A0A087XL76_POEFO Loading...

Solute carrier family 25 member 15

AlphaFold DB , UniProt , Accession A0A087XL76, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 303 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
1M50.6Low79.5Confident218 Ų21887.2 Ų87.2100%1.07449%0.492SS*.  0128.10-90.1172167.600106.2
2S59.7Low80.2Confident108 Ų10883.8 Ų83.876%0.75547%0.472SS*.PPolyproline II helixtrans-58.5132174.9480000109.4
3P69.4Low80.8Confident23 Ų2389.2 Ų89.215%0.14949%0.487CS..PPolyproline II helixtrans-59.4153.9-17921.8-29.9000110.7I7 Q8 M298 V301 A303P3-I7 HydrophobicContact CB-CB 4.33Å; P3-I7 HydrophobicContact CB-CG2 4.22Å; P3-Q8 HydrophobicContact CG-CB 4.46Å; P3-M298 HydrophobicContact CG-CE 4.29Å; P3-M298 HydrophobicContact CG-SD 3.83Å; P3-V301 HydrophobicContact CB-CG1 4.32Å; P3-A303 HydrophobicContact CG-CB 4.19Å
4H82.4Confident81.6Confident119 Ų11986.4 Ų86.455%0.55148%0.478SS*.PPolyproline II helixtrans-51.4138.9176.1-171.1-85.5000109.9V6 I7 Q8H4-V6 PolarHBondContact ND1-N 3.33Å; H4-V6 PolarHBondContact O-N 3.37Å; H4-I7 HydrophobicContact CB-CD1 4.06Å; H4-I7 HydrophobicContact CB-CG1 4.25Å; H4-I7 WeakPolarHBondContact O-CA 3.34Å; H4-I7 WeakPolarHBondContact O-CB 3.3Å; H4-I7 PolarHBondContact O-N 3.21Å; H4-Q8 PolarHBondContact O-N 3.22Å; H4-Q8 VanDerWaalsContact O-N 3.08Å
5P85.1Confident82.2Confident93 Ų9380.7 Ų80.760%0.60445%0.446SS*.Hα-helixtrans-54.4-31.7-172.416.6-31.5000114A9P5-A9 WeakPolarHBondContact O-CB 3.3Å; P5-A9 PolarHBondContact O-N 2.97Å
6V86.9Confident82.6Confident85 Ų8577.8 Ų77.852%0.51544%0.44SS..Hα-helixtrans-65.9-41.8173.7178.50000112.2H4 A9 L10H4-V6 PolarHBondContact ND1-N 3.33Å; H4-V6 PolarHBondContact O-N 3.37Å; V6-A9 PolarHBondContact O-N 3.31Å; V6-L10 HydrophobicContact CG1-CD1 4.35Å; V6-L10 WeakPolarHBondContact O-CG 3.5Å; V6-L10 PolarHBondContact O-N 2.94Å
7I87Confident83Confident67 Ų6776.2 Ų76.234%0.34444%0.439SS..Hα-helixtrans-67.2-42.8178.3-61.9173.2000109.4P3 H4 A9 L10 I11 V301P3-I7 HydrophobicContact CB-CB 4.33Å; P3-I7 HydrophobicContact CB-CG2 4.22Å; H4-I7 HydrophobicContact CB-CD1 4.06Å; H4-I7 HydrophobicContact CB-CG1 4.25Å; H4-I7 WeakPolarHBondContact O-CA 3.34Å; H4-I7 WeakPolarHBondContact O-CB 3.3Å; H4-I7 PolarHBondContact O-N 3.21Å; I7-A9 VanDerWaalsContact C-N 3.33Å; I7-A9 PolarHBondContact O-N 2.91Å; I7-L10 PolarHBondContact O-N 3.27Å; I7-I11 HydrophobicContact CG2-CD1 3.89Å; I7-I11 HydrophobicContact CG2-CG1 4.35Å; I7-I11 VanDerWaalsContact O-CG1 3.27Å; I7-I11 WeakPolarHBondContact O-CG1 3.35Å; I7-I11 PolarHBondContact O-N 2.79Å; I7-V301 HydrophobicContact CG2-CG1 4Å; I7-V301 HydrophobicContact CG2-CG2 4.2Å
8Q86.4Confident83.6Confident74 Ų7473.8 Ų73.835%0.34643%0.43SS..Hα-helixtrans-58.9-44.8174.6-176.3170.3-5.100111.8P3 H4 L10 I11 D12 M298P3-Q8 HydrophobicContact CG-CB 4.46Å; H4-Q8 PolarHBondContact O-N 3.22Å; H4-Q8 VanDerWaalsContact O-N 3.08Å; Q8-L10 VanDerWaalsContact C-N 3.35Å; Q8-L10 PolarHBondContact O-N 3.04Å; Q8-I11 PolarHBondContact O-N 3.2Å; Q8-D12 WeakPolarHBondContact O-CB 3.48Å; Q8-D12 PolarHBondContact O-N 3.42Å; Q8-M298 HydrophobicContact CG-CE 4.12Å
9A87.1Confident84Confident58 Ų5869.9 Ų69.948%0.47941%0.408SS..Hα-helixtrans-61.2-40.317600000112.8P5 V6 I7 F13P5-A9 WeakPolarHBondContact O-CB 3.3Å; P5-A9 PolarHBondContact O-N 2.97Å; V6-A9 PolarHBondContact O-N 3.31Å; I7-A9 VanDerWaalsContact C-N 3.33Å; I7-A9 PolarHBondContact O-N 2.91Å; A9-F13 WeakPolarHBondContact O-CB 3.27Å; A9-F13 PolarHBondContact O-N 3.15Å
10L89.8Confident84.3Confident106 Ų10667.1 Ų67.156%0.55539%0.393SS*.Hα-helixtrans-66.6-38.9176.3-72172.6000112.5V6 I7 Q8 S14V6-L10 HydrophobicContact CG1-CD1 4.35Å; V6-L10 WeakPolarHBondContact O-CG 3.5Å; V6-L10 PolarHBondContact O-N 2.94Å; I7-L10 PolarHBondContact O-N 3.27Å; Q8-L10 VanDerWaalsContact C-N 3.35Å; Q8-L10 PolarHBondContact O-N 3.04Å; L10-S14 WeakPolarHBondContact O-CB 3.42Å; L10-S14 PolarHBondContact O-N 3.38Å; L10-S14 PolarHBondContact O-OG 3.4Å
11I89.7Confident84.7Confident8 Ų866.6 Ų66.64%0.04139%0.392CS..Hα-helixtrans-64.4-50.9175.3-68.8171.8000109.9I7 Q8 F13 S14 A15 R294 M297 M298 V301I7-I11 HydrophobicContact CG2-CD1 3.89Å; I7-I11 HydrophobicContact CG2-CG1 4.35Å; I7-I11 VanDerWaalsContact O-CG1 3.27Å; I7-I11 WeakPolarHBondContact O-CG1 3.35Å; I7-I11 PolarHBondContact O-N 2.79Å; Q8-I11 PolarHBondContact O-N 3.2Å; I11-F13 VanDerWaalsContact C-N 3.3Å; I11-F13 PolarHBondContact O-N 3.25Å; I11-S14 PolarHBondContact O-N 3.19Å; I11-A15 VanDerWaalsContact O-CB 3.27Å; I11-A15 WeakPolarHBondContact O-CB 3.36Å; I11-A15 PolarHBondContact O-N 2.69Å; I11-R294 HydrophobicContact CG2-CG 4.03Å; I11-M297 HydrophobicContact CD1-CB 4.38Å; I11-M297 HydrophobicContact CG1-CB 4.02Å; I11-M297 HydrophobicContact CG2-CB 3.91Å; I11-M297 HydrophobicContact CG2-CE 4.08Å; I11-M297 HydrophobicContact CG2-SD 4.48Å; I11-M297 WeakPolarHBondContact O-CE 3.42Å; I11-M298 HydrophobicContact CB-CE 4.35Å; I11-M298 HydrophobicContact CD1-CE 3.95Å; I11-M298 HydrophobicContact CD1-CG 4.32Å; I11-M298 HydrophobicContact CD1-SD 3.67Å; I11-M298 HydrophobicContact CG2-CE 3.97Å; I11-M298 HydrophobicContact CG2-CG 4.32Å; I11-V301 HydrophobicContact CD1-CG2 4.24Å
12D88.1Confident86.8Confident46 Ų4657.5 Ų57.525%0.24635%0.351CS..Hα-helixtrans-64.1-37.4-178.8-70.4-31.2000111.2Q8 G16 R294Q8-D12 WeakPolarHBondContact O-CB 3.48Å; Q8-D12 PolarHBondContact O-N 3.42Å; D12-G16 PolarHBondContact O-N 2.66Å; D12-R294 WeakPolarHBondContact OD1-CD 3.1Å; D12-R294 IonicContact OD1-CZ 3.98Å; D12-R294 IonicContact OD1-NE 2.89Å; D12-R294 PolarHBondContact OD1-NE 3.46Å
13F88.9Confident88.4Confident154 Ų15453.3 Ų53.368%0.67532%0.321SS*.Hα-helixtrans-62.4-49.2172.9177-97000112.2A9 I11 G16 A17A9-F13 WeakPolarHBondContact O-CB 3.27Å; A9-F13 PolarHBondContact O-N 3.15Å; I11-F13 VanDerWaalsContact C-N 3.3Å; I11-F13 PolarHBondContact O-N 3.25Å; F13-G16 PolarHBondContact O-N 3.27Å; F13-A17 PolarHBondContact O-N 3.32Å
14S91.3Very high89.4Confident51 Ų5152.6 Ų52.636%0.35732%0.316SS..Hα-helixtrans-66.8-41.1-178.1-57.80000111.6L10 I11 G16 A17 A18L10-S14 WeakPolarHBondContact O-CB 3.42Å; L10-S14 PolarHBondContact O-N 3.38Å; L10-S14 PolarHBondContact O-OG 3.4Å; I11-S14 PolarHBondContact O-N 3.19Å; S14-G16 VanDerWaalsContact C-N 3.34Å; S14-A17 PolarHBondContact O-N 2.85Å; S14-A18 PolarHBondContact O-N 3.42Å
15A90.1Very high90Very high0 Ų050.3 Ų50.30%031%0.308CS..Hα-helixtrans-64.6-40.8174.400000111.1I11 A18 G19 Y290 R294 M297I11-A15 VanDerWaalsContact O-CB 3.27Å; I11-A15 WeakPolarHBondContact O-CB 3.36Å; I11-A15 PolarHBondContact O-N 2.69Å; A15-A18 PolarHBondContact O-N 2.85Å; A15-G19 PolarHBondContact O-N 3Å; A15-Y290 HydrophobicContact CB-CD2 3.72Å; A15-Y290 HydrophobicContact CB-CE2 3.83Å; A15-Y290 HydrophobicContact CB-CG 4.46Å; A15-R294 HydrophobicContact CB-CB 3.78Å; A15-M297 HydrophobicContact CB-CE 3.85Å
16G88.5Confident90.4Very high34 Ų3447.3 Ų47.335%0.35129%0.289SS..Hα-helixtrans-60.2-43.9173.500000112.4D12 F13 S14 G19 G20D12-G16 PolarHBondContact O-N 2.66Å; F13-G16 PolarHBondContact O-N 3.27Å; S14-G16 VanDerWaalsContact C-N 3.34Å; G16-G19 PolarHBondContact O-N 3.39Å; G16-G20 PolarHBondContact O-N 3.15Å
17A90.9Very high90.7Very high51 Ų5143.2 Ų43.242%0.42127%0.265SS..Hα-helixtrans-64.7-42.6176.400000112.4F13 S14 T21F13-A17 PolarHBondContact O-N 3.32Å; S14-A17 PolarHBondContact O-N 2.85Å; A17-T21 WeakPolarHBondContact O-CB 3.29Å; A17-T21 PolarHBondContact O-N 3.12Å; A17-T21 PolarHBondContact O-OG1 3.14Å
18A92.8Very high90.9Very high34 Ų3440 Ų4028%0.28125%0.248SC..Hα-helixtrans-62.5-47175.100000111.5S14 A15 T21 A22S14-A18 PolarHBondContact O-N 3.42Å; A15-A18 PolarHBondContact O-N 2.85Å; A18-T21 PolarHBondContact O-N 2.85Å; A18-A22 WeakPolarHBondContact O-CB 3.36Å; A18-A22 PolarHBondContact O-N 3.21Å
19G92Very high91.3Very high0 Ų037.2 Ų37.20%024%0.236CC..Hα-helixtrans-57.1-52.3174.500000112.6A15 G16 T21 A22 C23 L286A15-G19 PolarHBondContact O-N 3Å; G16-G19 PolarHBondContact O-N 3.39Å; G19-T21 VanDerWaalsContact C-N 3.26Å; G19-T21 PolarHBondContact O-N 3Å; G19-A22 PolarHBondContact O-N 2.76Å; G19-C23 WeakPolarHBondContact O-CB 3.32Å; G19-C23 PolarHBondContact O-N 3.04Å; G19-L286 WeakPolarHBondContact O-CD1 3.16Å
20G89.9Confident91.7Very high12 Ų1236.1 Ų36.112%0.12422%0.221CC..Hα-helixtrans-59.3-38.5178.500000112.5G16 C23 V24G16-G20 PolarHBondContact O-N 3.15Å; G20-C23 WeakPolarHBondContact O-CB 3.43Å; G20-V24 WeakPolarHBondContact O-CG2 3.42Å; G20-V24 PolarHBondContact O-N 3.26Å; G20-V24 VanDerWaalsContact O-N 3.1Å
21T93.2Very high91.8Very high58 Ų5831.9 Ų31.936%0.35620%0.198SC..Hα-helixtrans-65.8-47.2176.1-57.40000111.6A17 A18 G19 C23 V24 L25 L71A17-T21 WeakPolarHBondContact O-CB 3.29Å; A17-T21 PolarHBondContact O-N 3.12Å; A17-T21 PolarHBondContact O-OG1 3.14Å; A18-T21 PolarHBondContact O-N 2.85Å; G19-T21 VanDerWaalsContact C-N 3.26Å; G19-T21 PolarHBondContact O-N 3Å; T21-C23 VanDerWaalsContact C-N 3.32Å; T21-C23 PolarHBondContact O-N 3.01Å; T21-V24 PolarHBondContact O-N 3.22Å; T21-L25 HydrophobicContact CG2-CD1 3.94Å; T21-L25 HydrophobicContact CG2-CG 4.38Å; T21-L25 WeakPolarHBondContact O-CG 3.2Å; T21-L25 PolarHBondContact O-N 3.15Å; T21-L71 HydrophobicContact CG2-CD2 4.13Å
22A93.9Very high91.9Very high26 Ų2631.5 Ų31.522%0.21520%0.196CC..Hα-helixtrans-61.9-39.9177.900000112.2A18 G19 L25 S26 A285 A289A18-A22 WeakPolarHBondContact O-CB 3.36Å; A18-A22 PolarHBondContact O-N 3.21Å; G19-A22 PolarHBondContact O-N 2.76Å; A22-L25 PolarHBondContact O-N 3.08Å; A22-S26 WeakPolarHBondContact O-CB 3.38Å; A22-S26 PolarHBondContact O-N 2.64Å; A22-S26 PolarHBondContact O-OG 3.1Å; A22-A285 HydrophobicContact CB-CB 4.17Å; A22-A289 HydrophobicContact CB-CB 3.5Å
23C92.4Very high92.2Very high20 Ų2029.3 Ų29.314%0.13519%0.185CC..Hα-helixtrans-57.8-50.6174.2-176.80000111.9G19 G20 T21 S26 G27 L286G19-C23 WeakPolarHBondContact O-CB 3.32Å; G19-C23 PolarHBondContact O-N 3.04Å; G20-C23 WeakPolarHBondContact O-CB 3.43Å; T21-C23 VanDerWaalsContact C-N 3.32Å; T21-C23 PolarHBondContact O-N 3.01Å; C23-S26 PolarHBondContact O-OG 2.85Å; C23-S26 VanDerWaalsContact O-OG 3.11Å; C23-G27 PolarHBondContact O-N 3.47Å; C23-L286 HydrophobicContact CB-CB 3.94Å; C23-L286 HydrophobicContact CB-CD1 4.17Å
