3.12Å; M238-H242 WeakPolarHBondContact O-CB 3.4Å; M238-H242 PolarHBondContact O-N 2.85Å; I240-H242 VanDerWaalsContact C-N 3.31Å; I240-H242 PolarHBondContact O-N 2.92Å; H242-S257 PolarHBondContact CD2-OG 3.37Å; H242-S257 PolarHBondContact NE2-O 3.26Å; H242-S257 PolarHBondContact O-OG 2.99Å; H242-Q259 VanDerWaalsContact NE2-CA 3.31Å; H242-Q259 WeakPolarHBondContact NE2-CA 3.25Å; H242-Q259 PolarHBondContact NE2-N 2.95Å
243H51.7Low60Low5 Ų548.9 Ų48.92%0.02332%0.32CS..  trans-126.8104-168.8-68.9-96.6000112.6K131 G168 V245K131-H243 VanDerWaalsContact CE-CD2 3.47Å; K131-H243 WeakPolarHBondContact CE-CD2 3.45Å; K131-H243 PolarHBondContact NZ-CD2 2.91Å; K131-H243 PolarHBondContact NZ-ND1 3.21Å; G168-H243 PolarHBondContact O-CE1 3.39Å; G168-H243 PolarHBondContact O-NE2 3.47Å; G168-H243 VanDerWaalsContact O-NE2 3.12Å; H243-V245 PolarHBondContact O-N 3.04Å
244T43.8Very low57.2Low70 Ų7055.1 Ų55.143%0.42935%0.353SS..  trans-67.694.1159.939.70000107.9H143 T246H143-T244 WeakPolarHBondContact O-CG2 3.47Å; T244-T246 WeakPolarHBondContact CB-OG1 3.49Å; T244-T246 PolarHBondContact O-N 2.74Å; T244-T246 PolarHBondContact O-OG1 3.16Å
245V45.2Very low54.4Low6 Ų664.5 Ų64.54%0.03639%0.394CS..  trans-61.284170.4-179.80000107.7I144 V146 L151 H243I144-V245 HydrophobicContact CD1-CB 3.65Å; I144-V245 HydrophobicContact CD1-CG2 3.56Å; I144-V245 HydrophobicContact CG1-CB 3.95Å; I144-V245 HydrophobicContact CG1-CG2 4.33Å; I144-V245 HydrophobicContact CG2-CB 3.97Å; I144-V245 WeakPolarHBondContact CG2-O 2.95Å; V146-V245 HydrophobicContact CG2-CG1 4.23Å; V146-V245 WeakPolarHBondContact CG2-O 3.41Å; L151-V245 HydrophobicContact CD2-CG1 3.91Å; H243-V245 PolarHBondContact O-N 3.04Å
246T41.9Very low52Low53 Ų5370.9 Ų70.933%0.32543%0.433SS..  trans-107.2122.4-170.9-24.60000108.7T244 S248 S249T244-T246 WeakPolarHBondContact CB-OG1 3.49Å; T244-T246 PolarHBondContact O-N 2.74Å; T244-T246 PolarHBondContact O-OG1 3.16Å; T246-S248 VanDerWaalsContact CG2-N 3.32Å; T246-S249 VanDerWaalsContact CG2-N 3.33Å
247S37.4Very low50.2Low112 Ų11273.6 Ų73.678%0.78345%0.452SS*.SBendtrans-85.714.7151.4-70.10000111.7
248S35.8Very low48.7Very low64 Ų6480.6 Ų80.645%0.44848%0.483SS..  trans-15038-174.6-47.80000114T246 I250 A251T246-S248 VanDerWaalsContact CG2-N 3.32Å; S248-I250 PolarHBondContact O-N 3.34Å; S248-A251 PolarHBondContact O-N 2.9Å
249S37.7Very low47.6Very low95 Ų9583.8 Ų83.866%0.66450%0.498SS*.THydrogen-bonded Turntrans-66.68.9167.4177.50000113.1T246T246-S249 VanDerWaalsContact CG2-N 3.33Å
250I33.2Very low47.1Very low172 Ų17291 Ų9188%0.88253%0.526SS*.THydrogen-bonded Turntrans-85.4-22.6175.4-59.6-179000111.6S248S248-I250 PolarHBondContact O-N 3.34Å
251A34.8Very low47.2Very low83 Ų8394 Ų9469%0.68655%0.547SS*.SBendtrans-98.3-9.7-170.100000116.3S248S248-A251 PolarHBondContact O-N 2.9Å
252H28.9Very low48.1Very low151 Ų15192.5 Ų92.570%0.69952%0.524SS*.  trans-14496173.4-11647.1000109.8N254H252-N254 PolarHBondContact O-N 3.3Å
253G31.9Very low49.8Very low78 Ų7897.8 Ų97.880%0.80455%0.547SS*.  trans-59.299.3169.500000109.3
254N33.8Very low51.5Low130 Ų13099.6 Ų99.670%0.69556%0.56SS**  trans-140.6111.8173.4-93.1-31.1000109.5H252H252-N254 PolarHBondContact O-N 3.3Å
255K34.2Very low53.6Low197 Ų19796.9 Ų96.986%0.85754%0.543SS*.  trans7.3118.1165-66.2175.4179.6174.90115S257K255-S257 PolarHBondContact O-N 3.47Å
256V42.5Very low55.8Low135 Ų13598.8 Ų98.882%0.81855%0.553SS**  trans-41107.3159.7176.30000107.8K258V256-K258 PolarHBondContact O-N 2.99Å
257S52.3Low58.2Low58 Ų58101.5 Ų101.541%0.40657%0.565SS.*  trans-62.9112.9178.858.30000106.5H242 K255 Q259H242-S257 PolarHBondContact CD2-OG 3.37Å; H242-S257 PolarHBondContact NE2-O 3.26Å; H242-S257 PolarHBondContact O-OG 2.99Å; K255-S257 PolarHBondContact O-N 3.47Å; S257-Q259 PolarHBondContact O-N 3.39Å
258K57.3Low60.6Low188 Ų18899.1 Ų99.182%0.81754%0.544SS*.  trans-56.2134.8174.6-172.5174.3-179.9177.70107.4V256 R260V256-K258 PolarHBondContact O-N 2.99Å; K258-R260 PolarHBondContact O-N 3.42Å
259Q65.2Low63.2Low80 Ų8096.3 Ų96.337%0.37452%0.524SS..  trans-54.3116175-178.6174.2-3400108.3T170 H242 S257T170-Q259 PolarHBondContact O-NE2 2.92Å; H242-Q259 VanDerWaalsContact NE2-CA 3.31Å; H242-Q259 WeakPolarHBondContact NE2-CA 3.25Å; H242-Q259 PolarHBondContact NE2-N 2.95Å; S257-Q259 PolarHBondContact O-N 3.39Å