24V91.8Very high92.4Very high8 Ų822.9 Ų22.95%0.04816%0.157CC..Hα-helixtrans-65.8-45-179.3172.90000110.9G20 T21 G27 Q28 A70 L71 N74G20-V24 WeakPolarHBondContact O-CG2 3.42Å; G20-V24 PolarHBondContact O-N 3.26Å; G20-V24 VanDerWaalsContact O-N 3.1Å; T21-V24 PolarHBondContact O-N 3.22Å; V24-G27 PolarHBondContact O-N 3.27Å; V24-Q28 VanDerWaalsContact O-CB 3.26Å; V24-Q28 WeakPolarHBondContact O-CB 3.48Å; V24-Q28 PolarHBondContact O-N 3.35Å; V24-A70 HydrophobicContact CG1-CB 3.76Å; V24-L71 HydrophobicContact CB-CD2 3.58Å; V24-L71 HydrophobicContact CB-CG 4.18Å; V24-L71 HydrophobicContact CG1-CD2 3.77Å; V24-L71 HydrophobicContact CG1-CG 3.77Å; V24-L71 HydrophobicContact CG2-CD2 3.93Å; V24-N74 HydrophobicContact CG2-CB 4.11Å
25L93.8Very high92.4Very high71 Ų7120.8 Ų20.837%0.37214%0.142SC..Hα-helixtrans-64.7-46.1-178.3-69.4177.2000112.3T21 A22 G27 Q28 P29 Y64T21-L25 HydrophobicContact CG2-CD1 3.94Å; T21-L25 HydrophobicContact CG2-CG 4.38Å; T21-L25 WeakPolarHBondContact O-CG 3.2Å; T21-L25 PolarHBondContact O-N 3.15Å; A22-L25 PolarHBondContact O-N 3.08Å; L25-G27 VanDerWaalsContact C-N 3.33Å; L25-G27 PolarHBondContact O-N 2.85Å; L25-Q28 PolarHBondContact O-N 3.38Å; L25-P29 WeakPolarHBondContact O-CD 3.32Å; L25-Y64 HydrophobicContact CD2-CD1 4.45Å; L25-Y64 HydrophobicContact CD2-CE1 4.39Å; L25-Y64 VanDerWaalsContact O-CE1 3.22Å; L25-Y64 WeakPolarHBondContact O-CE1 3.25Å
26S93.8Very high92.6Very high30 Ų3021 Ų2121%0.2114%0.143CC..Hα-helixtrans-67.7-33.5177.657.70000112.8A22 C23 P281 A282 A285A22-S26 WeakPolarHBondContact O-CB 3.38Å; A22-S26 PolarHBondContact O-N 2.64Å; A22-S26 PolarHBondContact O-OG 3.1Å; C23-S26 PolarHBondContact O-OG 2.85Å; C23-S26 VanDerWaalsContact O-OG 3.11Å; S26-P281 PolarHBondContact OG-O 2.7Å; S26-A282 WeakPolarHBondContact OG-CA 3.37Å; S26-A285 VanDerWaalsContact OG-CB 3.31Å; S26-A285 WeakPolarHBondContact OG-CB 3.31Å
27G92.6Very high92.7Very high0 Ų020.2 Ų20.20%013%0.13CC..Hα-helixtrans-80.8-21.9178.600000114.8C23 V24 L25 F30 D31 R278C23-G27 PolarHBondContact O-N 3.47Å; V24-G27 PolarHBondContact O-N 3.27Å; L25-G27 VanDerWaalsContact C-N 3.33Å; L25-G27 PolarHBondContact O-N 2.85Å; G27-F30 PolarHBondContact O-N 2.83Å; G27-F30 VanDerWaalsContact O-N 3.15Å; G27-D31 PolarHBondContact O-N 3.24Å; G27-D31 VanDerWaalsContact O-N 3.14Å; G27-R278 VanDerWaalsContact CA-NH1 3.35Å; G27-R278 PolarHBondContact O-NH1 3.04Å
28Q93.1Very high92.6Very high0 Ų017.8 Ų17.80%011%0.11CC..Hα-helixtrans-58.3-43.5-170.9-17566.113.200114.2V24 L25 F30 D31 T32 Y64 K65 G66 A67V24-Q28 VanDerWaalsContact O-CB 3.26Å; V24-Q28 WeakPolarHBondContact O-CB 3.48Å; V24-Q28 PolarHBondContact O-N 3.35Å; L25-Q28 PolarHBondContact O-N 3.38Å; Q28-F30 PolarHBondContact O-N 2.97Å; Q28-D31 PolarHBondContact O-N 3.42Å; Q28-T32 PolarHBondContact O-N 3.42Å; Q28-T32 PolarHBondContact O-OG1 3Å; Q28-T32 VanDerWaalsContact O-OG1 3.12Å; Q28-Y64 HydrophobicContact CB-CD1 4.21Å; Q28-Y64 HydrophobicContact CB-CE1 4.44Å; Q28-Y64 HydrophobicContact CG-CD1 4.27Å; Q28-K65 PolarHBondContact NE2-O 3.23Å; Q28-G66 VanDerWaalsContact NE2-C 3.26Å; Q28-A67 HydrophobicContact CG-CB 4.08Å
29P94.3Very high92.4Very high14 Ų1416.1 Ų16.19%0.09110%0.096CC..Hα-helixtrans-55.9-41.8177.4-26.936.3000112.3L25 T32 I33 F51 L63 Y64L25-P29 WeakPolarHBondContact O-CD 3.32Å; P29-T32 PolarHBondContact O-N 2.87Å; P29-I33 WeakPolarHBondContact O-CG1 3.38Å; P29-I33 PolarHBondContact O-N 2.96Å; P29-I33 VanDerWaalsContact O-N 3.1Å; P29-F51 HydrophobicContact CB-CE2 4.44Å; P29-L63 HydrophobicContact CB-CB 4.18Å; P29-L63 HydrophobicContact CB-CD2 4.47Å; P29-L63 HydrophobicContact CG-CB 4.46Å; P29-Y64 HydrophobicContact CG-CE2 3.97Å
30F94.4Very high92.3Very high35 Ų3516.4 Ų16.415%0.15410%0.098CC..Hα-helixtrans-69.7-38.4179.7-57.6-80.2000112.5G27 Q28 T32 I33 K34 F47 P274 I277 R278 P281G27-F30 PolarHBondContact O-N 2.83Å; G27-F30 VanDerWaalsContact O-N 3.15Å; Q28-F30 PolarHBondContact O-N 2.97Å; F30-T32 VanDerWaalsContact C-N 3.32Å; F30-T32 PolarHBondContact O-N 3.47Å; F30-I33 PolarHBondContact O-N 2.93Å; F30-K34 VanDerWaalsContact O-CB 3.27Å; F30-K34 WeakPolarHBondContact O-CB 3.48Å; F30-K34 PolarHBondContact O-N 2.95Å; F30-F47 HydrophobicContact CD1-CE2 4.07Å; F30-F47 AromaticContact CD1-CZ 3.97Å; F30-F47 HydrophobicContact CD1-CZ 3.97Å; F30-F47 HydrophobicContact CE1-CE2 4.45Å; F30-F47 AromaticContact CE1-CZ 3.89Å; F30-F47 HydrophobicContact CE1-CZ 3.89Å; F30-P274 HydrophobicContact CB-CB 4.5Å; F30-I277 HydrophobicContact CD1-CB 4.4Å; F30-I277 HydrophobicContact CD1-CG2 4.11Å; F30-I277 HydrophobicContact CE1-CB 4.2Å; F30-I277 HydrophobicContact CE1-CG2 3.44Å; F30-I277 VanDerWaalsContact CE1-CG2 3.44Å; F30-I277 HydrophobicContact CZ-CG2 3.97Å; F30-R278 HydrophobicContact CB-CB 3.59Å; F30-R278 HydrophobicContact CB-CG 3.96Å; F30-R278 HydrophobicContact CD2-CB 4.09Å; F30-R278 HydrophobicContact CD2-CG 4.27Å; F30-R278 HydrophobicContact CG-CB 3.85Å; F30-R278 HydrophobicContact CG-CG 4.37Å; F30-P281 HydrophobicContact CD2-CG 4.4Å; F30-P281 HydrophobicContact CE2-CG 3.63Å; F30-P281 HydrophobicContact CZ-CG 4.05Å
31D92Very high92Very high17 Ų1717.5 Ų17.59%0.09110%0.102CC..Hα-helixtrans-61.8-42.4173.9-82.4-5.2000111.8G27 Q28 I33 K34 V35 K131 R278G27-D31 PolarHBondContact O-N 3.24Å; G27-D31 VanDerWaalsContact O-N 3.14Å; Q28-D31 PolarHBondContact O-N 3.42Å; D31-I33 VanDerWaalsContact C-N 3.35Å; D31-K34 WeakPolarHBondContact O-CB 3.42Å; D31-K34 PolarHBondContact O-N 3.16Å; D31-V35 WeakPolarHBondContact O-CG2 3.24Å; D31-V35 PolarHBondContact O-N 2.86Å; D31-K131 IonicContact OD2-NZ 2.96Å; D31-K131 PolarHBondContact OD2-NZ 3.44Å; D31-R278 WeakPolarHBondContact OD1-CD 3.28Å; D31-R278 IonicContact OD1-CZ 3.12Å; D31-R278 IonicContact OD1-NE 2.59Å; D31-R278 PolarHBondContact OD1-NE 2.68Å; D31-R278 IonicContact OD1-NH1 2.71Å; D31-R278 PolarHBondContact OD1-NH1 3.05Å; D31-R278 IonicContact OD2-CZ 3.3Å; D31-R278 IonicContact OD2-NH1 3.62Å; D31-R278 PolarHBondContact OD2-NH1 2.93Å; D31-R278 IonicContact OD2-NH2 3.92Å
32T92.3Very high91.6Very high0 Ų020.3 Ų20.30%013%0.125CC..Hα-helixtrans-62.4-45.6179.3-61.90000110.6Q28 P29 F30 V35 K36 L63 Q135Q28-T32 PolarHBondContact O-N 3.42Å; Q28-T32 PolarHBondContact O-OG1 3Å; Q28-T32 VanDerWaalsContact O-OG1 3.12Å; P29-T32 PolarHBondContact O-N 2.87Å; F30-T32 VanDerWaalsContact C-N 3.32Å; F30-T32 PolarHBondContact O-N 3.47Å; T32-V35 PolarHBondContact O-N 3.34Å; T32-K36 HydrophobicContact CG2-CD 4.3Å; T32-K36 VanDerWaalsContact O-CG 3.31Å; T32-K36 WeakPolarHBondContact O-CG 3.27Å; T32-K36 PolarHBondContact O-N 3.47Å; T32-K36 VanDerWaalsContact O-N 3.11Å; T32-L63 WeakPolarHBondContact CB-O 3.44Å; T32-L63 PolarHBondContact OG1-O 3.19Å; T32-Q135 HydrophobicContact CG2-CB 4.25Å; T32-Q135 HydrophobicContact CG2-CG 4.22Å; T32-Q135 PolarHBondContact OG1-NE2 3.3Å
33I94Very high91.3Very high0 Ų021.7 Ų21.70%013%0.127CC..Hα-helixtrans-66-41.5176.7-61.3-46.8000111.8P29 F30 D31 V35 K36 M37 F47 C50 F51 T54 L63 P274P29-I33 WeakPolarHBondContact O-CG1 3.38Å; P29-I33 PolarHBondContact O-N 2.96Å; P29-I33 VanDerWaalsContact O-N 3.1Å; F30-I33 PolarHBondContact O-N 2.93Å; D31-I33 VanDerWaalsContact C-N 3.35Å; I33-V35 PolarHBondContact O-N 3.39Å; I33-K36 HydrophobicContact CD1-CD 4.47Å; I33-K36 PolarHBondContact O-N 3.35Å; I33-M37 HydrophobicContact CG2-CG 4.21Å; I33-M37 HydrophobicContact CG2-SD 3.93Å; I33-M37 WeakPolarHBondContact O-CB 3.3Å; I33-M37 VanDerWaalsContact O-CG 3.31Å; I33-M37 WeakPolarHBondContact O-CG 3.19Å; I33-M37 PolarHBondContact O-N 3.21Å; I33-F47 HydrophobicContact CB-CD2 4.4Å; I33-F47 HydrophobicContact CB-CE2 4.33Å; I33-F47 HydrophobicContact CG2-CD2 3.6Å; I33-F47 HydrophobicContact CG2-CE2 4Å; I33-C50 HydrophobicContact CG2-CB 3.78Å; I33-F51 HydrophobicContact CD1-CB 4.37Å; I33-F51 HydrophobicContact CD1-CD2 4.5Å; I33-F51 HydrophobicContact CG1-CB 4.25Å; I33-F51 HydrophobicContact CG1-CD2 4.01Å; I33-T54 HydrophobicContact CD1-CG2 4.41Å; I33-T54 WeakPolarHBondContact CD1-OG1 3.39Å; I33-L63 HydrophobicContact CD1-CD2 3.89Å; I33-L63 HydrophobicContact CG1-CD2 4.27Å; I33-P274 HydrophobicContact CG2-CG 4.42Å
34K94Very high91.1Very high20 Ų2021.7 Ų21.79%0.08712%0.124CC..Hα-helixtrans-53.9-54.1174174.4-162.5170.2-174.90111F30 D31 K36 M37 Q38 D234 P274 T275F30-K34 VanDerWaalsContact O-CB 3.27Å; F30-K34 WeakPolarHBondContact O-CB 3.48Å; F30-K34 PolarHBondContact O-N 2.95Å; D31-K34 WeakPolarHBondContact O-CB 3.42Å; D31-K34 PolarHBondContact O-N 3.16Å; K34-K36 PolarHBondContact O-N 3.19Å; K34-M37 PolarHBondContact O-N 3.27Å; K34-Q38 HydrophobicContact CG-CG 4.39Å; K34-Q38 WeakPolarHBondContact O-CB 3.33Å; K34-Q38 WeakPolarHBondContact O-CG 3.02Å; K34-Q38 PolarHBondContact O-N 3.23Å; K34-D234 WeakPolarHBondContact CE-OD2 3.31Å; K34-D234 IonicContact NZ-OD1 2.79Å; K34-D234 IonicContact NZ-OD2 3.91Å; K34-D234 PolarHBondContact NZ-OD2 3.32Å; K34-P274 HydrophobicContact CB-CG 4.3Å; K34-T275 WeakPolarHBondContact CD-OG1 3.13Å
35V91.6Very high90.8Very high7 Ų732.6 Ų32.64%0.04217%0.165CC..Hα-helixtrans-63.2-41.1-176.9169.70000111.7D31 T32 I33 Q38 T39 C132 Q135 V242D31-V35 WeakPolarHBondContact O-CG2 3.24Å; D31-V35 PolarHBondContact O-N 2.86Å; T32-V35 PolarHBondContact O-N 3.34Å; I33-V35 PolarHBondContact O-N 3.39Å; V35-Q38 PolarHBondContact O-N 3.17Å; V35-T39 VanDerWaalsContact O-CB 3.28Å; V35-T39 WeakPolarHBondContact O-CB 3.35Å; V35-T39 PolarHBondContact O-N 3.32Å; V35-T39 PolarHBondContact O-OG1 3.06Å; V35-C132 HydrophobicContact CG1-CB 4.25Å; V35-Q135 HydrophobicContact CB-CB 4.34Å; V35-Q135 HydrophobicContact CG1-CB 4.18Å; V35-V242 HydrophobicContact CG1-CG2 4.24Å
36K92.4Very high90.6Very high4 Ų430.3 Ų30.32%0.01716%0.158CC..Hα-helixtrans-60.7-46.7175.1-72.5175.5-171.5-75.20111.7T32 I33 K34 T39 F40 Y44 Q135 E139T32-K36 HydrophobicContact CG2-CD 4.3Å; T32-K36 VanDerWaalsContact O-CG 3.31Å; T32-K36 WeakPolarHBondContact O-CG 3.27Å; T32-K36 PolarHBondContact O-N 3.47Å; T32-K36 VanDerWaalsContact O-N 3.11Å; I33-K36 HydrophobicContact CD1-CD 4.47Å; I33-K36 PolarHBondContact O-N 3.35Å; K34-K36 PolarHBondContact O-N 3.19Å; K36-T39 PolarHBondContact O-N 2.92Å; K36-F40 PolarHBondContact O-N 3.18Å; K36-Y44 HydrophobicContact CB-CE2 3.86Å; K36-Q135 VanDerWaalsContact CE-O 3.27Å; K36-Q135 WeakPolarHBondContact CE-O 3.5Å; K36-Q135 PolarHBondContact NZ-O 3.15Å; K36-E139 IonicContact NZ-OE1 3.48Å; K36-E139 PolarHBondContact NZ-OE1 2.96Å; K36-E139 IonicContact NZ-OE2 2.82Å; K36-E139 PolarHBondContact NZ-OE2 3.29Å