260R75.7Confident65.7Low153 Ų15398.2 Ų98.258%0.57752%0.52SS*.  trans-66.2144.5178.5-63.5-166.7-160.1-174.18.5108.9M238 K258 V265 D268M238-R260 WeakPolarHBondContact CE-O 3.3Å; K258-R260 PolarHBondContact O-N 3.42Å; R260-V265 HydrophobicContact CB-CG2 3.79Å; R260-D268 IonicContact NH1-OD2 3.81Å; R260-D268 PolarHBondContact NH1-OD2 2.86Å
261S84.4Confident68.4Low66 Ų66100.5 Ų100.546%0.46252%0.517SS..  trans-70.7145.2172.2177.60000109.5F263 S264 V265S261-F263 PolarHBondContact O-N 3.46Å; S261-S264 PolarHBondContact N-OG 2.96Å; S261-S264 PolarHBondContact O-N 2.93Å; S261-S264 PolarHBondContact O-OG 3.37Å; S261-V265 PolarHBondContact O-N 3.48Å; S261-V265 VanDerWaalsContact O-N 3.11Å
262M88.4Confident71.1Confident26 Ų26102.1 Ų102.113%0.12852%0.515CS..Hα-helixtrans-50.8-44.7173.1-176.8-157.7-34.600111.2G174 A175 A178 F231 V234 M238 S264 V265 L266G174-M262 WeakPolarHBondContact O-CE 3.27Å; A175-M262 HydrophobicContact CB-CE 4.24Å; A175-M262 HydrophobicContact CB-CG 4.01Å; A175-M262 HydrophobicContact CB-SD 4.28Å; A175-M262 VanDerWaalsContact N-CE 3.34Å; A178-M262 HydrophobicContact CB-CE 3.91Å; A178-M262 HydrophobicContact CB-SD 4.04Å; F231-M262 HydrophobicContact CD1-SD 3.62Å; F231-M262 HydrophobicContact CE1-SD 3.92Å; V234-M262 HydrophobicContact CB-CG 4.41Å; V234-M262 HydrophobicContact CG1-CB 4.27Å; V234-M262 HydrophobicContact CG1-CG 3.46Å; V234-M262 VanDerWaalsContact CG1-CG 3.46Å; M238-M262 HydrophobicContact SD-CB 4.14Å; M262-S264 VanDerWaalsContact C-N 3.34Å; M262-S264 PolarHBondContact O-N 3.28Å; M262-V265 PolarHBondContact O-N 3.4Å; M262-L266 WeakPolarHBondContact O-CB 3.5Å; M262-L266 PolarHBondContact O-N 2.93Å
263F89Confident73.9Confident132 Ų13297.9 Ų97.958%0.57950%0.495SS*.Hα-helixtrans-60.6-43.6178.7-67.6-77.7000111.7S261 V265 L266 L267S261-F263 PolarHBondContact O-N 3.46Å; F263-V265 VanDerWaalsContact C-N 3.32Å; F263-V265 PolarHBondContact O-N 3.35Å; F263-L266 PolarHBondContact O-N 3.31Å; F263-L267 HydrophobicContact CB-CD1 4.41Å; F263-L267 WeakPolarHBondContact O-CB 3.5Å; F263-L267 WeakPolarHBondContact O-CD1 3.35Å; F263-L267 PolarHBondContact O-N 3.43Å
264S87.3Confident76.6Confident42 Ų4295.5 Ų95.529%0.29447%0.471SS..Hα-helixtrans-60.7-41.717758.20000112.2S261 M262 L267 D268S261-S264 PolarHBondContact N-OG 2.96Å; S261-S264 PolarHBondContact O-N 2.93Å; S261-S264 PolarHBondContact O-OG 3.37Å; M262-S264 VanDerWaalsContact C-N 3.34Å; M262-S264 PolarHBondContact O-N 3.28Å; S264-L267 PolarHBondContact O-N 3.26Å; S264-D268 WeakPolarHBondContact O-CB 3.44Å; S264-D268 PolarHBondContact O-N 3.37Å
265V88.8Confident79.4Confident13 Ų1394.3 Ų94.38%0.07946%0.463CS..Hα-helixtrans-68.7-40.7177.7176.60000111.4V234 R237 M238 R260 S261 M262 F263 D268 I269V234-V265 HydrophobicContact CB-CG1 4.47Å; V234-V265 HydrophobicContact CG1-CB 3.96Å; V234-V265 HydrophobicContact CG1-CG1 3.9Å; V234-V265 HydrophobicContact CG2-CG1 4.45Å; R237-V265 HydrophobicContact CB-CG1 4.02Å; M238-V265 HydrophobicContact CG-CB 4.31Å; M238-V265 HydrophobicContact CG-CG1 4.37Å; M238-V265 HydrophobicContact CG-CG2 3.82Å; M238-V265 HydrophobicContact SD-CG2 4.5Å; R260-V265 HydrophobicContact CB-CG2 3.79Å; S261-V265 PolarHBondContact O-N 3.48Å; S261-V265 VanDerWaalsContact O-N 3.11Å; M262-V265 PolarHBondContact O-N 3.4Å; F263-V265 VanDerWaalsContact C-N 3.32Å; F263-V265 PolarHBondContact O-N 3.35Å; V265-D268 PolarHBondContact O-N 3.04Å; V265-I269 HydrophobicContact CG1-CD1 4.05Å; V265-I269 HydrophobicContact CG1-CG1 4.46Å; V265-I269 VanDerWaalsContact O-CG1 3.26Å; V265-I269 WeakPolarHBondContact O-CG1 3.09Å; V265-I269 PolarHBondContact O-N 3.48Å
266L91.4Very high82.1Confident46 Ų4695.4 Ų95.424%0.24146%0.462CS..Hα-helixtrans-59.7-47175-177.571.1000111.7V234 M262 F263 I269 K270 L278V234-L266 HydrophobicContact CG2-CB 3.94Å; V234-L266 HydrophobicContact CG2-CD1 3.81Å; M262-L266 WeakPolarHBondContact O-CB 3.5Å; M262-L266 PolarHBondContact O-N 2.93Å; F263-L266 PolarHBondContact O-N 3.31Å; L266-I269 PolarHBondContact O-N 2.65Å; L266-K270 WeakPolarHBondContact O-CB 3.44Å; L266-K270 PolarHBondContact O-N 3.14Å; L266-L278 HydrophobicContact CD1-CD1 3.8Å; L266-L278 HydrophobicContact CD1-CD2 3.75Å; L266-L278 HydrophobicContact CD1-CG 4.46Å
267L91.6Very high84.3Confident111 Ų11189 Ų8958%0.58142%0.423SS*.Hα-helixtrans-64-42.4177-87.6129.9000111.6F263 S264 K270 R271F263-L267 HydrophobicContact CB-CD1 4.41Å; F263-L267 WeakPolarHBondContact O-CB 3.5Å; F263-L267 WeakPolarHBondContact O-CD1 3.35Å; F263-L267 PolarHBondContact O-N 3.43Å; S264-L267 PolarHBondContact O-N 3.26Å; L267-K270 PolarHBondContact O-N 3.47Å; L267-R271 VanDerWaalsContact O-CB 3.26Å; L267-R271 WeakPolarHBondContact O-CB 3.41Å; L267-R271 PolarHBondContact O-N 2.84Å