37M92.1Very high90.4Very high17 Ų1730.3 Ų30.38%0.08416%0.155CC..Hα-helixtrans-66.8-39.3178.4-73.6-174.968.500113.3I33 K34 T39 F47 C50 S270 P274I33-M37 HydrophobicContact CG2-CG 4.21Å; I33-M37 HydrophobicContact CG2-SD 3.93Å; I33-M37 WeakPolarHBondContact O-CB 3.3Å; I33-M37 VanDerWaalsContact O-CG 3.31Å; I33-M37 WeakPolarHBondContact O-CG 3.19Å; I33-M37 PolarHBondContact O-N 3.21Å; K34-M37 PolarHBondContact O-N 3.27Å; M37-T39 VanDerWaalsContact C-N 3.32Å; M37-F47 HydrophobicContact SD-CB 4.25Å; M37-C50 HydrophobicContact CG-CB 4.01Å; M37-C50 HydrophobicContact SD-CB 4.4Å; M37-S270 PolarHBondContact O-OG 3.47Å; M37-P274 HydrophobicContact SD-CG 4.15Å
38Q89.4Confident90.4Very high0 Ų035.4 Ų35.40%018%0.181CC..Hα-helixtrans-66.5-36.5177.3-77.4178.7-26.400111.6K34 V35 Y231 D234 C235 S238 R239 S270K34-Q38 HydrophobicContact CG-CG 4.39Å; K34-Q38 WeakPolarHBondContact O-CB 3.33Å; K34-Q38 WeakPolarHBondContact O-CG 3.02Å; K34-Q38 PolarHBondContact O-N 3.23Å; V35-Q38 PolarHBondContact O-N 3.17Å; Q38-Y231 PolarHBondContact NE2-OH 3.5Å; Q38-Y231 VanDerWaalsContact NE2-OH 3.08Å; Q38-D234 PolarHBondContact NE2-OD2 3.4Å; Q38-C235 HydrophobicContact CG-CB 4.42Å; Q38-S238 VanDerWaalsContact OE1-CB 3.3Å; Q38-S238 PolarHBondContact OE1-OG 3.04Å; Q38-R239 VanDerWaalsContact O-CZ 3.3Å; Q38-R239 PolarHBondContact O-NE 2.84Å; Q38-R239 PolarHBondContact O-NH2 2.79Å; Q38-R239 VanDerWaalsContact O-NH2 3.08Å; Q38-S270 WeakPolarHBondContact CG-O 3.5Å
39T88.1Confident90.5Very high0 Ų039.3 Ų39.30%020%0.199CC..Hα-helixtrans-89.4-39.7-173.4-49.60000112.6V35 K36 M37 P41 V242 Y243V35-T39 VanDerWaalsContact O-CB 3.28Å; V35-T39 WeakPolarHBondContact O-CB 3.35Å; V35-T39 PolarHBondContact O-N 3.32Å; V35-T39 PolarHBondContact O-OG1 3.06Å; K36-T39 PolarHBondContact O-N 2.92Å; M37-T39 VanDerWaalsContact C-N 3.32Å; T39-P41 VanDerWaalsContact C-CD 3.42Å; T39-P41 WeakPolarHBondContact O-CD 3.2Å; T39-V242 HydrophobicContact CG2-CB 3.84Å; T39-V242 HydrophobicContact CG2-CG1 3.74Å; T39-V242 HydrophobicContact CG2-CG2 4.26Å; T39-Y243 HydrophobicContact CG2-CD1 4.12Å; T39-Y243 HydrophobicContact CG2-CE1 3.4Å; T39-Y243 VanDerWaalsContact CG2-CE1 3.4Å; T39-Y243 HydrophobicContact CG2-CE2 4.16Å; T39-Y243 VanDerWaalsContact CG2-CZ 3.45Å; T39-Y243 PolarHBondContact O-OH 2.86Å
40F88.9Confident90.4Very high6 Ų638.7 Ų38.73%0.02620%0.195CC..  trans-124.663.4-174.9-56.2-86.3000112K36 S42 M43 Y44 A136 E139 M140 T143 K145 V242 Y243K36-F40 PolarHBondContact O-N 3.18Å; F40-S42 VanDerWaalsContact C-N 3.27Å; F40-S42 PolarHBondContact O-N 3.49Å; F40-M43 HydrophobicContact CB-CB 4.29Å; F40-M43 HydrophobicContact CB-CE 3.63Å; F40-M43 HydrophobicContact CB-CG 4.16Å; F40-M43 HydrophobicContact CD1-CE 3.78Å; F40-M43 HydrophobicContact CD2-CE 4.36Å; F40-M43 HydrophobicContact CG-CE 3.68Å; F40-M43 PolarHBondContact O-N 2.9Å; F40-M43 VanDerWaalsContact O-N 3.15Å; F40-Y44 HydrophobicContact CB-CE2 4.46Å; F40-A136 HydrophobicContact CE2-CB 3.94Å; F40-E139 HydrophobicContact CD1-CB 4.18Å; F40-E139 HydrophobicContact CD2-CB 3.47Å; F40-E139 VanDerWaalsContact CD2-CB 3.47Å; F40-E139 HydrophobicContact CD2-CG 3.89Å; F40-E139 HydrophobicContact CE1-CB 4.04Å; F40-E139 HydrophobicContact CE2-CB 3.32Å; F40-E139 HydrophobicContact CE2-CG 4.17Å; F40-E139 HydrophobicContact CG-CB 3.91Å; F40-E139 HydrophobicContact CG-CG 4.34Å; F40-E139 HydrophobicContact CZ-CB 3.62Å; F40-M140 HydrophobicContact CE2-CG 4.4Å; F40-M140 HydrophobicContact CZ-CG 3.73Å; F40-T143 HydrophobicContact CD1-CG2 4.16Å; F40-T143 HydrophobicContact CE1-CG2 4.07Å; F40-K145 HydrophobicContact CE1-CD 4.49Å; F40-V242 HydrophobicContact CE2-CG1 4.5Å; F40-Y243 AromaticContact CE1-CE1 3.97Å; F40-Y243 HydrophobicContact CE1-CE1 3.97Å; F40-Y243 AromaticContact CZ-CE1 3.99Å; F40-Y243 HydrophobicContact CZ-CE1 3.99Å
41P83.5Confident90.3Very high34 Ų3440.4 Ų40.422%0.22120%0.202CC..G310 helixtrans-65.3-27.9-174.525.7-33.9000113.5T39 M43 Y44 E263T39-P41 VanDerWaalsContact C-CD 3.42Å; T39-P41 WeakPolarHBondContact O-CD 3.2Å; P41-M43 VanDerWaalsContact C-N 3.27Å; P41-M43 PolarHBondContact O-N 3.3Å; P41-Y44 VanDerWaalsContact O-O 3.12Å; P41-E263 WeakPolarHBondContact CG-OE2 3.42Å
42S85.3Confident90.4Very high118 Ų11843.2 Ų43.283%0.82522%0.216SC*.G310 helixtrans-71-20177.556.50000113.8F40F40-S42 VanDerWaalsContact C-N 3.27Å; F40-S42 PolarHBondContact O-N 3.49Å
43M86.9Confident90.4Very high55 Ų5544.3 Ų44.327%0.27122%0.224SC..G310 helixtrans-86.5-17.4-178.2-61.2-150.5-60.800113.2F40 P41 E139 T143F40-M43 HydrophobicContact CB-CB 4.29Å; F40-M43 HydrophobicContact CB-CE 3.63Å; F40-M43 HydrophobicContact CB-CG 4.16Å; F40-M43 HydrophobicContact CD1-CE 3.78Å; F40-M43 HydrophobicContact CD2-CE 4.36Å; F40-M43 HydrophobicContact CG-CE 3.68Å; F40-M43 PolarHBondContact O-N 2.9Å; F40-M43 VanDerWaalsContact O-N 3.15Å; P41-M43 VanDerWaalsContact C-N 3.27Å; P41-M43 PolarHBondContact O-N 3.3Å; M43-E139 HydrophobicContact CE-CB 3.35Å; M43-E139 HydrophobicContact CE-CG 3.32Å; M43-T143 HydrophobicContact CE-CG2 4.24Å; M43-T143 HydrophobicContact SD-CG2 3.87Å
44Y89Confident90.3Very high19 Ų1944.3 Ų44.38%0.07522%0.224CC..  trans-130.9125.6-174.6-55.5-67.6000112K36 F40 P41 G46 C50 E139K36-Y44 HydrophobicContact CB-CE2 3.86Å; F40-Y44 HydrophobicContact CB-CE2 4.46Å; P41-Y44 VanDerWaalsContact O-O 3.12Å; Y44-G46 PolarHBondContact O-N 3.18Å; Y44-C50 VanDerWaalsContact CD1-CA 3.48Å; Y44-C50 HydrophobicContact CD1-CB 3.63Å; Y44-C50 HydrophobicContact CD2-CB 4.28Å; Y44-C50 HydrophobicContact CE1-CB 4.21Å; Y44-C50 HydrophobicContact CG-CB 3.66Å; Y44-C50 VanDerWaalsContact CG-SG 3.57Å; Y44-E139 HydrophobicContact CE2-CG 4.24Å; Y44-E139 VanDerWaalsContact OH-CG 3.23Å; Y44-E139 WeakPolarHBondContact OH-CG 3.46Å; Y44-E139 PolarHBondContact OH-OE1 3.04Å
45R85.2Confident90.2Very high237 Ų23748.1 Ų48.189%0.89424%0.241SC*.SBendtrans-72.9-13.4177.6-61-178.8-178.2-1780.3113.8H49R45-H49 HydrophobicContact CB-CB 4.48Å
46G88.8Confident90.2Very high23 Ų2355.9 Ų55.924%0.23727%0.274CS..SBendtrans165.2-177.6-178.200000113Y44 H49 C50Y44-G46 PolarHBondContact O-N 3.18Å; G46-H49 PolarHBondContact O-N 3.34Å; G46-C50 WeakPolarHBondContact O-CB 3.35Å; G46-C50 PolarHBondContact O-N 3.42Å
47F91Very high89.9Confident30 Ų3059.8 Ų59.813%0.13229%0.293CS..Hα-helixtrans-55.6-54.9-176.6168.9-116.2000113.2F30 I33 M37 H49 C50 F51 T273 P274 I277F30-F47 HydrophobicContact CD1-CE2 4.07Å; F30-F47 AromaticContact CD1-CZ 3.97Å; F30-F47 HydrophobicContact CD1-CZ 3.97Å; F30-F47 HydrophobicContact CE1-CE2 4.45Å; F30-F47 AromaticContact CE1-CZ 3.89Å; F30-F47 HydrophobicContact CE1-CZ 3.89Å; I33-F47 HydrophobicContact CB-CD2 4.4Å; I33-F47 HydrophobicContact CB-CE2 4.33Å; I33-F47 HydrophobicContact CG2-CD2 3.6Å; I33-F47 HydrophobicContact CG2-CE2 4Å; M37-F47 HydrophobicContact SD-CB 4.25Å; F47-H49 VanDerWaalsContact C-N 3.33Å; F47-H49 PolarHBondContact O-N 3.26Å; F47-C50 PolarHBondContact O-N 3.4Å; F47-F51 WeakPolarHBondContact O-CB 3.43Å; F47-F51 PolarHBondContact O-N 3.33Å; F47-T273 HydrophobicContact CB-CG2 4.46Å; F47-P274 HydrophobicContact CD2-CB 3.58Å; F47-P274 HydrophobicContact CD2-CG 3.88Å; F47-P274 HydrophobicContact CE2-CB 3.76Å; F47-I277 HydrophobicContact CD1-CD1 4Å; F47-I277 HydrophobicContact CE1-CD1 3.77Å; F47-I277 HydrophobicContact CZ-CD1 4.41Å
48I93.2Very high89.6Confident108 Ų10861.1 Ų61.155%0.55430%0.302SS*.Hα-helixtrans-63-42.1-176.4-58.7-62.2000111F51 I52I48-F51 PolarHBondContact O-N 3.32Å; I48-I52 HydrophobicContact CG2-CD1 3.65Å; I48-I52 HydrophobicContact CG2-CG1 4.36Å; I48-I52 WeakPolarHBondContact O-CB 3.28Å; I48-I52 VanDerWaalsContact O-CG1 3.31Å; I48-I52 WeakPolarHBondContact O-CG1 3.48Å; I48-I52 PolarHBondContact O-N 2.89Å
49H93.7Very high89.6Confident82 Ų8262.2 Ų62.238%0.3831%0.313SS..Hα-helixtrans-62.4-47.8176.8-173.4-94.8000111R45 G46 F47 F51 I52 S53R45-H49 HydrophobicContact CB-CB 4.48Å; G46-H49 PolarHBondContact O-N 3.34Å; F47-H49 VanDerWaalsContact C-N 3.33Å; F47-H49 PolarHBondContact O-N 3.26Å; H49-F51 VanDerWaalsContact C-N 3.34Å; H49-F51 PolarHBondContact O-N 3.03Å; H49-I52 PolarHBondContact O-N 3.47Å; H49-S53 VanDerWaalsContact O-CB 3.25Å; H49-S53 WeakPolarHBondContact O-CB 3.24Å; H49-S53 PolarHBondContact O-N 2.82Å; H49-S53 PolarHBondContact O-OG 3.19Å
50C92.3Very high89.7Confident0 Ų067.5 Ų67.50%034%0.34CS..Hα-helixtrans-60.9-41.8177.6-168.90000112.4I33 M37 Y44 G46 F47 T54I33-C50 HydrophobicContact CG2-CB 3.78Å; M37-C50 HydrophobicContact CG-CB 4.01Å; M37-C50 HydrophobicContact SD-CB 4.4Å; Y44-C50 VanDerWaalsContact CD1-CA 3.48Å; Y44-C50 HydrophobicContact CD1-CB 3.63Å; Y44-C50 HydrophobicContact CD2-CB 4.28Å; Y44-C50 HydrophobicContact CE1-CB 4.21Å; Y44-C50 HydrophobicContact CG-CB 3.66Å; Y44-C50 VanDerWaalsContact CG-SG 3.57Å; G46-C50 WeakPolarHBondContact O-CB 3.35Å; G46-C50 PolarHBondContact O-N 3.42Å; F47-C50 PolarHBondContact O-N 3.4Å; C50-T54 VanDerWaalsContact O-CB 3.31Å; C50-T54 WeakPolarHBondContact O-CB 3.49Å; C50-T54 PolarHBondContact O-N 3.14Å; C50-T54 PolarHBondContact O-OG1 2.93Å
51F93.5Very high89.5Confident71 Ų7169.6 Ų69.631%0.31136%0.364SS..Hα-helixtrans-61.8-52.3177.5-174.7-88.6000112P29 I33 F47 I48 H49 T54 F55 L63P29-F51 HydrophobicContact CB-CE2 4.44Å; I33-F51 HydrophobicContact CD1-CB 4.37Å; I33-F51 HydrophobicContact CD1-CD2 4.5Å; I33-F51 HydrophobicContact CG1-CB 4.25Å; I33-F51 HydrophobicContact CG1-CD2 4.01Å; F47-F51 WeakPolarHBondContact O-CB 3.43Å; F47-F51 PolarHBondContact O-N 3.33Å; I48-F51 PolarHBondContact O-N 3.32Å; H49-F51 VanDerWaalsContact C-N 3.34Å; H49-F51 PolarHBondContact O-N 3.03Å; F51-T54 PolarHBondContact O-N 3.13Å; F51-F55 WeakPolarHBondContact O-CB 3.48Å; F51-F55 PolarHBondContact O-N 2.96Å; F51-L63 HydrophobicContact CD2-CD2 4.06Å; F51-L63 HydrophobicContact CE2-CD1 3.8Å; F51-L63 HydrophobicContact CE2-CD2 4.01Å; F51-L63 HydrophobicContact CZ-CD1 3.88Å
52I93.3Very high89.6Confident76 Ų7668 Ų6839%0.3935%0.354SS..Hα-helixtrans-64.7-43.4-179.7-65.7171.1000110.7I48 H49 F55 K56I48-I52 HydrophobicContact CG2-CD1 3.65Å; I48-I52 HydrophobicContact CG2-CG1 4.36Å; I48-I52 WeakPolarHBondContact O-CB 3.28Å; I48-I52 VanDerWaalsContact O-CG1 3.31Å; I48-I52 WeakPolarHBondContact O-CG1 3.48Å; I48-I52 PolarHBondContact O-N 2.89Å; H49-I52 PolarHBondContact O-N 3.47Å; I52-F55 PolarHBondContact O-N 3Å; I52-K56 HydrophobicContact CG2-CD 3.97Å; I52-K56 HydrophobicContact CG2-CG 4.33Å; I52-K56 WeakPolarHBondContact O-CB 3.34Å; I52-K56 WeakPolarHBondContact O-CG 3.49Å; I52-K56 PolarHBondContact O-N 2.96Å
53S91.5Very high89.8Confident23 Ų2362.6 Ų62.616%0.16132%0.316CS..Hα-helixtrans-60.4-47177-67.80000111.4H49 F55 K56 Q57H49-S53 VanDerWaalsContact O-CB 3.25Å; H49-S53 WeakPolarHBondContact O-CB 3.24Å; H49-S53 PolarHBondContact O-N 2.82Å; H49-S53 PolarHBondContact O-OG 3.19Å; S53-F55 VanDerWaalsContact C-N 3.32Å; S53-F55 PolarHBondContact O-N 3.42Å; S53-K56 PolarHBondContact O-N 3.22Å; S53-Q57 VanDerWaalsContact O-CB 3.31Å; S53-Q57 WeakPolarHBondContact O-CB 3.44Å; S53-Q57 VanDerWaalsContact O-CG 3.26Å; S53-Q57 WeakPolarHBondContact O-CG 3.16Å; S53-Q57 PolarHBondContact O-N 3.08Å; S53-Q57 PolarHBondContact O-OE1 3.46Å
54T91.8Very high90.1Very high0 Ų064.7 Ų64.70%032%0.321CS..Hα-helixtrans-59.9-44.6177.9-59.20000111.2I33 C50 F51 Q57 V58 G59 L63I33-T54 HydrophobicContact CD1-CG2 4.41Å; I33-T54 WeakPolarHBondContact CD1-OG1 3.39Å; C50-T54 VanDerWaalsContact O-CB 3.31Å; C50-T54 WeakPolarHBondContact O-CB 3.49Å; C50-T54 PolarHBondContact O-N 3.14Å; C50-T54 PolarHBondContact O-OG1 2.93Å; F51-T54 PolarHBondContact O-N 3.13Å; T54-Q57 PolarHBondContact O-N 2.89Å; T54-V58 PolarHBondContact O-N 3.4Å; T54-G59 PolarHBondContact O-N 3.11Å; T54-L63 HydrophobicContact CG2-CD2 3.87Å; T54-L63 HydrophobicContact CG2-CG 4.36Å
55F92.4Very high90Very high100 Ų10066 Ų6644%0.43933%0.328SS..Hα-helixtrans-63.8-40.8178-173.4-90.7000112F51 I52 S53 G59 L60 L63F51-F55 WeakPolarHBondContact O-CB 3.48Å; F51-F55 PolarHBondContact O-N 2.96Å; I52-F55 PolarHBondContact O-N 3Å; S53-F55 VanDerWaalsContact C-N 3.32Å; S53-F55 PolarHBondContact O-N 3.42Å; F55-G59 WeakPolarHBondContact O-CA 3.15Å; F55-G59 PolarHBondContact O-N 2.86Å; F55-L60 HydrophobicContact CD2-CD2 4.13Å; F55-L60 HydrophobicContact CD2-CG 4.42Å; F55-L60 HydrophobicContact CE2-CD2 3.59Å; F55-L60 HydrophobicContact CE2-CG 3.71Å; F55-L63 HydrophobicContact CD2-CD1 4.25Å
56K91.1Very high90.1Very high171 Ų17155 Ų5574%0.74329%0.288SS*.Hα-helixtrans-72-37.1178.3-73.8-177.6176.9-175.50113.4I52 S53I52-K56 HydrophobicContact CG2-CD 3.97Å; I52-K56 HydrophobicContact CG2-CG 4.33Å; I52-K56 WeakPolarHBondContact O-CB 3.34Å; I52-K56 WeakPolarHBondContact O-CG 3.49Å; I52-K56 PolarHBondContact O-N 2.96Å; S53-K56 PolarHBondContact O-N 3.22Å
57Q87.9Confident90.2Very high86 Ų8654.6 Ų54.640%0.40228%0.282SS..Hα-helixtrans-80.8-42.4-175.5-72169.5-36.200112.8S53 T54S53-Q57 VanDerWaalsContact O-CB 3.31Å; S53-Q57 WeakPolarHBondContact O-CB 3.44Å; S53-Q57 VanDerWaalsContact O-CG 3.26Å; S53-Q57 WeakPolarHBondContact O-CG 3.16Å; S53-Q57 PolarHBondContact O-N 3.08Å; S53-Q57 PolarHBondContact O-OE1 3.46Å; T54-Q57 PolarHBondContact O-N 2.89Å
58V85.5Confident90.3Very high45 Ų4557.5 Ų57.527%0.27330%0.302SS..Hα-helixtrans-122.7-11.8-169.9-167.70000112.4T54 G62 H138T54-V58 PolarHBondContact O-N 3.4Å; V58-G62 VanDerWaalsContact CG1-CA 3.48Å; V58-H138 HydrophobicContact CG2-CB 4.27Å
59G88.9Confident90.2Very high23 Ų2352.5 Ų52.524%0.23728%0.277CS..  trans75.3-169-176.600000113.7T54 F55 G61 G62T54-G59 PolarHBondContact O-N 3.11Å; F55-G59 WeakPolarHBondContact O-CA 3.15Å; F55-G59 PolarHBondContact O-N 2.86Å; G59-G61 PolarHBondContact O-N 2.77Å; G59-G62 PolarHBondContact O-N 3.12Å
60L89.2Confident90Very high110 Ų11048.9 Ų48.958%0.57626%0.261SS*.Hα-helixtrans-57.2-36.3177.5-76172.1000112.8F55 G62 L63 Y64F55-L60 HydrophobicContact CD2-CD2 4.13Å; F55-L60 HydrophobicContact CD2-CG 4.42Å; F55-L60 HydrophobicContact CE2-CD2 3.59Å; F55-L60 HydrophobicContact CE2-CG 3.71Å; L60-G62 PolarHBondContact O-N 3.36Å; L60-L63 HydrophobicContact CD2-CD1 4.49Å; L60-L63 PolarHBondContact O-N 2.79Å; L60-L63 VanDerWaalsContact O-N 3.13Å; L60-Y64 PolarHBondContact O-N 3.24Å
61G86.3Confident90Very high51 Ų5150.8 Ų50.853%0.52627%0.271SS..Hα-helixtrans-58.5-31.6176.500000112.6G59 Y64 K65G59-G61 PolarHBondContact O-N 2.77Å; G61-Y64 PolarHBondContact O-N 2.93Å; G61-K65 WeakPolarHBondContact O-CG 3.31Å; G61-K65 PolarHBondContact O-N 3.43Å; G61-K65 VanDerWaalsContact O-N 3.16Å
62G85.6Confident89.9Confident1 Ų151.9 Ų51.91%0.0128%0.28CS..Hα-helixtrans-64.3-41.3175.900000113.5V58 G59 L60 Y64 K65V58-G62 VanDerWaalsContact CG1-CA 3.48Å; G59-G62 PolarHBondContact O-N 3.12Å; L60-G62 PolarHBondContact O-N 3.36Å; G62-Y64 VanDerWaalsContact C-N 3.32Å; G62-Y64 PolarHBondContact O-N 2.87Å; G62-K65 PolarHBondContact O-N 3.12Å
63L89.8Confident89.7Confident4 Ų448.5 Ų48.52%0.02126%0.263CS..Hα-helixtrans-68.1-32.3-179.7-66.7173.4000112.4P29 T32 I33 F51 T54 F55 L60P29-L63 HydrophobicContact CB-CB 4.18Å; P29-L63 HydrophobicContact CB-CD2 4.47Å; P29-L63 HydrophobicContact CG-CB 4.46Å; T32-L63 WeakPolarHBondContact CB-O 3.44Å; T32-L63 PolarHBondContact OG1-O 3.19Å; I33-L63 HydrophobicContact CD1-CD2 3.89Å; I33-L63 HydrophobicContact CG1-CD2 4.27Å; F51-L63 HydrophobicContact CD2-CD2 4.06Å; F51-L63 HydrophobicContact CE2-CD1 3.8Å; F51-L63 HydrophobicContact CE2-CD2 4.01Å; F51-L63 HydrophobicContact CZ-CD1 3.88Å; T54-L63 HydrophobicContact CG2-CD2 3.87Å; T54-L63 HydrophobicContact CG2-CG 4.36Å; F55-L63 HydrophobicContact CD2-CD1 4.25Å; L60-L63 HydrophobicContact CD2-CD1 4.49Å; L60-L63 PolarHBondContact O-N 2.79Å; L60-L63 VanDerWaalsContact O-N 3.13Å
64Y92Very high89.6Confident98 Ų9849.8 Ų49.838%0.38427%0.268SS..THydrogen-bonded Turntrans-95.44.1-179.9-74.3-93.4000114L25 Q28 P29 L60 G61 G62 G66 A67L25-Y64 HydrophobicContact CD2-CD1 4.45Å; L25-Y64 HydrophobicContact CD2-CE1 4.39Å; L25-Y64 VanDerWaalsContact O-CE1 3.22Å; L25-Y64 WeakPolarHBondContact O-CE1 3.25Å; Q28-Y64 HydrophobicContact CB-CD1 4.21Å; Q28-Y64 HydrophobicContact CB-CE1 4.44Å; Q28-Y64 HydrophobicContact CG-CD1 4.27Å; P29-Y64 HydrophobicContact CG-CE2 3.97Å; L60-Y64 PolarHBondContact O-N 3.24Å; G61-Y64 PolarHBondContact O-N 2.93Å; G62-Y64 VanDerWaalsContact C-N 3.32Å; G62-Y64 PolarHBondContact O-N 2.87Å; Y64-G66 PolarHBondContact O-N 3.11Å; Y64-A67 VanDerWaalsContact O-CB 3.29Å; Y64-A67 WeakPolarHBondContact O-CB 3.45Å; Y64-A67 PolarHBondContact O-N 3.49Å
65K87.6Confident89.4Confident48 Ų4855 Ų5521%0.20930%0.295CS..THydrogen-bonded Turntrans-57129.9171.3-82.6-172.3178.8-177.50109.7Q28 G61 G62 Q135 S152Q28-K65 PolarHBondContact NE2-O 3.23Å; G61-K65 WeakPolarHBondContact O-CG 3.31Å; G61-K65 PolarHBondContact O-N 3.43Å; G61-K65 VanDerWaalsContact O-N 3.16Å; G62-K65 PolarHBondContact O-N 3.12Å; K65-Q135 WeakPolarHBondContact O-CG 3.45Å; K65-S152 WeakPolarHBondContact CE-OG 3.41Å; K65-S152 PolarHBondContact NZ-OG 3.4Å; K65-S152 VanDerWaalsContact NZ-OG 3.11Å
66G87.1Confident89.3Confident6 Ų651.5 Ų51.56%0.06228%0.283CS..THydrogen-bonded Turntrans87.52.6-177.600000115.4Q28 Y64 T68 P69 A70Q28-G66 VanDerWaalsContact NE2-C 3.26Å; Y64-G66 PolarHBondContact O-N 3.11Å; G66-T68 VanDerWaalsContact C-N 3.35Å; G66-T68 PolarHBondContact O-N 3.43Å; G66-P69 WeakPolarHBondContact O-CD 3.31Å; G66-A70 WeakPolarHBondContact O-CB 3.48Å; G66-A70 PolarHBondContact O-N 3.47Å
67A91.3Very high89.2Confident14 Ų1445.7 Ų45.712%0.11626%0.259CS..Hα-helixtrans-58-43.7178.200000112.7Q28 Y64 A70 L71Q28-A67 HydrophobicContact CG-CB 4.08Å; Y64-A67 VanDerWaalsContact O-CB 3.29Å; Y64-A67 WeakPolarHBondContact O-CB 3.45Å; Y64-A67 PolarHBondContact O-N 3.49Å; A67-A70 WeakPolarHBondContact O-CB 3.44Å; A67-A70 PolarHBondContact O-N 3.21Å; A67-L71 WeakPolarHBondContact O-CG 3.23Å; A67-L71 PolarHBondContact O-N 2.71Å
68T91.4Very high89.1Confident90 Ų9044.5 Ų44.555%0.55226%0.255SS*.Hα-helixtrans-63.5-51.4179.5-51.20000112.3G66 A70 L71 L72G66-T68 VanDerWaalsContact C-N 3.35Å; G66-T68 PolarHBondContact O-N 3.43Å; T68-A70 PolarHBondContact O-N 3.17Å; T68-L71 PolarHBondContact O-N 3.42Å; T68-L72 WeakPolarHBondContact O-CG 3.44Å; T68-L72 PolarHBondContact O-N 3.47Å
69P91.6Very high89.2Confident4 Ų445.2 Ų45.23%0.02627%0.265CS..Hα-helixtrans-57.7-33.8170.2-27.335000114.2G66 L72 A73 V130 K131 L134 V154G66-P69 WeakPolarHBondContact O-CD 3.31Å; P69-L72 PolarHBondContact O-N 3.26Å; P69-A73 VanDerWaalsContact O-CB 3.24Å; P69-A73 WeakPolarHBondContact O-CB 3.46Å; P69-A73 PolarHBondContact O-N 3Å; P69-V130 HydrophobicContact CB-CG1 4.47Å; P69-V130 HydrophobicContact CG-CG1 3.93Å; P69-K131 HydrophobicContact CB-CB 3.92Å; P69-L134 HydrophobicContact CG-CD1 3.98Å; P69-V154 HydrophobicContact CG-CG1 4.22Å; P69-V154 HydrophobicContact CG-CG2 3.86Å
70A90.7Very high89.3Confident6 Ų646 Ų465%0.0527%0.265CS..Hα-helixtrans-66.8-41.1177.100000112.7V24 G66 A67 T68 A73 N74 K131V24-A70 HydrophobicContact CG1-CB 3.76Å; G66-A70 WeakPolarHBondContact O-CB 3.48Å; G66-A70 PolarHBondContact O-N 3.47Å; A67-A70 WeakPolarHBondContact O-CB 3.44Å; A67-A70 PolarHBondContact O-N 3.21Å; T68-A70 PolarHBondContact O-N 3.17Å; A70-A73 WeakPolarHBondContact O-CB 3.46Å; A70-A73 PolarHBondContact O-N 2.98Å; A70-N74 PolarHBondContact O-N 3.22Å; A70-K131 HydrophobicContact CB-CD 3.72Å; A70-K131 HydrophobicContact CB-CG 4.34Å
71L91.9Very high89.2Confident40 Ų4042.6 Ų42.621%0.20925%0.248CC..Hα-helixtrans-63.5-46.4173.8-75.1167.7000111T21 V24 A67 T68 A73 N74 I75T21-L71 HydrophobicContact CG2-CD2 4.13Å; V24-L71 HydrophobicContact CB-CD2 3.58Å; V24-L71 HydrophobicContact CB-CG 4.18Å; V24-L71 HydrophobicContact CG1-CD2 3.77Å; V24-L71 HydrophobicContact CG1-CG 3.77Å; V24-L71 HydrophobicContact CG2-CD2 3.93Å; A67-L71 WeakPolarHBondContact O-CG 3.23Å; A67-L71 PolarHBondContact O-N 2.71Å; T68-L71 PolarHBondContact O-N 3.42Å; L71-A73 VanDerWaalsContact C-N 3.33Å; L71-A73 PolarHBondContact O-N 2.96Å; L71-N74 PolarHBondContact O-N 2.89Å; L71-I75 WeakPolarHBondContact O-CG1 3.34Å; L71-I75 PolarHBondContact O-N 3.41Å