268D89.1Confident86.3Confident61 Ų6186.5 Ų86.533%0.32641%0.405SS..Hα-helixtrans-60.2-46.2175.8-74.2-13.8000111.3R260 S264 V265 R271 N272R260-D268 IonicContact NH1-OD2 3.81Å; R260-D268 PolarHBondContact NH1-OD2 2.86Å; S264-D268 WeakPolarHBondContact O-CB 3.44Å; S264-D268 PolarHBondContact O-N 3.37Å; V265-D268 PolarHBondContact O-N 3.04Å; D268-R271 PolarHBondContact O-N 3.39Å; D268-N272 VanDerWaalsContact O-CB 3.28Å; D268-N272 WeakPolarHBondContact O-CB 3.37Å; D268-N272 PolarHBondContact O-N 3.18Å; D268-N272 PolarHBondContact O-ND2 3.43Å; D268-N272 VanDerWaalsContact O-ND2 3.13Å
269I89.5Confident88Confident6 Ų682 Ų823%0.03138%0.384CS..Hα-helixtrans-63.3-47.7177.4-65170.8000110.1V233 V234 R237 V265 L266 R271 E273 G274 L278V233-I269 HydrophobicContact CG1-CD1 4.04Å; V234-I269 HydrophobicContact CG2-CD1 4.15Å; R237-I269 HydrophobicContact CG-CD1 4.08Å; V265-I269 HydrophobicContact CG1-CD1 4.05Å; V265-I269 HydrophobicContact CG1-CG1 4.46Å; V265-I269 VanDerWaalsContact O-CG1 3.26Å; V265-I269 WeakPolarHBondContact O-CG1 3.09Å; V265-I269 PolarHBondContact O-N 3.48Å; L266-I269 PolarHBondContact O-N 2.65Å; I269-R271 VanDerWaalsContact C-N 3.31Å; I269-R271 PolarHBondContact O-N 2.78Å; I269-E273 HydrophobicContact CG2-CB 4.31Å; I269-E273 CarbonylContact O-C 3.54Å; I269-E273 WeakPolarHBondContact O-CA 3.37Å; I269-E273 WeakPolarHBondContact O-CB 3.39Å; I269-E273 PolarHBondContact O-N 3.29Å; I269-G274 PolarHBondContact O-N 3.08Å; I269-L278 HydrophobicContact CB-CD2 4.06Å; I269-L278 HydrophobicContact CD1-CD2 4.06Å; I269-L278 HydrophobicContact CG2-CD2 3.6Å; I269-L278 HydrophobicContact CG2-CG 4Å
270K90.8Very high89.3Confident135 Ų13581.6 Ų81.659%0.58738%0.379SS*.Hα-helixtrans-59.5-42179.5-176.4-175.3175.2-174.10111.7L266 L267 G274 I275L266-K270 WeakPolarHBondContact O-CB 3.44Å; L266-K270 PolarHBondContact O-N 3.14Å; L267-K270 PolarHBondContact O-N 3.47Å; K270-G274 WeakPolarHBondContact O-CA 3.49Å; K270-G274 PolarHBondContact O-N 2.9Å; K270-I275 HydrophobicContact CG-CD1 4.47Å
271R90.5Very high90Very high219 Ų21974.5 Ų74.583%0.82635%0.354SS*.Hα-helixtrans-75.4-42.2-176.8-178.8177.1169.8170.4-1.7112.9L267 D268 I269L267-R271 VanDerWaalsContact O-CB 3.26Å; L267-R271 WeakPolarHBondContact O-CB 3.41Å; L267-R271 PolarHBondContact O-N 2.84Å; D268-R271 PolarHBondContact O-N 3.39Å; I269-R271 VanDerWaalsContact C-N 3.31Å; I269-R271 PolarHBondContact O-N 2.78Å
272N90Very high90.4Very high118 Ų11872.8 Ų72.863%0.63134%0.339SS*.Hα-helixtrans-96.6-33.1-171.1-59.2-38.2000113.3D268D268-N272 VanDerWaalsContact O-CB 3.28Å; D268-N272 WeakPolarHBondContact O-CB 3.37Å; D268-N272 PolarHBondContact O-N 3.18Å; D268-N272 PolarHBondContact O-ND2 3.43Å; D268-N272 VanDerWaalsContact O-ND2 3.13Å
273E88.2Confident90.6Very high61 Ų6173.8 Ų73.829%0.28536%0.356SS..THydrogen-bonded Turntrans-114.3-12.9-174.8-52.8-178.2-168.300112.9R237 I269 S277R237-E273 IonicContact CZ-OE1 2.78Å; R237-E273 IonicContact CZ-OE2 3.76Å; R237-E273 IonicContact NH1-OE1 3.34Å; R237-E273 PolarHBondContact NH1-OE1 3.4Å; R237-E273 IonicContact NH1-OE2 3.67Å; R237-E273 IonicContact NH2-OE1 2.84Å; R237-E273 PolarHBondContact NH2-OE1 3.08Å; R237-E273 IonicContact NH2-OE2 3.94Å; R237-E273 PolarHBondContact NH2-OE2 3.35Å; I269-E273 HydrophobicContact CG2-CB 4.31Å; I269-E273 CarbonylContact O-C 3.54Å; I269-E273 WeakPolarHBondContact O-CA 3.37Å; I269-E273 WeakPolarHBondContact O-CB 3.39Å; I269-E273 PolarHBondContact O-N 3.29Å; E273-S277 WeakPolarHBondContact OE2-CB 3.44Å; E273-S277 PolarHBondContact OE2-OG 2.85Å
274G88.8Confident90.7Very high28 Ų2867.7 Ų67.729%0.28933%0.33SS..  trans80.9165.8-177.100000114.3I269 K270 R276 S277I269-G274 PolarHBondContact O-N 3.08Å; K270-G274 WeakPolarHBondContact O-CA 3.49Å; K270-G274 PolarHBondContact O-N 2.9Å; G274-R276 PolarHBondContact O-N 3.42Å; G274-S277 WeakPolarHBondContact O-CB 3.29Å; G274-S277 PolarHBondContact O-N 2.92Å; G274-S277 VanDerWaalsContact O-N 3.11Å
275I91.8Very high91Very high106 Ų10665.7 Ų65.754%0.54432%0.316SS..G310 helixtrans-62-30.7-175.3-160.177.6000113K270 S277 L278K270-I275 HydrophobicContact CG-CD1 4.47Å; I275-S277 PolarHBondContact O-N 3.21Å; I275-L278 HydrophobicContact CD1-CD1 3.65Å; I275-L278 HydrophobicContact CG1-CD1 4.38Å; I275-L278 WeakPolarHBondContact O-CB 3.36Å; I275-L278 PolarHBondContact O-N 2.97Å; I275-L278 VanDerWaalsContact O-N 3.13Å
276R91.3Very high91.1Very high219 Ų21967.3 Ų67.383%0.82632%0.323SS*.G310 helixtrans-63.3-27.3178.9-170.9177179.3-179.91.2112.2G274 L278 Y279G274-R276 PolarHBondContact O-N 3.42Å; R276-L278 PolarHBondContact O-N 3.47Å; R276-Y279 PolarHBondContact O-N 3.24Å; R276-Y279 VanDerWaalsContact O-N 3.14Å
277S89.6Confident91.1Very high1 Ų170.3 Ų70.31%0.00734%0.339CS..G310 helixtrans-64.8-29.4177.8-160.60000112.4E273 G274 I275 Y279 R280E273-S277 WeakPolarHBondContact OE2-CB 3.44Å; E273-S277 PolarHBondContact OE2-OG 2.85Å; G274-S277 WeakPolarHBondContact O-CB 3.29Å; G274-S277 PolarHBondContact O-N 2.92Å; G274-S277 VanDerWaalsContact O-N 3.11Å; I275-S277 PolarHBondContact O-N 3.21Å; S277-Y279 PolarHBondContact O-N 3.47Å; S277-R280 WeakPolarHBondContact O-CB 3.3Å; S277-R280 PolarHBondContact O-N 3.2Å; S277-R280 VanDerWaalsContact O-N 3.14Å; S277-R280 WeakPolarHBondContact OG-CD 3.21Å
278L92.9Very high91.1Very high6 Ų667 Ų673%0.03132%0.319CS..G310 helixtrans-66.8-5.8175.4-62.2173.6000114.1F229 P230 V233 V234 L266 I269 I275 R276F229-L278 VanDerWaalsContact CD1-O 3.3Å; F229-L278 WeakPolarHBondContact CD1-O 3.23Å; P230-L278 HydrophobicContact CB-CB 4.11Å; P230-L278 HydrophobicContact CB-CD1 4.31Å; P230-L278 HydrophobicContact CB-CD2 4.48Å; P230-L278 HydrophobicContact CG-CB 4.33Å; V233-L278 VanDerWaalsContact CG2-O 3.23Å; V233-L278 WeakPolarHBondContact CG2-O 3.28Å; V234-L278 HydrophobicContact CG2-CD2 4.42Å; L266-L278 HydrophobicContact CD1-CD1 3.8Å; L266-L278 HydrophobicContact CD1-CD2 3.75Å; L266-L278 HydrophobicContact CD1-CG 4.46Å; I269-L278 HydrophobicContact CB-CD2 4.06Å; I269-L278 HydrophobicContact CD1-CD2 4.06Å; I269-L278 HydrophobicContact CG2-CD2 3.6Å; I269-L278 HydrophobicContact CG2-CG 4Å; I275-L278 HydrophobicContact CD1-CD1 3.65Å; I275-L278 HydrophobicContact CG1-CD1 4.38Å; I275-L278 WeakPolarHBondContact O-CB 3.36Å; I275-L278 PolarHBondContact O-N 2.97Å; I275-L278 VanDerWaalsContact O-N 3.13Å; R276-L278 PolarHBondContact O-N 3.47Å
279Y94.5Very high91.1Very high93 Ų9365.4 Ų65.437%0.36531%0.312SS..G310 helixtrans-118.510.2177.4-68-82.2000113.1V226 F229 P230 R276 S277 G281 L282V226-Y279 HydrophobicContact CG1-CE1 4.4Å; V226-Y279 WeakPolarHBondContact O-CE1 3.48Å; F229-Y279 HydrophobicContact CB-CD1 4.08Å; F229-Y279 HydrophobicContact CB-CE1 4.19Å; F229-Y279 HydrophobicContact CD1-CD1 4.4Å; P230-Y279 HydrophobicContact CG-CE1 4.27Å; P230-Y279 HydrophobicContact CG-CE2 4.28Å; R276-Y279 PolarHBondContact O-N 3.24Å; R276-Y279 VanDerWaalsContact O-N 3.14Å; S277-Y279 PolarHBondContact O-N 3.47Å; Y279-G281 PolarHBondContact O-N 2.93Å; Y279-L282 HydrophobicContact CD1-CD2 4.13Å; Y279-L282 VanDerWaalsContact O-CB 3.26Å; Y279-L282 WeakPolarHBondContact O-CB 3.5Å; Y279-L282 PolarHBondContact O-N 3.31Å; Y279-L282 VanDerWaalsContact O-N 3.16Å
280R91.4Very high91Very high72 Ų7271.2 Ų71.227%0.27234%0.337SS..THydrogen-bonded Turntrans-68.6122.6177.6-78.1178.7179.2-127.813.1111.1Q36 P39 F229 S277Q36-R280 WeakPolarHBondContact CG-O 3.42Å; P39-R280 VanDerWaalsContact C-NH1 3.35Å; P39-R280 VanDerWaalsContact CA-NH1 3.25Å; P39-R280 VanDerWaalsContact CB-CZ 3.42Å; P39-R280 PolarHBondContact O-NH1 2.96Å; F229-R280 VanDerWaalsContact CE1-O 3.24Å; F229-R280 WeakPolarHBondContact CE1-O 3.46Å; S277-R280 WeakPolarHBondContact O-CB 3.3Å; S277-R280 PolarHBondContact O-N 3.2Å; S277-R280 VanDerWaalsContact O-N 3.14Å; S277-R280 WeakPolarHBondContact OG-CD 3.21Å
281G92Very high91.1Very high4 Ų467.5 Ų67.54%0.04133%0.327CS..THydrogen-bonded Turntrans95.4-0.1-174.900000114Y279 G283 P284 T285Y279-G281 PolarHBondContact O-N 2.93Å; G281-G283 VanDerWaalsContact C-N 3.34Å; G281-G283 PolarHBondContact O-N 2.86Å; G281-P284 VanDerWaalsContact O-CD 3.3Å; G281-P284 WeakPolarHBondContact O-CD 3.19Å; G281-T285 PolarHBondContact O-N 2.9Å; G281-T285 VanDerWaalsContact O-N 3.15Å; G281-T285 PolarHBondContact O-OG1 2.68Å