72L91.7Very high89.2Confident93 Ų9347.8 Ų47.849%0.48726%0.256SS..Hα-helixtrans-61.5-42176.7-71.2174.7000111.8T68 P69 I75 S76 T127T68-L72 WeakPolarHBondContact O-CG 3.44Å; T68-L72 PolarHBondContact O-N 3.47Å; P69-L72 PolarHBondContact O-N 3.26Å; L72-I75 PolarHBondContact O-N 2.81Å; L72-S76 VanDerWaalsContact O-CB 3.27Å; L72-S76 WeakPolarHBondContact O-CB 3.31Å; L72-S76 PolarHBondContact O-N 2.76Å; L72-S76 PolarHBondContact O-OG 3.38Å; L72-T127 HydrophobicContact CB-CG2 4.14Å
73A89.2Confident89.3Confident6 Ų654.2 Ų54.25%0.0529%0.29CS..Hα-helixtrans-55.9-52.8174.500000110.6P69 A70 L71 I75 S76 E77 I124 T127P69-A73 VanDerWaalsContact O-CB 3.24Å; P69-A73 WeakPolarHBondContact O-CB 3.46Å; P69-A73 PolarHBondContact O-N 3Å; A70-A73 WeakPolarHBondContact O-CB 3.46Å; A70-A73 PolarHBondContact O-N 2.98Å; L71-A73 VanDerWaalsContact C-N 3.33Å; L71-A73 PolarHBondContact O-N 2.96Å; A73-I75 PolarHBondContact O-N 2.59Å; A73-S76 WeakPolarHBondContact CA-OG 3.26Å; A73-S76 PolarHBondContact O-N 3.37Å; A73-S76 PolarHBondContact O-OG 2.92Å; A73-E77 VanDerWaalsContact O-CB 3.27Å; A73-E77 WeakPolarHBondContact O-CB 3.31Å; A73-E77 PolarHBondContact O-N 3.39Å; A73-I124 HydrophobicContact CB-CD1 4.39Å; A73-I124 HydrophobicContact CB-CG1 3.84Å; A73-T127 WeakPolarHBondContact CA-OG1 3.27Å; A73-T127 VanDerWaalsContact CB-OG1 3.3Å; A73-T127 WeakPolarHBondContact CB-OG1 2.93Å
74N88.5Confident89.4Confident49 Ų4954.5 Ų54.526%0.26229%0.292SS..Hα-helixtrans-59.4-43179.8-174.369.7000112.7V24 A70 L71 N78V24-N74 HydrophobicContact CG2-CB 4.11Å; A70-N74 PolarHBondContact O-N 3.22Å; L71-N74 PolarHBondContact O-N 2.89Å; N74-N78 PolarHBondContact O-N 3.49Å; N74-N78 PolarHBondContact O-ND2 2.85Å; N74-N78 PolarHBondContact OD1-ND2 2.89Å
75I88.8Confident89.1Confident109 Ų10953.2 Ų53.256%0.55929%0.287SS*.Hα-helixtrans-65.7-47.2177.4-65.9165.8000110.5L71 L72 A73 E77 A79L71-I75 WeakPolarHBondContact O-CG1 3.34Å; L71-I75 PolarHBondContact O-N 3.41Å; L72-I75 PolarHBondContact O-N 2.81Å; A73-I75 PolarHBondContact O-N 2.59Å; I75-E77 PolarHBondContact O-N 3.34Å; I75-A79 VanDerWaalsContact O-CB 3.28Å; I75-A79 WeakPolarHBondContact O-CB 3.37Å; I75-A79 PolarHBondContact O-N 2.93Å
76S89.5Confident89Confident28 Ų2852.6 Ų52.620%0.19629%0.294CS..Hα-helixtrans-64.1-41-178.3660000112.6L72 A73 V80L72-S76 VanDerWaalsContact O-CB 3.27Å; L72-S76 WeakPolarHBondContact O-CB 3.31Å; L72-S76 PolarHBondContact O-N 2.76Å; L72-S76 PolarHBondContact O-OG 3.38Å; A73-S76 WeakPolarHBondContact CA-OG 3.26Å; A73-S76 PolarHBondContact O-N 3.37Å; A73-S76 PolarHBondContact O-OG 2.92Å; S76-V80 WeakPolarHBondContact O-CB 3.44Å; S76-V80 WeakPolarHBondContact O-CG2 3.19Å; S76-V80 PolarHBondContact O-N 2.99Å
77E87.7Confident89.1Confident48 Ų4858.1 Ų58.122%0.22432%0.321CS..Hα-helixtrans-62.9-52.9179.1177.5174.7-144.500110.6A73 I75 A79 V80 L81 I124A73-E77 VanDerWaalsContact O-CB 3.27Å; A73-E77 WeakPolarHBondContact O-CB 3.31Å; A73-E77 PolarHBondContact O-N 3.39Å; I75-E77 PolarHBondContact O-N 3.34Å; E77-A79 PolarHBondContact O-N 3.45Å; E77-V80 PolarHBondContact O-N 2.97Å; E77-L81 WeakPolarHBondContact O-CB 3.34Å; E77-L81 PolarHBondContact O-N 3.37Å; E77-I124 HydrophobicContact CB-CD1 4.19Å; E77-I124 HydrophobicContact CG-CD1 4.39Å
78N86.4Confident88.9Confident62 Ų6257.8 Ų57.833%0.33232%0.318SS..Hα-helixtrans-63.1-43.9-179.7-74.7-63.1000111.7N74 V80 L81 F82N74-N78 PolarHBondContact O-N 3.49Å; N74-N78 PolarHBondContact O-ND2 2.85Å; N74-N78 PolarHBondContact OD1-ND2 2.89Å; N78-V80 PolarHBondContact O-N 3.2Å; N78-L81 PolarHBondContact O-N 3.45Å; N78-F82 WeakPolarHBondContact O-CD2 3.45Å; N78-F82 PolarHBondContact O-N 3.42Å
79A88.9Confident88.7Confident59 Ų5955.1 Ų55.149%0.48830%0.299SS..Hα-helixtrans-60.5-47179.400000112.2I75 E77 L83I75-A79 VanDerWaalsContact O-CB 3.28Å; I75-A79 WeakPolarHBondContact O-CB 3.37Å; I75-A79 PolarHBondContact O-N 2.93Å; E77-A79 PolarHBondContact O-N 3.45Å; A79-L83 WeakPolarHBondContact O-CB 3.3Å; A79-L83 PolarHBondContact O-N 3.42Å; A79-L83 VanDerWaalsContact O-N 3.07Å
80V90.3Very high88.4Confident39 Ų3959.3 Ų59.324%0.23632%0.321CS..Hα-helixtrans-72.7-35.8-179.6175.20000111.5S76 E77 N78 L83 S84 F119 A123S76-V80 WeakPolarHBondContact O-CB 3.44Å; S76-V80 WeakPolarHBondContact O-CG2 3.19Å; S76-V80 PolarHBondContact O-N 2.99Å; E77-V80 PolarHBondContact O-N 2.97Å; N78-V80 PolarHBondContact O-N 3.2Å; V80-L83 PolarHBondContact O-N 2.97Å; V80-S84 VanDerWaalsContact O-CB 3.29Å; V80-S84 WeakPolarHBondContact O-CB 3.45Å; V80-S84 PolarHBondContact O-N 2.98Å; V80-S84 PolarHBondContact O-OG 3.27Å; V80-F119 VanDerWaalsContact CG1-C 3.5Å; V80-F119 HydrophobicContact CG1-CB 3.85Å; V80-A123 HydrophobicContact CB-CB 4.22Å; V80-A123 HydrophobicContact CG1-CB 4.49Å; V80-A123 HydrophobicContact CG2-CB 3.69Å
81L86.8Confident88.3Confident40 Ų4061 Ų6121%0.20934%0.335CS..Hα-helixtrans-59.1-52.8173.9-173.971.6000110.3E77 N78 L83 S84 Y85 A116E77-L81 WeakPolarHBondContact O-CB 3.34Å; E77-L81 PolarHBondContact O-N 3.37Å; N78-L81 PolarHBondContact O-N 3.45Å; L81-L83 VanDerWaalsContact C-N 3.35Å; L81-L83 PolarHBondContact O-N 3.06Å; L81-S84 PolarHBondContact O-N 3.04Å; L81-S84 PolarHBondContact O-OG 2.74Å; L81-Y85 WeakPolarHBondContact O-CB 2.88Å; L81-Y85 PolarHBondContact O-N 3.06Å; L81-A116 HydrophobicContact CD1-CB 3.83Å
82F85.6Confident87.9Confident159 Ų15959.5 Ų59.570%0.69733%0.328SS*.Hα-helixtrans-61.5-40.8179.1-79.6-63.8000113N78N78-F82 WeakPolarHBondContact O-CD2 3.45Å; N78-F82 PolarHBondContact O-N 3.42Å
83L89.4Confident87.5Confident137 Ų13757.3 Ų57.372%0.71731%0.313SS*.Hα-helixtrans-64.4-43.3177.9-178.665.8000112.2A79 V80 L81A79-L83 WeakPolarHBondContact O-CB 3.3Å; A79-L83 PolarHBondContact O-N 3.42Å; A79-L83 VanDerWaalsContact O-N 3.07Å; V80-L83 PolarHBondContact O-N 2.97Å; L81-L83 VanDerWaalsContact C-N 3.35Å; L81-L83 PolarHBondContact O-N 3.06Å
84S90.1Very high87.4Confident9 Ų963.7 Ų63.76%0.06335%0.346CS..Hα-helixtrans-85-21.9-175.6610000113.5V80 L81 G86 L87 C88V80-S84 VanDerWaalsContact O-CB 3.29Å; V80-S84 WeakPolarHBondContact O-CB 3.45Å; V80-S84 PolarHBondContact O-N 2.98Å; V80-S84 PolarHBondContact O-OG 3.27Å; L81-S84 PolarHBondContact O-N 3.04Å; L81-S84 PolarHBondContact O-OG 2.74Å; S84-G86 PolarHBondContact O-N 3.48Å; S84-L87 PolarHBondContact O-N 3.45Å; S84-C88 WeakPolarHBondContact O-CB 3.37Å; S84-C88 PolarHBondContact O-N 3.01Å; S84-C88 PolarHBondContact O-SG 3.03Å
85Y86.4Confident87.2Confident72 Ų7267.9 Ų67.928%0.28237%0.367SS..Hα-helixtrans-61-45.5-174-174.8-118.4000112.7L81 L87 C88 Q89 A112 A116L81-Y85 WeakPolarHBondContact O-CB 2.88Å; L81-Y85 PolarHBondContact O-N 3.06Å; Y85-L87 PolarHBondContact O-N 2.66Å; Y85-C88 PolarHBondContact O-N 3.23Å; Y85-Q89 HydrophobicContact CE1-CG 4.26Å; Y85-Q89 HydrophobicContact CE2-CG 4.33Å; Y85-Q89 WeakPolarHBondContact O-CG 3.19Å; Y85-Q89 PolarHBondContact O-N 2.76Å; Y85-Q89 PolarHBondContact OH-NE2 2.96Å; Y85-Q89 VanDerWaalsContact OH-NE2 3.16Å; Y85-A112 HydrophobicContact CE2-CB 4.19Å; Y85-A116 HydrophobicContact CD2-CB 4.48Å
86G85.3Confident86.9Confident34 Ų3466.7 Ų66.735%0.35136%0.362SS..Hα-helixtrans-60.1-45177.300000112.6S84 C88 Q89 D90S84-G86 PolarHBondContact O-N 3.48Å; G86-C88 VanDerWaalsContact C-N 3.32Å; G86-C88 PolarHBondContact O-N 2.94Å; G86-Q89 WeakPolarHBondContact O-CB 3.25Å; G86-Q89 PolarHBondContact O-N 2.93Å; G86-D90 PolarHBondContact O-N 2.92Å; G86-D90 VanDerWaalsContact O-N 3.08Å
87L88.9Confident86.6Confident123 Ų12376.5 Ų76.564%0.64440%0.395SS*.Hα-helixtrans-62.8-39.5176.3-61.2175.2000111.9S84 Y85 D90 A91S84-L87 PolarHBondContact O-N 3.45Å; Y85-L87 PolarHBondContact O-N 2.66Å; L87-D90 PolarHBondContact O-N 3.44Å; L87-A91 PolarHBondContact O-N 3.5Å
88C87.8Confident86.2Confident6 Ų677 Ų774%0.04140%0.398CS..Hα-helixtrans-70.1-35.2178.1-66.10000112.1S84 Y85 G86 A91 V92 A112 L115 A116S84-C88 WeakPolarHBondContact O-CB 3.37Å; S84-C88 PolarHBondContact O-N 3.01Å; S84-C88 PolarHBondContact O-SG 3.03Å; Y85-C88 PolarHBondContact O-N 3.23Å; G86-C88 VanDerWaalsContact C-N 3.32Å; G86-C88 PolarHBondContact O-N 2.94Å; C88-A91 PolarHBondContact O-N 3.36Å; C88-V92 WeakPolarHBondContact O-CG2 3.46Å; C88-V92 PolarHBondContact O-N 3.06Å; C88-A112 HydrophobicContact CB-CB 4.27Å; C88-A112 VanDerWaalsContact CB-O 3.31Å; C88-A112 WeakPolarHBondContact CB-O 3.38Å; C88-L115 HydrophobicContact CB-CB 4.12Å; C88-A116 HydrophobicContact CB-CB 4.26Å; C88-A116 VanDerWaalsContact SG-CA 3.6Å; C88-A116 PolarHBondContact SG-N 3.37Å
89Q86.7Confident85.8Confident35 Ų3580.7 Ų80.716%0.16442%0.417CS..Hα-helixtrans-62.2-43.8172.3-74.1-173.9-21.500111.4Y85 G86 A91 V92 R93 L104 A112Y85-Q89 HydrophobicContact CE1-CG 4.26Å; Y85-Q89 HydrophobicContact CE2-CG 4.33Å; Y85-Q89 WeakPolarHBondContact O-CG 3.19Å; Y85-Q89 PolarHBondContact O-N 2.76Å; Y85-Q89 PolarHBondContact OH-NE2 2.96Å; Y85-Q89 VanDerWaalsContact OH-NE2 3.16Å; G86-Q89 WeakPolarHBondContact O-CB 3.25Å; G86-Q89 PolarHBondContact O-N 2.93Å; Q89-A91 VanDerWaalsContact C-N 3.35Å; Q89-V92 PolarHBondContact O-N 3.43Å; Q89-R93 WeakPolarHBondContact O-CG 3.34Å; Q89-R93 PolarHBondContact O-N 3.01Å; Q89-L104 HydrophobicContact CB-CD1 3.78Å; Q89-L104 HydrophobicContact CG-CD1 3.82Å; Q89-A112 HydrophobicContact CB-CB 4.39Å; Q89-A112 HydrophobicContact CG-CB 3.76Å
90D86.6Confident84.6Confident91 Ų9188.2 Ų88.249%0.48744%0.439SS..Hα-helixtrans-64.2-39.6176.4-72.2-24.5000112.3G86 L87 R93 L94G86-D90 PolarHBondContact O-N 2.92Å; G86-D90 VanDerWaalsContact O-N 3.08Å; L87-D90 PolarHBondContact O-N 3.44Å; D90-R93 PolarHBondContact O-N 3.28Å; D90-R93 IonicContact OD1-CZ 3.85Å; D90-R93 IonicContact OD1-NH1 2.68Å; D90-R93 PolarHBondContact OD1-NH1 3.32Å; D90-L94 WeakPolarHBondContact O-CB 3.46Å; D90-L94 PolarHBondContact O-N 3Å
91A86.9Confident83.4Confident42 Ų4289.5 Ų89.535%0.34746%0.46SS..Hα-helixtrans-61.5-43.8174.100000112L87 C88 Q89 L94 L95L87-A91 PolarHBondContact O-N 3.5Å; C88-A91 PolarHBondContact O-N 3.36Å; Q89-A91 VanDerWaalsContact C-N 3.35Å; A91-L94 PolarHBondContact O-N 2.92Å; A91-L95 VanDerWaalsContact O-CG 3.31Å; A91-L95 WeakPolarHBondContact O-CG 3.11Å; A91-L95 PolarHBondContact O-N 2.96Å