282L92.8Very high91.2Very high30 Ų3057.1 Ų57.116%0.15729%0.288CS..Hα-helixtrans-60-44.4175.7179.965.9000111.4W225 V226 F229 Y279 T285 I286W225-L282 HydrophobicContact CB-CD1 4.09Å; V226-L282 HydrophobicContact CG2-CD2 4.27Å; F229-L282 HydrophobicContact CD1-CB 4.34Å; F229-L282 HydrophobicContact CD2-CB 4.38Å; F229-L282 HydrophobicContact CD2-CD1 3.62Å; F229-L282 HydrophobicContact CE1-CB 4.16Å; F229-L282 HydrophobicContact CE2-CB 4.22Å; F229-L282 HydrophobicContact CE2-CD1 4.05Å; F229-L282 HydrophobicContact CG-CB 4.44Å; F229-L282 HydrophobicContact CG-CD1 4.01Å; F229-L282 HydrophobicContact CZ-CB 4.12Å; Y279-L282 HydrophobicContact CD1-CD2 4.13Å; Y279-L282 VanDerWaalsContact O-CB 3.26Å; Y279-L282 WeakPolarHBondContact O-CB 3.5Å; Y279-L282 PolarHBondContact O-N 3.31Å; Y279-L282 VanDerWaalsContact O-N 3.16Å; L282-T285 WeakPolarHBondContact O-CA 3.17Å; L282-T285 WeakPolarHBondContact O-CB 3.47Å; L282-T285 PolarHBondContact O-N 3.47Å; L282-I286 HydrophobicContact CD1-CD1 3.99Å; L282-I286 HydrophobicContact CD1-CG1 4.11Å; L282-I286 HydrophobicContact CD2-CD1 4.25Å; L282-I286 HydrophobicContact CG-CD1 3.78Å; L282-I286 HydrophobicContact CG-CG1 4.27Å; L282-I286 WeakPolarHBondContact O-CG1 3.07Å; L282-I286 PolarHBondContact O-N 2.86Å
283G91.2Very high91.2Very high47 Ų4754.3 Ų54.349%0.48528%0.275SS..Hα-helixtrans-54.2-56.6177.200000113.6G281 T285 I286 L287G281-G283 VanDerWaalsContact C-N 3.34Å; G281-G283 PolarHBondContact O-N 2.86Å; G283-T285 PolarHBondContact O-N 3.43Å; G283-I286 PolarHBondContact O-N 3.11Å; G283-L287 WeakPolarHBondContact O-CB 3.31Å; G283-L287 PolarHBondContact O-N 2.86Å
284P92Very high91.3Very high4 Ų452.9 Ų52.93%0.02628%0.276CS..Hα-helixtrans-51.6-38.1171.6-27.531.1000113.7L28 I31 K32 M35 T45 G281 R288L28-P284 HydrophobicContact CD2-CB 4.46Å; I31-P284 HydrophobicContact CG2-CG 4.49Å; K32-P284 HydrophobicContact CB-CB 4.5Å; M35-P284 HydrophobicContact SD-CG 3.98Å; T45-P284 HydrophobicContact CG2-CG 3.67Å; T45-P284 WeakPolarHBondContact OG1-CG 3.44Å; G281-P284 VanDerWaalsContact O-CD 3.3Å; G281-P284 WeakPolarHBondContact O-CD 3.19Å; P284-R288 WeakPolarHBondContact O-CB 3.41Å; P284-R288 PolarHBondContact O-N 2.87Å
285T92.9Very high91.6Very high0 Ų052.3 Ų52.30%027%0.269CS..Hα-helixtrans-70.6-43.8-177.9-55.30000112.2K32 W225 F229 G281 L282 G283 R288 T289K32-T285 WeakPolarHBondContact CD-OG1 3.39Å; K32-T285 VanDerWaalsContact CG-OG1 3.31Å; K32-T285 WeakPolarHBondContact CG-OG1 3.39Å; W225-T285 HydrophobicContact CD2-CG2 3.37Å; W225-T285 VanDerWaalsContact CE2-CG2 3.48Å; W225-T285 HydrophobicContact CE3-CG2 3.49Å; W225-T285 VanDerWaalsContact CE3-CG2 3.49Å; W225-T285 HydrophobicContact CG-CG2 3.98Å; W225-T285 HydrophobicContact CH2-CG2 3.88Å; W225-T285 HydrophobicContact CZ2-CG2 3.77Å; W225-T285 HydrophobicContact CZ3-CG2 3.73Å; F229-T285 HydrophobicContact CE2-CG2 4.14Å; F229-T285 WeakPolarHBondContact CE2-OG1 3.34Å; G281-T285 PolarHBondContact O-N 2.9Å; G281-T285 VanDerWaalsContact O-N 3.15Å; G281-T285 PolarHBondContact O-OG1 2.68Å; L282-T285 WeakPolarHBondContact O-CA 3.17Å; L282-T285 WeakPolarHBondContact O-CB 3.47Å; L282-T285 PolarHBondContact O-N 3.47Å; G283-T285 PolarHBondContact O-N 3.43Å; T285-R288 WeakPolarHBondContact O-CB 3.2Å; T285-R288 PolarHBondContact O-N 3.31Å; T285-T289 PolarHBondContact O-N 3.33Å; T285-T289 VanDerWaalsContact O-N 3.14Å; T285-T289 PolarHBondContact O-OG1 2.96Å
286I91.4Very high91.7Very high47 Ų4749.9 Ų49.924%0.24126%0.257CS..Hα-helixtrans-64-48.3174.6-66.7172.7000109.6V222 L282 G283 R288 T289 F290V222-I286 HydrophobicContact CG2-CG2 4.46Å; L282-I286 HydrophobicContact CD1-CD1 3.99Å; L282-I286 HydrophobicContact CD1-CG1 4.11Å; L282-I286 HydrophobicContact CD2-CD1 4.25Å; L282-I286 HydrophobicContact CG-CD1 3.78Å; L282-I286 HydrophobicContact CG-CG1 4.27Å; L282-I286 WeakPolarHBondContact O-CG1 3.07Å; L282-I286 PolarHBondContact O-N 2.86Å; G283-I286 PolarHBondContact O-N 3.11Å; I286-R288 PolarHBondContact O-N 2.92Å; I286-T289 WeakPolarHBondContact O-CB 3.47Å; I286-T289 PolarHBondContact O-N 2.75Å; I286-F290 HydrophobicContact CG2-CE2 4.31Å
287L91.5Very high91.7Very high109 Ų10946 Ų4657%0.57125%0.246SC*.Hα-helixtrans-58.8-36.8177.9-178.962.3000112L28 G283 T289 P291L28-L287 HydrophobicContact CD1-CB 4.38Å; L28-L287 HydrophobicContact CD1-CD2 4.28Å; L28-L287 HydrophobicContact CD1-CG 4.03Å; L28-L287 HydrophobicContact CD2-CD2 4.21Å; G283-L287 WeakPolarHBondContact O-CB 3.31Å; G283-L287 PolarHBondContact O-N 2.86Å; L287-T289 VanDerWaalsContact C-N 3.34Å; L287-P291 WeakPolarHBondContact O-CD 3.42Å; L287-P291 WeakPolarHBondContact O-CG 3.31Å