92V84.9Confident82.8Confident9 Ų989.1 Ų89.16%0.05546%0.463CS..Hα-helixtrans-64.2-42.6176.5171.70000111.4C88 Q89 L94 L95 L96 L104 H108 A112 L115C88-V92 WeakPolarHBondContact O-CG2 3.46Å; C88-V92 PolarHBondContact O-N 3.06Å; Q89-V92 PolarHBondContact O-N 3.43Å; V92-L94 VanDerWaalsContact C-N 3.31Å; V92-L94 PolarHBondContact O-N 3.44Å; V92-L95 PolarHBondContact O-N 2.9Å; V92-L96 HydrophobicContact CG1-CD1 3.77Å; V92-L96 WeakPolarHBondContact O-CG 3.27Å; V92-L96 PolarHBondContact O-N 3.4Å; V92-L96 VanDerWaalsContact O-N 3.09Å; V92-L104 HydrophobicContact CG1-CD2 4.13Å; V92-H108 HydrophobicContact CG1-CB 3.99Å; V92-A112 HydrophobicContact CG2-CB 4.06Å; V92-L115 HydrophobicContact CG2-CD1 3.74Å
93R83.6Confident82.2Confident47 Ų4790.3 Ų90.318%0.17747%0.47CS..Hα-helixtrans-58.6-43.7175.3-71174.9-170.9115.45111.6Q89 D90 L96 R97 M98 L104Q89-R93 WeakPolarHBondContact O-CG 3.34Å; Q89-R93 PolarHBondContact O-N 3.01Å; D90-R93 PolarHBondContact O-N 3.28Å; D90-R93 IonicContact OD1-CZ 3.85Å; D90-R93 IonicContact OD1-NH1 2.68Å; D90-R93 PolarHBondContact OD1-NH1 3.32Å; R93-L96 PolarHBondContact O-N 3.47Å; R93-R97 PolarHBondContact O-N 3.39Å; R93-R97 VanDerWaalsContact O-N 3.16Å; R93-M98 PolarHBondContact O-N 2.93Å; R93-L104 HydrophobicContact CG-CD1 4.32Å; R93-L104 HydrophobicContact CG-CD2 3.86Å; R93-L104 HydrophobicContact CG-CG 4.24Å
94L85.7Confident81.4Confident139 Ų13984.2 Ų84.273%0.72844%0.438SS*.Hα-helixtrans-64.6-45.4178.6-176.268.1000112D90 A91 V92 L96 R97D90-L94 WeakPolarHBondContact O-CB 3.46Å; D90-L94 PolarHBondContact O-N 3Å; A91-L94 PolarHBondContact O-N 2.92Å; V92-L94 VanDerWaalsContact C-N 3.31Å; V92-L94 PolarHBondContact O-N 3.44Å; L94-L96 VanDerWaalsContact C-N 3.25Å; L94-L96 PolarHBondContact O-N 3.47Å; L94-R97 PolarHBondContact O-N 3.18Å; L94-R97 VanDerWaalsContact O-N 3.11Å
95L84.8Confident80.8Confident137 Ų13786.9 Ų86.972%0.71746%0.457SS*.Hα-helixtrans-61.2-35.6179.2-74.2170.5000112.3A91 V92 R97A91-L95 VanDerWaalsContact O-CG 3.31Å; A91-L95 WeakPolarHBondContact O-CG 3.11Å; A91-L95 PolarHBondContact O-N 2.96Å; V92-L95 PolarHBondContact O-N 2.9Å; L95-R97 VanDerWaalsContact C-N 3.32Å
96L82.5Confident80.1Confident84 Ų8486.6 Ų86.644%0.4446%0.461SS..THydrogen-bonded Turntrans-88.42.4179.2-64.2172000113.6V92 R93 L94 M98 H108V92-L96 HydrophobicContact CG1-CD1 3.77Å; V92-L96 WeakPolarHBondContact O-CG 3.27Å; V92-L96 PolarHBondContact O-N 3.4Å; V92-L96 VanDerWaalsContact O-N 3.09Å; R93-L96 PolarHBondContact O-N 3.47Å; L94-L96 VanDerWaalsContact C-N 3.25Å; L94-L96 PolarHBondContact O-N 3.47Å; L96-M98 HydrophobicContact CB-CG 3.83Å; L96-M98 HydrophobicContact CB-SD 4.06Å; L96-M98 HydrophobicContact CD1-SD 4.06Å; L96-M98 PolarHBondContact O-N 2.94Å; L96-H108 VanDerWaalsContact CD1-CD2 3.47Å; L96-H108 WeakPolarHBondContact CD1-CD2 3.47Å; L96-H108 VanDerWaalsContact CD1-NE2 3.34Å; L96-H108 WeakPolarHBondContact CD1-NE2 3.2Å
97R83Confident79.5Confident235 Ų23589.6 Ų89.689%0.88747%0.472SS*.THydrogen-bonded Turntrans52.938.1-176.5-57-178.3175.9177.6-1.5112.9R93 L94 L95R93-R97 PolarHBondContact O-N 3.39Å; R93-R97 VanDerWaalsContact O-N 3.16Å; L94-R97 PolarHBondContact O-N 3.18Å; L94-R97 VanDerWaalsContact O-N 3.11Å; L95-R97 VanDerWaalsContact C-N 3.32Å
98M79.2Confident79.1Confident59 Ų5986.1 Ų86.129%0.29145%0.452SS..  trans-86.5150.1176.5-62.4179.274.200110.8R93 L96 A102 L104R93-M98 PolarHBondContact O-N 2.93Å; L96-M98 HydrophobicContact CB-CG 3.83Å; L96-M98 HydrophobicContact CB-SD 4.06Å; L96-M98 HydrophobicContact CD1-SD 4.06Å; L96-M98 PolarHBondContact O-N 2.94Å; M98-A102 HydrophobicContact CB-CB 4.29Å; M98-A102 HydrophobicContact CE-CB 3.78Å; M98-L104 HydrophobicContact SD-CD2 4.45Å
99D77.6Confident78.6Confident138 Ų13889.8 Ų89.874%0.73847%0.467SS*.  trans-61.8147.6174.4-77.3-48.7000112.2G101 A102D99-G101 PolarHBondContact O-N 3.39Å; D99-A102 WeakPolarHBondContact O-CB 3.26Å; D99-A102 PolarHBondContact O-N 3.3Å
100K64.1Low78Confident218 Ų21888.6 Ų88.695%0.94846%0.464SS*.THydrogen-bonded Turntrans-63.3102.4175.7-73.5-174.4177.9-178.40109.4
101G65.5Low77.6Confident66 Ų6686.8 Ų86.868%0.6846%0.458SS*.THydrogen-bonded Turntrans114.8-2.6-179.800000114.8D99 E103D99-G101 PolarHBondContact O-N 3.39Å; G101-E103 PolarHBondContact O-N 2.98Å
102A73.3Confident77.4Confident32 Ų3284.8 Ų84.826%0.26444%0.441SS..PPolyproline II helixtrans-60.4136.9172.100000110.9M98 D99 L104M98-A102 HydrophobicContact CB-CB 4.29Å; M98-A102 HydrophobicContact CE-CB 3.78Å; D99-A102 WeakPolarHBondContact O-CB 3.26Å; D99-A102 PolarHBondContact O-N 3.3Å; A102-L104 PolarHBondContact O-N 2.65Å
103E73.1Confident77.2Confident183 Ų18384.9 Ų84.986%0.85544%0.444SS*.PPolyproline II helixtrans-63126.5176.9-71.6-147.4143.900110.4G101G101-E103 PolarHBondContact O-N 2.98Å
104L72.8Confident77.1Confident9 Ų983.7 Ų83.75%0.04744%0.443CS..PPolyproline II helixtrans-77.9124.7176.2-74.5161.9000108.5Q89 V92 R93 M98 A102 H108 K109Q89-L104 HydrophobicContact CB-CD1 3.78Å; Q89-L104 HydrophobicContact CG-CD1 3.82Å; V92-L104 HydrophobicContact CG1-CD2 4.13Å; R93-L104 HydrophobicContact CG-CD1 4.32Å; R93-L104 HydrophobicContact CG-CD2 3.86Å; R93-L104 HydrophobicContact CG-CG 4.24Å; M98-L104 HydrophobicContact SD-CD2 4.45Å; A102-L104 PolarHBondContact O-N 2.65Å; L104-H108 HydrophobicContact CB-CB 3.97Å; L104-H108 HydrophobicContact CD2-CB 3.41Å; L104-H108 VanDerWaalsContact CD2-CB 3.41Å; L104-H108 HydrophobicContact CG-CB 4.27Å; L104-K109 HydrophobicContact CB-CG 3.86Å; L104-K109 WeakPolarHBondContact O-CE 3.48Å; L104-K109 PolarHBondContact O-NZ 3.48Å
105S77.6Confident77.1Confident65 Ų6580.1 Ų80.146%0.45543%0.425SS..PPolyproline II helixtrans-54.4156165.4-179.60000110.5V107 H108 K109S105-V107 PolarHBondContact O-N 2.69Å; S105-V107 VanDerWaalsContact O-N 3.15Å; S105-H108 WeakPolarHBondContact O-CA 3.46Å; S105-H108 WeakPolarHBondContact O-CB 3.21Å; S105-H108 PolarHBondContact O-N 3.35Å; S105-K109 PolarHBondContact O-N 3.37Å
106D72.4Confident77.2Confident67 Ų6773.6 Ų73.636%0.35839%0.39SS..Hα-helixtrans-56.4-32.9180-63.1-30.6000112.5H108 K109 A110D106-H108 VanDerWaalsContact C-N 3.35Å; D106-H108 PolarHBondContact O-N 2.99Å; D106-K109 PolarHBondContact O-N 3.39Å; D106-K109 IonicContact OD1-NZ 3.64Å; D106-A110 VanDerWaalsContact O-CB 3.28Å; D106-A110 WeakPolarHBondContact O-CB 3.46Å; D106-A110 PolarHBondContact O-N 3.12Å
107V73.1Confident77.3Confident96 Ų9669.7 Ų69.758%0.58237%0.37SS*.Hα-helixtrans-66.2-37173.7-178.60000111.8S105 S111S105-V107 PolarHBondContact O-N 2.69Å; S105-V107 VanDerWaalsContact O-N 3.15Å; V107-S111 WeakPolarHBondContact O-CB 3.43Å; V107-S111 PolarHBondContact O-N 3.25Å; V107-S111 PolarHBondContact O-OG 3.48Å
108H79.3Confident77.5Confident50 Ų5061.2 Ų61.223%0.23134%0.342CS..Hα-helixtrans-74.1-38.6177.8-56.7160.8000111.5V92 L96 L104 S105 D106 A110 S111 A112V92-H108 HydrophobicContact CG1-CB 3.99Å; L96-H108 VanDerWaalsContact CD1-CD2 3.47Å; L96-H108 WeakPolarHBondContact CD1-CD2 3.47Å; L96-H108 VanDerWaalsContact CD1-NE2 3.34Å; L96-H108 WeakPolarHBondContact CD1-NE2 3.2Å; L104-H108 HydrophobicContact CB-CB 3.97Å; L104-H108 HydrophobicContact CD2-CB 3.41Å; L104-H108 VanDerWaalsContact CD2-CB 3.41Å; L104-H108 HydrophobicContact CG-CB 4.27Å; S105-H108 WeakPolarHBondContact O-CA 3.46Å; S105-H108 WeakPolarHBondContact O-CB 3.21Å; S105-H108 PolarHBondContact O-N 3.35Å; D106-H108 VanDerWaalsContact C-N 3.35Å; D106-H108 PolarHBondContact O-N 2.99Å; H108-A110 VanDerWaalsContact C-N 3.34Å; H108-S111 PolarHBondContact O-N 3.14Å; H108-A112 WeakPolarHBondContact O-CB 3.14Å; H108-A112 PolarHBondContact O-N 3.2Å
109K77.9Confident78Confident83 Ų8363.1 Ų63.136%0.36135%0.349SS..Hα-helixtrans-60.9-43.7170.8-68.1173.7-175.8154.30111.1L104 S105 D106 S111 A112 G113L104-K109 HydrophobicContact CB-CG 3.86Å; L104-K109 WeakPolarHBondContact O-CE 3.48Å; L104-K109 PolarHBondContact O-NZ 3.48Å; S105-K109 PolarHBondContact O-N 3.37Å; D106-K109 PolarHBondContact O-N 3.39Å; D106-K109 IonicContact OD1-NZ 3.64Å; K109-S111 VanDerWaalsContact C-N 3.35Å; K109-S111 PolarHBondContact O-N 3.19Å; K109-A112 PolarHBondContact O-N 3.46Å; K109-G113 PolarHBondContact O-N 3.22Å
110A74.4Confident78.5Confident11 Ų1156.8 Ų56.89%0.09132%0.315CS..Hα-helixtrans-61.8-40.9174.800000112.6D106 H108 G113 S114 F189D106-A110 VanDerWaalsContact O-CB 3.28Å; D106-A110 WeakPolarHBondContact O-CB 3.46Å; D106-A110 PolarHBondContact O-N 3.12Å; H108-A110 VanDerWaalsContact C-N 3.34Å; A110-G113 PolarHBondContact O-N 3.19Å; A110-S114 WeakPolarHBondContact O-CB 3.46Å; A110-S114 PolarHBondContact O-N 3.34Å; A110-S114 PolarHBondContact O-OG 3.38Å; A110-F189 HydrophobicContact CB-CB 4.37Å; A110-F189 HydrophobicContact CB-CD1 4.36Å; A110-F189 HydrophobicContact CB-CD2 3.27Å; A110-F189 HydrophobicContact CB-CE2 3.47Å; A110-F189 VanDerWaalsContact CB-CE2 3.47Å; A110-F189 HydrophobicContact CB-CG 3.76Å; A110-F189 HydrophobicContact CB-CZ 4.12Å
111S78.3Confident79.7Confident52 Ų5246.4 Ų46.436%0.36427%0.27SS..Hα-helixtrans-65.5-42.7175.9-59.50000111.5V107 H108 K109 G113 S114 L115V107-S111 WeakPolarHBondContact O-CB 3.43Å; V107-S111 PolarHBondContact O-N 3.25Å; V107-S111 PolarHBondContact O-OG 3.48Å; H108-S111 PolarHBondContact O-N 3.14Å; K109-S111 VanDerWaalsContact C-N 3.35Å; K109-S111 PolarHBondContact O-N 3.19Å; S111-G113 VanDerWaalsContact C-N 3.34Å; S111-G113 PolarHBondContact O-N 3.38Å; S111-S114 PolarHBondContact O-N 2.85Å; S111-L115 WeakPolarHBondContact O-CG 3.43Å; S111-L115 PolarHBondContact O-N 3.46Å
112A83.2Confident80.8Confident0 Ų047 Ų470%026%0.256CS..Hα-helixtrans-62.6-40.617400000111.7Y85 C88 Q89 V92 H108 K109 L115 A116Y85-A112 HydrophobicContact CE2-CB 4.19Å; C88-A112 HydrophobicContact CB-CB 4.27Å; C88-A112 VanDerWaalsContact CB-O 3.31Å; C88-A112 WeakPolarHBondContact CB-O 3.38Å; Q89-A112 HydrophobicContact CB-CB 4.39Å; Q89-A112 HydrophobicContact CG-CB 3.76Å; V92-A112 HydrophobicContact CG2-CB 4.06Å; H108-A112 WeakPolarHBondContact O-CB 3.14Å; H108-A112 PolarHBondContact O-N 3.2Å; K109-A112 PolarHBondContact O-N 3.46Å; A112-L115 PolarHBondContact O-N 2.96Å; A112-A116 VanDerWaalsContact O-CB 3.31Å; A112-A116 WeakPolarHBondContact O-CB 3.26Å; A112-A116 PolarHBondContact O-N 2.93Å
113G80.7Confident81.6Confident11 Ų1147 Ų4711%0.11326%0.256CS..Hα-helixtrans-62.7-40172.600000112.9K109 A110 S111 L115 A116 S117K109-G113 PolarHBondContact O-N 3.22Å; A110-G113 PolarHBondContact O-N 3.19Å; S111-G113 VanDerWaalsContact C-N 3.34Å; S111-G113 PolarHBondContact O-N 3.38Å; G113-L115 VanDerWaalsContact C-N 3.35Å; G113-L115 PolarHBondContact O-N 3.08Å; G113-A116 PolarHBondContact O-N 3.47Å; G113-S117 WeakPolarHBondContact O-CB 3.31Å; G113-S117 PolarHBondContact O-N 3.26Å
114S81.5Confident82.4Confident22 Ų2238.6 Ų38.615%0.15422%0.217CC..Hα-helixtrans-68.4-31.7176.5-57.10000112.9A110 S111 S117A110-S114 WeakPolarHBondContact O-CB 3.46Å; A110-S114 PolarHBondContact O-N 3.34Å; A110-S114 PolarHBondContact O-OG 3.38Å; S111-S114 PolarHBondContact O-N 2.85Å; S114-S117 PolarHBondContact O-OG 2.97Å
115L84.9Confident83.3Confident65 Ų6538.2 Ų38.234%0.3422%0.215SC..Hα-helixtrans-73.4-42.4171.3-71.2171.6000111.2C88 V92 S111 A112 G113 S117 I118C88-L115 HydrophobicContact CB-CB 4.12Å; V92-L115 HydrophobicContact CG2-CD1 3.74Å; S111-L115 WeakPolarHBondContact O-CG 3.43Å; S111-L115 PolarHBondContact O-N 3.46Å; A112-L115 PolarHBondContact O-N 2.96Å; G113-L115 VanDerWaalsContact C-N 3.35Å; G113-L115 PolarHBondContact O-N 3.08Å; L115-S117 PolarHBondContact O-N 3.38Å; L115-I118 HydrophobicContact CD2-CD1 4.47Å; L115-I118 WeakPolarHBondContact O-CB 2.91Å; L115-I118 PolarHBondContact O-N 3.28Å; L115-I118 VanDerWaalsContact O-N 3.17Å
116A86.1Confident83.9Confident0 Ų036.5 Ų36.50%020%0.202CC..Hα-helixtrans-61.6-32.1176.400000111.9L81 Y85 C88 A112 G113 I118 F119 S120L81-A116 HydrophobicContact CD1-CB 3.83Å; Y85-A116 HydrophobicContact CD2-CB 4.48Å; C88-A116 HydrophobicContact CB-CB 4.26Å; C88-A116 VanDerWaalsContact SG-CA 3.6Å; C88-A116 PolarHBondContact SG-N 3.37Å; A112-A116 VanDerWaalsContact O-CB 3.31Å; A112-A116 WeakPolarHBondContact O-CB 3.26Å; A112-A116 PolarHBondContact O-N 2.93Å; G113-A116 PolarHBondContact O-N 3.47Å; A116-I118 PolarHBondContact O-N 3.1Å; A116-F119 WeakPolarHBondContact O-CB 3.4Å; A116-F119 PolarHBondContact O-N 3.11Å; A116-S120 PolarHBondContact O-N 2.9Å; A116-S120 VanDerWaalsContact O-N 3.07Å
117S84.4Confident84.9Confident1 Ų134.6 Ų34.61%0.00719%0.193CC..Hα-helixtrans-65.4-21178.477.70000113.5G113 S114 L115 S120 S121 E181G113-S117 WeakPolarHBondContact O-CB 3.31Å; G113-S117 PolarHBondContact O-N 3.26Å; S114-S117 PolarHBondContact O-OG 2.97Å; L115-S117 PolarHBondContact O-N 3.38Å; S117-S120 WeakPolarHBondContact CA-OG 3.13Å; S117-S120 PolarHBondContact O-OG 3.15Å; S117-S121 WeakPolarHBondContact O-CB 3.29Å; S117-S121 PolarHBondContact O-N 2.98Å; S117-S121 PolarHBondContact O-OG 3.27Å; S117-E181 WeakPolarHBondContact OG-CB 3.18Å
118I88Confident85.7Confident57 Ų5731.2 Ų31.229%0.29217%0.171SC..Hα-helixtrans-65.4-43171.4-60172.4000109.9L115 A116 S121 M122 I178L115-I118 HydrophobicContact CD2-CD1 4.47Å; L115-I118 WeakPolarHBondContact O-CB 2.91Å; L115-I118 PolarHBondContact O-N 3.28Å; L115-I118 VanDerWaalsContact O-N 3.17Å; A116-I118 PolarHBondContact O-N 3.1Å; I118-S121 WeakPolarHBondContact O-CB 3.44Å; I118-S121 PolarHBondContact O-N 3.39Å; I118-M122 PolarHBondContact O-N 3.47Å; I118-I178 HydrophobicContact CG1-CG2 4.49Å; I118-I178 HydrophobicContact CG2-CD1 4.39Å
119F90.1Very high86.2Confident100 Ų10028.8 Ų28.844%0.43916%0.16SC..Hα-helixtrans-69.8-45178.3-61.2-82.6000111.5V80 A116 S121 M122 A123V80-F119 VanDerWaalsContact CG1-C 3.5Å; V80-F119 HydrophobicContact CG1-CB 3.85Å; A116-F119 WeakPolarHBondContact O-CB 3.4Å; A116-F119 PolarHBondContact O-N 3.11Å; F119-S121 VanDerWaalsContact C-N 3.27Å; F119-S121 PolarHBondContact O-N 3.34Å; F119-M122 HydrophobicContact CB-CE 4.37Å; F119-M122 HydrophobicContact CD1-CE 3.63Å; F119-M122 HydrophobicContact CE1-CE 4.3Å; F119-M122 HydrophobicContact CG-CE 4.28Å; F119-M122 PolarHBondContact O-N 3.41Å; F119-A123 PolarHBondContact O-N 3.13Å
120S87.8Confident86.9Confident4 Ų425.1 Ų25.13%0.02814%0.144CC..Hα-helixtrans-63.5-35.5175.574.10000111.7A116 S117 M122 A123 I124A116-S120 PolarHBondContact O-N 2.9Å; A116-S120 VanDerWaalsContact O-N 3.07Å; S117-S120 WeakPolarHBondContact CA-OG 3.13Å; S117-S120 PolarHBondContact O-OG 3.15Å; S120-M122 VanDerWaalsContact C-N 3.28Å; S120-M122 PolarHBondContact O-N 3.36Å; S120-A123 PolarHBondContact O-N 3.02Å; S120-I124 WeakPolarHBondContact O-CB 3.49Å; S120-I124 WeakPolarHBondContact O-CG2 3.36Å; S120-I124 PolarHBondContact O-N 3.28Å
121S88.4Confident87.7Confident1 Ų126 Ų261%0.00715%0.146CC..Hα-helixtrans-59-36.5174.8-70.20000112.8S117 I118 F119 C125 T177S117-S121 WeakPolarHBondContact O-CB 3.29Å; S117-S121 PolarHBondContact O-N 2.98Å; S117-S121 PolarHBondContact O-OG 3.27Å; I118-S121 WeakPolarHBondContact O-CB 3.44Å; I118-S121 PolarHBondContact O-N 3.39Å; F119-S121 VanDerWaalsContact C-N 3.27Å; F119-S121 PolarHBondContact O-N 3.34Å; S121-C125 VanDerWaalsContact O-CB 3.23Å; S121-C125 WeakPolarHBondContact O-CB 3.27Å; S121-C125 PolarHBondContact O-N 3.27Å; S121-C125 VanDerWaalsContact O-N 3.08Å; S121-T177 WeakPolarHBondContact OG-CG2 3.48Å
122M90.1Very high88.3Confident78 Ų7823.9 Ų23.938%0.38413%0.131SC..Hα-helixtrans-68.2-37.4175.6-68.5-173-72.100111.9I118 F119 S120 P126 Y171 L174I118-M122 PolarHBondContact O-N 3.47Å; F119-M122 HydrophobicContact CB-CE 4.37Å; F119-M122 HydrophobicContact CD1-CE 3.63Å; F119-M122 HydrophobicContact CE1-CE 4.3Å; F119-M122 HydrophobicContact CG-CE 4.28Å; F119-M122 PolarHBondContact O-N 3.41Å; S120-M122 VanDerWaalsContact C-N 3.28Å; S120-M122 PolarHBondContact O-N 3.36Å; M122-P126 WeakPolarHBondContact O-CD 3.46Å; M122-Y171 HydrophobicContact CB-CE1 4.5Å; M122-Y171 WeakPolarHBondContact O-CE1 3.43Å; M122-L174 HydrophobicContact CG-CD1 4.4Å
123A90.3Very high88.6Confident32 Ų3223.9 Ų23.926%0.26413%0.131SC..Hα-helixtrans-74.8-36.5179.100000112.9V80 F119 S120V80-A123 HydrophobicContact CB-CB 4.22Å; V80-A123 HydrophobicContact CG1-CB 4.49Å; V80-A123 HydrophobicContact CG2-CB 3.69Å; F119-A123 PolarHBondContact O-N 3.13Å; S120-A123 PolarHBondContact O-N 3.02Å
124I90Very high89Confident7 Ų723.6 Ų23.64%0.03613%0.127CC..Hα-helixtrans-82.1-29.7-176.1-157.8-176.8000113A73 E77 S120 T127 E128 T177A73-I124 HydrophobicContact CB-CD1 4.39Å; A73-I124 HydrophobicContact CB-CG1 3.84Å; E77-I124 HydrophobicContact CB-CD1 4.19Å; E77-I124 HydrophobicContact CG-CD1 4.39Å; S120-I124 WeakPolarHBondContact O-CB 3.49Å; S120-I124 WeakPolarHBondContact O-CG2 3.36Å; S120-I124 PolarHBondContact O-N 3.28Å; I124-T127 PolarHBondContact O-N 3.4Å; I124-T127 VanDerWaalsContact O-N 3.14Å; I124-T127 PolarHBondContact O-OG1 3.02Å; I124-E128 HydrophobicContact CD1-CG 4.02Å; I124-E128 HydrophobicContact CG1-CG 3.86Å; I124-E128 WeakPolarHBondContact O-CB 3.21Å; I124-E128 PolarHBondContact O-N 2.9Å; I124-T177 HydrophobicContact CG2-CG2 4.44Å
125C90.3Very high89.4Confident0 Ų022.6 Ų22.60%012%0.12CC..Hα-helixtrans-56.9-45-172.5-173.20000113.5S121 T127 L129 F170 Y171 L174S121-C125 VanDerWaalsContact O-CB 3.23Å; S121-C125 WeakPolarHBondContact O-CB 3.27Å; S121-C125 PolarHBondContact O-N 3.27Å; S121-C125 VanDerWaalsContact O-N 3.08Å; C125-T127 PolarHBondContact O-N 3.28Å; C125-L129 VanDerWaalsContact O-CB 3.23Å; C125-L129 WeakPolarHBondContact O-CB 3.37Å; C125-L129 PolarHBondContact O-N 3.26Å; C125-F170 CarbonylContact C-O 3.56Å; C125-F170 PolarHBondContact SG-O 3.12Å; C125-F170 VanDerWaalsContact SG-O 3.37Å; C125-Y171 HydrophobicContact CB-CD1 4.43Å; C125-L174 HydrophobicContact CB-CD1 4.21Å
126P91.6Very high89.5Confident29 Ų2919.5 Ų19.519%0.18810%0.103CC..Hα-helixtrans-60.7-42.1176.8-25.636.1000113.7M122 V130 F170 Y171M122-P126 WeakPolarHBondContact O-CD 3.46Å; P126-V130 WeakPolarHBondContact O-CG2 3.46Å; P126-V130 PolarHBondContact O-N 3.2Å; P126-F170 HydrophobicContact CB-CB 3.89Å; P126-F170 HydrophobicContact CB-CD1 4.23Å; P126-F170 HydrophobicContact CB-CG 4.36Å; P126-F170 HydrophobicContact CG-CB 4.1Å; P126-Y171 HydrophobicContact CG-CE1 4.27Å
127T91.9Very high89.5Confident27 Ų2719.6 Ų19.617%0.16610%0.104CC..Hα-helixtrans-75.1-41.6-17651.20000111.2L72 A73 I124 C125 V130 K131L72-T127 HydrophobicContact CB-CG2 4.14Å; A73-T127 WeakPolarHBondContact CA-OG1 3.27Å; A73-T127 VanDerWaalsContact CB-OG1 3.3Å; A73-T127 WeakPolarHBondContact CB-OG1 2.93Å; I124-T127 PolarHBondContact O-N 3.4Å; I124-T127 VanDerWaalsContact O-N 3.14Å; I124-T127 PolarHBondContact O-OG1 3.02Å; C125-T127 PolarHBondContact O-N 3.28Å; T127-V130 PolarHBondContact O-N 3.1Å; T127-K131 WeakPolarHBondContact O-CB 3.19Å; T127-K131 PolarHBondContact O-N 2.93Å
128E89.4Confident89.5Confident25 Ų2521.4 Ų21.412%0.11711%0.112CC..Hα-helixtrans-63.1-40.5172.7-91.5-177.3135.600112.7I124 V130 K131 C132 R180 K237I124-E128 HydrophobicContact CD1-CG 4.02Å; I124-E128 HydrophobicContact CG1-CG 3.86Å; I124-E128 WeakPolarHBondContact O-CB 3.21Å; I124-E128 PolarHBondContact O-N 2.9Å; E128-V130 VanDerWaalsContact C-N 3.33Å; E128-V130 PolarHBondContact O-N 3.24Å; E128-K131 WeakPolarHBondContact O-CB 3.27Å; E128-K131 PolarHBondContact O-N 3.45Å; E128-C132 WeakPolarHBondContact O-CB 3.18Å; E128-C132 PolarHBondContact O-N 3.34Å; E128-C132 PolarHBondContact O-SG 3.45Å; E128-R180 IonicContact OE1-NH1 2.76Å; E128-R180 IonicContact OE1-NH2 3.21Å; E128-K237 IonicContact OE1-NZ 3.72Å; E128-K237 PolarHBondContact OE1-NZ 2.74Å; E128-K237 WeakPolarHBondContact OE2-CE 3.34Å; E128-K237 IonicContact OE2-NZ 2.66Å; E128-K237 PolarHBondContact OE2-NZ 2.85Å
129L90.9Very high89.5Confident0 Ų018.7 Ų18.70%010%0.098CC..Hα-helixtrans-61.5-44.1177.4178139.1000111.1C125 R133 V161 G169 F170 Q172 Q241C125-L129 VanDerWaalsContact O-CB 3.23Å; C125-L129 WeakPolarHBondContact O-CB 3.37Å; C125-L129 PolarHBondContact O-N 3.26Å; L129-R133 WeakPolarHBondContact O-CB 3.43Å; L129-R133 VanDerWaalsContact O-CG 3.3Å; L129-R133 WeakPolarHBondContact O-CG 3.1Å; L129-R133 PolarHBondContact O-N 3.11Å; L129-R133 VanDerWaalsContact O-N 3.13Å; L129-V161 HydrophobicContact CD2-CG1 4.48Å; L129-V161 HydrophobicContact CD2-CG2 3.97Å; L129-G169 WeakPolarHBondContact CD1-O 3.3Å; L129-F170 HydrophobicContact CD2-CD1 4.37Å; L129-Q172 HydrophobicContact CD1-CB 3.72Å; L129-Q241 HydrophobicContact CD1-CG 4.46Å