288R91.6Very high91.9Very high40 Ų4052.1 Ų52.115%0.15128%0.278CS..Hα-helixtrans-67.6-32.8177.4-173.2-17265.777.20.8112.9G25 L28 W225 P284 T285 I286 F290 P291 A292G25-R288 WeakPolarHBondContact O-CD 3.36Å; L28-R288 HydrophobicContact CB-CB 3.77Å; L28-R288 HydrophobicContact CB-CG 3.96Å; L28-R288 VanDerWaalsContact CD1-CA 3.49Å; L28-R288 HydrophobicContact CD1-CB 3.71Å; L28-R288 HydrophobicContact CD1-CG 4.29Å; L28-R288 HydrophobicContact CG-CB 4.4Å; W225-R288 VanDerWaalsContact CZ2-NH2 3.25Å; P284-R288 WeakPolarHBondContact O-CB 3.41Å; P284-R288 PolarHBondContact O-N 2.87Å; T285-R288 WeakPolarHBondContact O-CB 3.2Å; T285-R288 PolarHBondContact O-N 3.31Å; I286-R288 PolarHBondContact O-N 2.92Å; R288-F290 PolarHBondContact O-N 3.49Å; R288-P291 VanDerWaalsContact O-CD 3.3Å; R288-P291 WeakPolarHBondContact O-CD 3.47Å; R288-P291 WeakPolarHBondContact O-CG 3.27Å; R288-A292 HydrophobicContact CG-CB 4.33Å; R288-A292 WeakPolarHBondContact O-CB 3.47Å; R288-A292 PolarHBondContact O-N 2.91Å
289T88.5Confident92Very high29 Ų2952.8 Ų52.818%0.17829%0.285CS..Hα-helixtrans-60.5-49.5-171.2-61.60000110.9W225 T285 I286 L287 T293W225-T289 PolarHBondContact NE1-OG1 3.46Å; W225-T289 VanDerWaalsContact NE1-OG1 3.09Å; T285-T289 PolarHBondContact O-N 3.33Å; T285-T289 VanDerWaalsContact O-N 3.14Å; T285-T289 PolarHBondContact O-OG1 2.96Å; I286-T289 WeakPolarHBondContact O-CB 3.47Å; I286-T289 PolarHBondContact O-N 2.75Å; L287-T289 VanDerWaalsContact C-N 3.34Å; T289-T293 WeakPolarHBondContact O-CB 3.47Å; T289-T293 PolarHBondContact O-N 3.01Å; T289-T293 PolarHBondContact O-OG1 3.42Å
290F87.9Confident91.9Very high127 Ų12750 Ų5056%0.55728%0.277SS*.Hα-helixtrans-58.4-56.6-179.5-63.6-83.2000114.6I286 R288 G294I286-F290 HydrophobicContact CG2-CE2 4.31Å; R288-F290 PolarHBondContact O-N 3.49Å; F290-G294 PolarHBondContact O-N 3.07Å
291P91.9Very high92Very high58 Ų5851.6 Ų51.638%0.37729%0.288SS..Hα-helixtrans-69.5-37.3-178.428.8-36.4000112.7V24 L287 R288 G294 A295V24-P291 HydrophobicContact CG1-CB 3.75Å; V24-P291 HydrophobicContact CG1-CG 4.46Å; L287-P291 WeakPolarHBondContact O-CD 3.42Å; L287-P291 WeakPolarHBondContact O-CG 3.31Å; R288-P291 VanDerWaalsContact O-CD 3.3Å; R288-P291 WeakPolarHBondContact O-CD 3.47Å; R288-P291 WeakPolarHBondContact O-CG 3.27Å; P291-G294 PolarHBondContact O-N 3.05Å; P291-A295 WeakPolarHBondContact O-CB 3.37Å; P291-A295 PolarHBondContact O-N 3.39Å
292A92.9Very high92Very high1 Ų160.4 Ų60.41%0.00832%0.319CS..Hα-helixtrans-67.4-42.7178.100000111.7R288 A295 L296R288-A292 HydrophobicContact CG-CB 4.33Å; R288-A292 WeakPolarHBondContact O-CB 3.47Å; R288-A292 PolarHBondContact O-N 2.91Å; A292-A295 PolarHBondContact O-N 3.49Å; A292-L296 PolarHBondContact O-N 3.24Å
293T89.5Confident92Very high59 Ų5960 Ų6036%0.36232%0.319SS..Hα-helixtrans-67.3-40.3175.1-64.90000111.5T289 A295 L296 F297T289-T293 WeakPolarHBondContact O-CB 3.47Å; T289-T293 PolarHBondContact O-N 3.01Å; T289-T293 PolarHBondContact O-OG1 3.42Å; T293-A295 PolarHBondContact O-N 3.07Å; T293-L296 WeakPolarHBondContact O-CB 3.42Å; T293-L296 PolarHBondContact O-N 3.27Å; T293-F297 HydrophobicContact CG2-CD2 3.62Å; T293-F297 HydrophobicContact CG2-CE2 3.3Å; T293-F297 HydrophobicContact CG2-CZ 4.38Å; T293-F297 WeakPolarHBondContact O-CD2 2.94Å; T293-F297 PolarHBondContact O-N 2.92Å
294G91.1Very high92Very high31 Ų3163.8 Ų63.832%0.3232%0.318SS..Hα-helixtrans-59.3-46173.400000112.2F290 P291 L296 F297 L298F290-G294 PolarHBondContact O-N 3.07Å; P291-G294 PolarHBondContact O-N 3.05Å; G294-L296 VanDerWaalsContact C-N 3.34Å; G294-L296 PolarHBondContact O-N 2.91Å; G294-F297 PolarHBondContact O-N 3.43Å; G294-L298 WeakPolarHBondContact O-CB 3.21Å; G294-L298 VanDerWaalsContact O-CG 3.29Å; G294-L298 WeakPolarHBondContact O-CG 3.07Å; G294-L298 PolarHBondContact O-N 3.37Å
295A95.1Very high91.9Very high16 Ų1669.2 Ų69.213%0.13234%0.341CS..Hα-helixtrans-62.8-39.7176.300000112.5A20 V24 P291 A292 T293 A299A20-A295 HydrophobicContact CB-CB 4.14Å; V24-A295 HydrophobicContact CB-CB 4.04Å; V24-A295 HydrophobicContact CG1-CB 4.47Å; V24-A295 HydrophobicContact CG2-CB 3.64Å; P291-A295 WeakPolarHBondContact O-CB 3.37Å; P291-A295 PolarHBondContact O-N 3.39Å; A292-A295 PolarHBondContact O-N 3.49Å; T293-A295 PolarHBondContact O-N 3.07Å; A295-A299 VanDerWaalsContact O-CB 3.3Å; A295-A299 WeakPolarHBondContact O-CB 3.36Å; A295-A299 PolarHBondContact O-N 3.47Å
296L93.3Very high91.8Very high54 Ų5471.5 Ų71.528%0.28336%0.357SS..Hα-helixtrans-56.9-55.2173.6-173153.6000110.9G17 A292 T293 G294 L298 A299 V300G17-L296 WeakPolarHBondContact O-CA 3.48Å; A292-L296 PolarHBondContact O-N 3.24Å; T293-L296 WeakPolarHBondContact O-CB 3.42Å; T293-L296 PolarHBondContact O-N 3.27Å; G294-L296 VanDerWaalsContact C-N 3.34Å; G294-L296 PolarHBondContact O-N 2.91Å; L296-L298 PolarHBondContact O-N 3.4Å; L296-A299 PolarHBondContact O-N 3.42Å; L296-V300 HydrophobicContact CD2-CG2 3.92Å; L296-V300 VanDerWaalsContact O-CG2 3.29Å; L296-V300 WeakPolarHBondContact O-CG2 3.35Å; L296-V300 PolarHBondContact O-N 2.96Å
297F91.9Very high91.4Very high139 Ų13970 Ų7061%0.6135%0.352SS*.Hα-helixtrans-62.1-45-177.2-77-59.9000111.9T293 G294 A299 V300 E301T293-F297 HydrophobicContact CG2-CD2 3.62Å; T293-F297 HydrophobicContact CG2-CE2 3.3Å; T293-F297 HydrophobicContact CG2-CZ 4.38Å; T293-F297 WeakPolarHBondContact O-CD2 2.94Å; T293-F297 PolarHBondContact O-N 2.92Å; G294-F297 PolarHBondContact O-N 3.43Å; F297-A299 VanDerWaalsContact C-N 3.34Å; F297-A299 PolarHBondContact O-N 2.82Å; F297-V300 PolarHBondContact O-N 3.08Å; F297-E301 VanDerWaalsContact O-CB 3.23Å; F297-E301 WeakPolarHBondContact O-CB 3.27Å; F297-E301 PolarHBondContact O-N 3.2Å
298L94.1Very high91.1Very high129 Ų12967.9 Ų67.968%0.67534%0.339SS*.Hα-helixtrans-58.8-45.2177.3-72.6172.7000111.8G294 L296 W302G294-L298 WeakPolarHBondContact O-CB 3.21Å; G294-L298 VanDerWaalsContact O-CG 3.29Å; G294-L298 WeakPolarHBondContact O-CG 3.07Å; G294-L298 PolarHBondContact O-N 3.37Å; L296-L298 PolarHBondContact O-N 3.4Å; L298-W302 WeakPolarHBondContact O-CB 3.21Å; L298-W302 PolarHBondContact O-N 3.39Å
299A95.1Very high90.8Very high20 Ų2072.3 Ų72.317%0.16537%0.365CS..Hα-helixtrans-70.2-36.9179.800000112.8A20 A295 L296 F297 T303A20-A299 HydrophobicContact CB-CB 3.59Å; A295-A299 VanDerWaalsContact O-CB 3.3Å; A295-A299 WeakPolarHBondContact O-CB 3.36Å; A295-A299 PolarHBondContact O-N 3.47Å; L296-A299 PolarHBondContact O-N 3.42Å; F297-A299 VanDerWaalsContact C-N 3.34Å; F297-A299 PolarHBondContact O-N 2.82Å; A299-T303 WeakPolarHBondContact O-CB 3.36Å; A299-T303 PolarHBondContact O-N 3.47Å; A299-T303 PolarHBondContact O-OG1 3.47Å
300V92.7Very high90.4Very high33 Ų3377.8 Ų77.820%0.239%0.393CS..Hα-helixtrans-63.5-52.2173.6169.70000110.5A13 L296 F297 W302 T303 R304A13-V300 HydrophobicContact CB-CG1 4.19Å; A13-V300 WeakPolarHBondContact O-CG2 3.34Å; L296-V300 HydrophobicContact CD2-CG2 3.92Å; L296-V300 VanDerWaalsContact O-CG2 3.29Å; L296-V300 WeakPolarHBondContact O-CG2 3.35Å; L296-V300 PolarHBondContact O-N 2.96Å; F297-V300 PolarHBondContact O-N 3.08Å; V300-W302 VanDerWaalsContact C-N 3.34Å; V300-W302 PolarHBondContact O-N 3.47Å; V300-T303 PolarHBondContact O-N 3.27Å; V300-R304 HydrophobicContact CG1-CG 4.42Å; V300-R304 WeakPolarHBondContact O-CB 3.49Å; V300-R304 VanDerWaalsContact O-CG 3.27Å; V300-R304 WeakPolarHBondContact O-CG 3.19Å; V300-R304 PolarHBondContact O-N 2.97Å
301E91.5Very high89.9Confident107 Ų10775.2 Ų75.250%0.539%0.385SS..Hα-helixtrans-56.5-48.9179.8-178.188.7-169.500110.8F297 R304 K305F297-E301 VanDerWaalsContact O-CB 3.23Å; F297-E301 WeakPolarHBondContact O-CB 3.27Å; F297-E301 PolarHBondContact O-N 3.2Å; E301-R304 PolarHBondContact O-N 2.97Å; E301-K305 HydrophobicContact CG-CD 4.34Å; E301-K305 WeakPolarHBondContact O-CG 3.27Å; E301-K305 PolarHBondContact O-N 3.5Å; E301-K305 WeakPolarHBondContact OE1-CE 3.34Å; E301-K305 IonicContact OE1-NZ 3.27Å; E301-K305 PolarHBondContact OE1-NZ 2.94Å
302W93.5Very high88.7Confident188 Ų18881.3 Ų81.371%0.71241%0.414SS*.Hα-helixtrans-63.9-47179.4-164-54.2000111.5L298 V300 R304 K305 C306L298-W302 WeakPolarHBondContact O-CB 3.21Å; L298-W302 PolarHBondContact O-N 3.39Å; V300-W302 VanDerWaalsContact C-N 3.34Å; V300-W302 PolarHBondContact O-N 3.47Å; W302-R304 VanDerWaalsContact C-N 3.3Å; W302-R304 PolarHBondContact O-N 3.24Å; W302-K305 PolarHBondContact O-N 3.41Å; W302-C306 PolarHBondContact NE1-SG 2.72Å; W302-C306 VanDerWaalsContact NE1-SG 3.42Å; W302-C306 PolarHBondContact O-N 2.98Å
303T92.5Very high88.5Confident23 Ų2385.3 Ų85.314%0.14143%0.434CS..Hα-helixtrans-62.6-39.4-179.9-580000111.3V12 A13 N16 A299 V300 G307V12-T303 HydrophobicContact CB-CG2 4.49Å; V12-T303 HydrophobicContact CG1-CG2 3.91Å; A13-T303 HydrophobicContact CB-CG2 3.87Å; N16-T303 WeakPolarHBondContact CB-OG1 3.33Å; N16-T303 WeakPolarHBondContact ND2-CG2 3.49Å; N16-T303 PolarHBondContact ND2-OG1 3.28Å; N16-T303 VanDerWaalsContact ND2-OG1 3.11Å; A299-T303 WeakPolarHBondContact O-CB 3.36Å; A299-T303 PolarHBondContact O-N 3.47Å; A299-T303 PolarHBondContact O-OG1 3.47Å; V300-T303 PolarHBondContact O-N 3.27Å; T303-G307 PolarHBondContact O-N 2.92Å
304R90.4Very high88.5Confident126 Ų12686.7 Ų86.748%0.47544%0.438SS..Hα-helixtrans-64.6-46.9176-70.9177.672.4127.44.3111.6I9 A13 V300 E301 W302 C306 G307 H308I9-R304 HydrophobicContact CG2-CB 4.4Å; I9-R304 HydrophobicContact CG2-CG 4.18Å; A13-R304 HydrophobicContact CB-CG 3.73Å; V300-R304 HydrophobicContact CG1-CG 4.42Å; V300-R304 WeakPolarHBondContact O-CB 3.49Å; V300-R304 VanDerWaalsContact O-CG 3.27Å; V300-R304 WeakPolarHBondContact O-CG 3.19Å; V300-R304 PolarHBondContact O-N 2.97Å; E301-R304 PolarHBondContact O-N 2.97Å; W302-R304 VanDerWaalsContact C-N 3.3Å; W302-R304 PolarHBondContact O-N 3.24Å; R304-C306 PolarHBondContact O-N 3.4Å; R304-G307 PolarHBondContact O-N 2.87Å; R304-H308 PolarHBondContact O-CD2 3.31Å; R304-H308 PolarHBondContact O-N 2.9Å
305K89.7Confident88.3Confident118 Ų11889.8 Ų89.851%0.51345%0.445SS..Hα-helixtrans-57.8-50177.1-75.3174.7-178166.30111.6E301 W302 G307 H308 L309E301-K305 HydrophobicContact CG-CD 4.34Å; E301-K305 WeakPolarHBondContact O-CG 3.27Å; E301-K305 PolarHBondContact O-N 3.5Å; E301-K305 WeakPolarHBondContact OE1-CE 3.34Å; E301-K305 IonicContact OE1-NZ 3.27Å; E301-K305 PolarHBondContact OE1-NZ 2.94Å; W302-K305 PolarHBondContact O-N 3.41Å; K305-G307 VanDerWaalsContact C-N 3.34Å; K305-G307 PolarHBondContact O-N 3.07Å; K305-H308 PolarHBondContact O-N 3.33Å; K305-L309 VanDerWaalsContact O-CG 3.27Å; K305-L309 WeakPolarHBondContact O-CG 3.42Å; K305-L309 PolarHBondContact O-N 3.15Å; K305-L309 VanDerWaalsContact O-N 3.08Å
306C90.5Very high87.9Confident48 Ų4894.1 Ų94.132%0.32446%0.463SS..Hα-helixtrans-63.7-38.5176-700000112.6W302 R304 L309 L310W302-C306 PolarHBondContact NE1-SG 2.72Å; W302-C306 VanDerWaalsContact NE1-SG 3.42Å; W302-C306 PolarHBondContact O-N 2.98Å; R304-C306 PolarHBondContact O-N 3.4Å; C306-L309 PolarHBondContact O-N 3.45Å; C306-L310 WeakPolarHBondContact O-CB 3.39Å; C306-L310 VanDerWaalsContact O-CG 3.29Å; C306-L310 WeakPolarHBondContact O-CG 3.49Å; C306-L310 PolarHBondContact O-N 3.2Å
307G85.1Confident87.6Confident14 Ų1496.6 Ų96.614%0.14447%0.474CS..Hα-helixtrans-64.1-39.6179.600000113.3T303 R304 K305 L311T303-G307 PolarHBondContact O-N 2.92Å; R304-G307 PolarHBondContact O-N 2.87Å; K305-G307 VanDerWaalsContact C-N 3.34Å; K305-G307 PolarHBondContact O-N 3.07Å; G307-L311 WeakPolarHBondContact O-CB 3.29Å; G307-L311 WeakPolarHBondContact O-CG 3.4Å; G307-L311 PolarHBondContact O-N 3.38Å
308H84.5Confident87.3Confident65 Ų6593.8 Ų93.830%0.30147%0.465SS..Hα-helixtrans-68.2-47.5172.9-71.5-64.3000111.1N6 R304 K305 L310 L311 D312N6-H308 PolarHBondContact OD1-CE1 3.18Å; R304-H308 PolarHBondContact O-CD2 3.31Å; R304-H308 PolarHBondContact O-N 2.9Å; K305-H308 PolarHBondContact O-N 3.33Å; H308-L310 PolarHBondContact O-N 3.03Å; H308-L310 VanDerWaalsContact O-N 3.15Å; H308-L311 PolarHBondContact O-N 3Å; H308-L311 VanDerWaalsContact O-N 3.09Å; H308-D312 WeakPolarHBondContact O-CB 3.48Å; H308-D312 PolarHBondContact O-N 3.09Å
309L84.5Confident86.8Confident133 Ų13391.3 Ų91.370%0.69645%0.45SS*.Hα-helixtrans-59.1-28.3177.7-71.4170000114.7K305 C306K305-L309 VanDerWaalsContact O-CG 3.27Å; K305-L309 WeakPolarHBondContact O-CG 3.42Å; K305-L309 PolarHBondContact O-N 3.15Å; K305-L309 VanDerWaalsContact O-N 3.08Å; C306-L309 PolarHBondContact O-N 3.45Å
310L81.2Confident86.2Confident144 Ų14496.8 Ų96.875%0.75447%0.472SS*.Hα-helixtrans-88.2-17.9179.2-74.4169.5000113.7C306 H308C306-L310 WeakPolarHBondContact O-CB 3.39Å; C306-L310 VanDerWaalsContact O-CG 3.29Å; C306-L310 WeakPolarHBondContact O-CG 3.49Å; C306-L310 PolarHBondContact O-N 3.2Å; H308-L310 PolarHBondContact O-N 3.03Å; H308-L310 VanDerWaalsContact O-N 3.15Å
311L76.3Confident85.6Confident74 Ų74102.1 Ų102.139%0.38750%0.495SS..Hα-helixtrans-112.7-5.4-174.3-70-179.4000114.1K5 I9 G307 H308K5-L311 HydrophobicContact CB-CD1 4.27Å; K5-L311 HydrophobicContact CD-CB 4.4Å; K5-L311 HydrophobicContact CD-CD1 4.43Å; K5-L311 HydrophobicContact CG-CD1 4.31Å; K5-L311 PolarHBondContact NZ-O 2.89Å; I9-L311 HydrophobicContact CD1-CD1 3.8Å; I9-L311 HydrophobicContact CG1-CD1 3.87Å; G307-L311 WeakPolarHBondContact O-CB 3.29Å; G307-L311 WeakPolarHBondContact O-CG 3.4Å; G307-L311 PolarHBondContact O-N 3.38Å; H308-L311 PolarHBondContact O-N 3Å; H308-L311 VanDerWaalsContact O-N 3.09Å
312D68.1Low85.1Confident185 Ų185101.6 Ų101.699%0.98949%0.494SS*.  trans-80.70161.7-66-21.3000110.2H308H308-D312 WeakPolarHBondContact O-CB 3.48Å; H308-D312 PolarHBondContact O-N 3.09Å

Retrieved 312 of 312 residues in 98 ms (Link to these results)

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