130V91.8Very high89.2Confident6 Ų614 Ų144%0.0368%0.078CC..Hα-helixtrans-66.1-41.2176.4176.20000111.1P69 P126 T127 E128 L134 V154 V157 V158 F170P69-V130 HydrophobicContact CB-CG1 4.47Å; P69-V130 HydrophobicContact CG-CG1 3.93Å; P126-V130 WeakPolarHBondContact O-CG2 3.46Å; P126-V130 PolarHBondContact O-N 3.2Å; T127-V130 PolarHBondContact O-N 3.1Å; E128-V130 VanDerWaalsContact C-N 3.33Å; E128-V130 PolarHBondContact O-N 3.24Å; V130-L134 HydrophobicContact CG1-CD1 4.02Å; V130-L134 WeakPolarHBondContact O-CB 3.46Å; V130-L134 WeakPolarHBondContact O-CG 3.44Å; V130-L134 PolarHBondContact O-N 3.42Å; V130-V154 HydrophobicContact CG1-CG1 4.01Å; V130-V157 HydrophobicContact CB-CG1 4.45Å; V130-V157 HydrophobicContact CG1-CB 4.24Å; V130-V157 HydrophobicContact CG1-CG1 4.11Å; V130-V157 HydrophobicContact CG2-CG1 4.32Å; V130-V158 HydrophobicContact CG1-CG2 4.48Å; V130-V158 HydrophobicContact CG2-CG2 3.94Å; V130-F170 HydrophobicContact CG2-CD1 4.39Å; V130-F170 HydrophobicContact CG2-CE1 4.09Å
131K92.2Very high89.1Confident28 Ų2815.4 Ų15.412%0.1228%0.084CC..Hα-helixtrans-56.3-57.3174.9-178.5-170.6173.7179.40111.5D31 P69 A70 T127 E128 R133 L134 Q135D31-K131 IonicContact OD2-NZ 2.96Å; D31-K131 PolarHBondContact OD2-NZ 3.44Å; P69-K131 HydrophobicContact CB-CB 3.92Å; A70-K131 HydrophobicContact CB-CD 3.72Å; A70-K131 HydrophobicContact CB-CG 4.34Å; T127-K131 WeakPolarHBondContact O-CB 3.19Å; T127-K131 PolarHBondContact O-N 2.93Å; E128-K131 WeakPolarHBondContact O-CB 3.27Å; E128-K131 PolarHBondContact O-N 3.45Å; K131-R133 VanDerWaalsContact C-N 3.31Å; K131-R133 PolarHBondContact O-N 3.25Å; K131-L134 PolarHBondContact O-N 3.4Å; K131-L134 VanDerWaalsContact O-N 3.15Å; K131-Q135 WeakPolarHBondContact O-CG 3.25Å; K131-Q135 PolarHBondContact O-N 3.01Å
132C89.8Confident88.8Confident8 Ų820.4 Ų20.45%0.05411%0.107CC..Hα-helixtrans-61.5-41.6-175-660000111.3V35 E128 Q135 A136 Q241 V242V35-C132 HydrophobicContact CG1-CB 4.25Å; E128-C132 WeakPolarHBondContact O-CB 3.18Å; E128-C132 PolarHBondContact O-N 3.34Å; E128-C132 PolarHBondContact O-SG 3.45Å; C132-Q135 PolarHBondContact O-N 3.32Å; C132-A136 WeakPolarHBondContact O-CB 3.24Å; C132-A136 PolarHBondContact O-N 2.99Å; C132-A136 VanDerWaalsContact O-N 3.12Å; C132-Q241 HydrophobicContact CB-CB 4.34Å; C132-Q241 PolarHBondContact SG-OE1 3.39Å; C132-Q241 VanDerWaalsContact SG-OE1 3.4Å; C132-V242 HydrophobicContact CB-CG2 4.09Å
133R90.2Very high88.5Confident0 Ų019.5 Ų19.50%011%0.106CC..Hα-helixtrans-60.4-48.3174.8-75-179.1-179.5-170.47.7111.6L129 K131 Q135 A136 M137 V157 Q172 Q241 S244L129-R133 WeakPolarHBondContact O-CB 3.43Å; L129-R133 VanDerWaalsContact O-CG 3.3Å; L129-R133 WeakPolarHBondContact O-CG 3.1Å; L129-R133 PolarHBondContact O-N 3.11Å; L129-R133 VanDerWaalsContact O-N 3.13Å; K131-R133 VanDerWaalsContact C-N 3.31Å; K131-R133 PolarHBondContact O-N 3.25Å; R133-Q135 VanDerWaalsContact C-N 3.32Å; R133-Q135 PolarHBondContact O-N 3.45Å; R133-A136 CarbonylContact O-C 3.58Å; R133-A136 PolarHBondContact O-N 3.13Å; R133-M137 HydrophobicContact CB-CE 3.73Å; R133-M137 WeakPolarHBondContact O-CE 3.47Å; R133-M137 VanDerWaalsContact O-CG 3.29Å; R133-M137 WeakPolarHBondContact O-CG 3.41Å; R133-M137 PolarHBondContact O-N 2.87Å; R133-V157 HydrophobicContact CB-CG1 3.97Å; R133-Q172 VanDerWaalsContact NH2-OE1 3.09Å; R133-Q241 WeakPolarHBondContact CG-O 3.31Å; R133-Q241 PolarHBondContact NE-O 3.09Å; R133-S244 PolarHBondContact NH2-OG 3.1Å
134L89.4Confident88.1Confident5 Ų521 Ų213%0.02613%0.125CC..Hα-helixtrans-60.2-39.3177.8-76.9171.2000113.2P69 V130 K131 A136 V154 V157P69-L134 HydrophobicContact CG-CD1 3.98Å; V130-L134 HydrophobicContact CG1-CD1 4.02Å; V130-L134 WeakPolarHBondContact O-CB 3.46Å; V130-L134 WeakPolarHBondContact O-CG 3.44Å; V130-L134 PolarHBondContact O-N 3.42Å; K131-L134 PolarHBondContact O-N 3.4Å; K131-L134 VanDerWaalsContact O-N 3.15Å; L134-A136 VanDerWaalsContact C-N 3.28Å; L134-A136 PolarHBondContact O-N 3.37Å; L134-V154 HydrophobicContact CD1-CB 4.44Å; L134-V154 HydrophobicContact CD1-CG2 3.76Å; L134-V157 HydrophobicContact CD2-CG2 3.54Å; L134-V157 HydrophobicContact CG-CG2 3.89Å
135Q89.1Confident87.5Confident1 Ų124.3 Ų24.31%0.00514%0.139CC..Hα-helixtrans-65.8-32.5178.5-73.1175-43.500112.4T32 V35 K36 K65 K131 C132 R133T32-Q135 HydrophobicContact CG2-CB 4.25Å; T32-Q135 HydrophobicContact CG2-CG 4.22Å; T32-Q135 PolarHBondContact OG1-NE2 3.3Å; V35-Q135 HydrophobicContact CB-CB 4.34Å; V35-Q135 HydrophobicContact CG1-CB 4.18Å; K36-Q135 VanDerWaalsContact CE-O 3.27Å; K36-Q135 WeakPolarHBondContact CE-O 3.5Å; K36-Q135 PolarHBondContact NZ-O 3.15Å; K65-Q135 WeakPolarHBondContact O-CG 3.45Å; K131-Q135 WeakPolarHBondContact O-CG 3.25Å; K131-Q135 PolarHBondContact O-N 3.01Å; C132-Q135 PolarHBondContact O-N 3.32Å; R133-Q135 VanDerWaalsContact C-N 3.32Å; R133-Q135 PolarHBondContact O-N 3.45Å
136A87.8Confident87Confident0 Ų025.1 Ų25.10%014%0.144CC..Hα-helixtrans-96.1-3.1-178.900000115.1F40 C132 R133 L134 H138 E139 M140 V242F40-A136 HydrophobicContact CE2-CB 3.94Å; C132-A136 WeakPolarHBondContact O-CB 3.24Å; C132-A136 PolarHBondContact O-N 2.99Å; C132-A136 VanDerWaalsContact O-N 3.12Å; R133-A136 CarbonylContact O-C 3.58Å; R133-A136 PolarHBondContact O-N 3.13Å; L134-A136 VanDerWaalsContact C-N 3.28Å; L134-A136 PolarHBondContact O-N 3.37Å; A136-H138 VanDerWaalsContact C-N 3.31Å; A136-H138 PolarHBondContact O-N 3.44Å; A136-E139 WeakPolarHBondContact CA-OE2 3.37Å; A136-E139 PolarHBondContact O-N 2.91Å; A136-M140 HydrophobicContact CB-CG 4.43Å; A136-M140 HydrophobicContact CB-SD 4.26Å; A136-M140 VanDerWaalsContact O-CG 3.24Å; A136-M140 WeakPolarHBondContact O-CG 3.1Å; A136-M140 PolarHBondContact O-N 3.44Å; A136-V242 HydrophobicContact CB-CB 4.39Å; A136-V242 HydrophobicContact CB-CG1 3.56Å; A136-V242 HydrophobicContact CB-CG2 3.83Å
137M85.6Confident86.2Confident3 Ų326.9 Ų26.92%0.01516%0.161CC..Hα-helixtrans-53.9-43.9-171.6-83.1-67.313500113.4R133 E139 M140 E141 V157 L245R133-M137 HydrophobicContact CB-CE 3.73Å; R133-M137 WeakPolarHBondContact O-CE 3.47Å; R133-M137 VanDerWaalsContact O-CG 3.29Å; R133-M137 WeakPolarHBondContact O-CG 3.41Å; R133-M137 PolarHBondContact O-N 2.87Å; M137-E139 PolarHBondContact O-N 3.39Å; M137-M140 HydrophobicContact CE-SD 4.34Å; M137-M140 WeakPolarHBondContact O-CB 3.33Å; M137-M140 PolarHBondContact O-N 3.21Å; M137-E141 WeakPolarHBondContact O-CG 3.47Å; M137-E141 PolarHBondContact O-N 3.42Å; M137-V157 HydrophobicContact CE-CG2 3.76Å; M137-L245 HydrophobicContact CE-CD2 3.72Å
138H85Confident85.2Confident39 Ų3934.5 Ų34.518%0.18119%0.192CC..Hα-helixtrans-64-44.3-176.3-177.661.2000111.4V58 A136 M140 E141 E142V58-H138 HydrophobicContact CG2-CB 4.27Å; A136-H138 VanDerWaalsContact C-N 3.31Å; A136-H138 PolarHBondContact O-N 3.44Å; H138-M140 VanDerWaalsContact C-N 3.3Å; H138-M140 PolarHBondContact O-N 3Å; H138-E141 WeakPolarHBondContact O-CB 3.44Å; H138-E141 PolarHBondContact O-N 3.39Å; H138-E142 IonicContact NE2-OE1 2.66Å; H138-E142 PolarHBondContact O-N 2.97Å
139E87.7Confident84.1Confident0 Ų036.5 Ų36.50%022%0.219CC..Hα-helixtrans-66.7-34.8178.3-67.569.2-144.500111.5K36 F40 M43 Y44 A136 M137 E141 T143K36-E139 IonicContact NZ-OE1 3.48Å; K36-E139 PolarHBondContact NZ-OE1 2.96Å; K36-E139 IonicContact NZ-OE2 2.82Å; K36-E139 PolarHBondContact NZ-OE2 3.29Å; F40-E139 HydrophobicContact CD1-CB 4.18Å; F40-E139 HydrophobicContact CD2-CB 3.47Å; F40-E139 VanDerWaalsContact CD2-CB 3.47Å; F40-E139 HydrophobicContact CD2-CG 3.89Å; F40-E139 HydrophobicContact CE1-CB 4.04Å; F40-E139 HydrophobicContact CE2-CB 3.32Å; F40-E139 HydrophobicContact CE2-CG 4.17Å; F40-E139 HydrophobicContact CG-CB 3.91Å; F40-E139 HydrophobicContact CG-CG 4.34Å; F40-E139 HydrophobicContact CZ-CB 3.62Å; M43-E139 HydrophobicContact CE-CB 3.35Å; M43-E139 HydrophobicContact CE-CG 3.32Å; Y44-E139 HydrophobicContact CE2-CG 4.24Å; Y44-E139 VanDerWaalsContact OH-CG 3.23Å; Y44-E139 WeakPolarHBondContact OH-CG 3.46Å; Y44-E139 PolarHBondContact OH-OE1 3.04Å; A136-E139 WeakPolarHBondContact CA-OE2 3.37Å; A136-E139 PolarHBondContact O-N 2.91Å; M137-E139 PolarHBondContact O-N 3.39Å; E139-E141 VanDerWaalsContact C-N 3.35Å; E139-T143 WeakPolarHBondContact O-CB 3.47Å; E139-T143 VanDerWaalsContact O-CG2 3.32Å; E139-T143 WeakPolarHBondContact O-CG2 3.37Å; E139-T143 PolarHBondContact O-N 3.4Å; E139-T143 PolarHBondContact O-OG1 3.43Å
140M83.3Confident83Confident0 Ų039.2 Ų39.20%023%0.232CC..Hα-helixtrans-67.2-35.4173.9-65173.786.400112.3F40 A136 M137 H138 T143 G144 K145 V146 V242 L245F40-M140 HydrophobicContact CE2-CG 4.4Å; F40-M140 HydrophobicContact CZ-CG 3.73Å; A136-M140 HydrophobicContact CB-CG 4.43Å; A136-M140 HydrophobicContact CB-SD 4.26Å; A136-M140 VanDerWaalsContact O-CG 3.24Å; A136-M140 WeakPolarHBondContact O-CG 3.1Å; A136-M140 PolarHBondContact O-N 3.44Å; M137-M140 HydrophobicContact CE-SD 4.34Å; M137-M140 WeakPolarHBondContact O-CB 3.33Å; M137-M140 PolarHBondContact O-N 3.21Å; H138-M140 VanDerWaalsContact C-N 3.3Å; H138-M140 PolarHBondContact O-N 3Å; M140-T143 PolarHBondContact O-OG1 2.89Å; M140-G144 PolarHBondContact O-N 3.42Å; M140-K145 HydrophobicContact CB-CB 4.31Å; M140-K145 WeakPolarHBondContact O-CA 3.38Å; M140-K145 PolarHBondContact O-N 3.02Å; M140-V146 HydrophobicContact CB-CB 4.27Å; M140-V146 HydrophobicContact CB-CG2 3.8Å; M140-V146 HydrophobicContact CE-CG2 3.9Å; M140-V146 PolarHBondContact O-N 3.46Å; M140-V146 VanDerWaalsContact O-N 3.12Å; M140-V146 HydrophobicContact SD-CG2 4.41Å; M140-V242 HydrophobicContact CE-CG1 3.89Å; M140-V242 WeakPolarHBondContact CE-O 3.49Å; M140-V242 HydrophobicContact CG-CG1 3.98Å; M140-V242 HydrophobicContact SD-CG1 3.48Å; M140-V242 WeakPolarHBondContact SD-CG1 3.48Å; M140-L245 HydrophobicContact CE-CB 3.77Å; M140-L245 HydrophobicContact CE-CD2 3.6Å; M140-L245 HydrophobicContact CE-CG 4.3Å; M140-L245 HydrophobicContact SD-CD2 4.32Å
141E85.3Confident81.7Confident35 Ų3548.5 Ų48.516%0.16427%0.266CS..Hα-helixtrans-70.2-43.6173.7-72.2176.8-149.100111.7M137 H138 E139 T143 G144 V146M137-E141 WeakPolarHBondContact O-CG 3.47Å; M137-E141 PolarHBondContact O-N 3.42Å; H138-E141 WeakPolarHBondContact O-CB 3.44Å; H138-E141 PolarHBondContact O-N 3.39Å; E139-E141 VanDerWaalsContact C-N 3.35Å; E141-T143 VanDerWaalsContact C-N 3.34Å; E141-T143 PolarHBondContact O-N 2.69Å; E141-G144 PolarHBondContact O-N 3.49Å; E141-V146 HydrophobicContact CG-CB 4.38Å; E141-V146 HydrophobicContact CG-CG1 4.39Å
142E84.1Confident80.8Confident106 Ų10649.3 Ų49.350%0.49528%0.276SS..Hα-helixtrans-64-38.3177.4-74.4-162.8146.500112.3H138 G144H138-E142 IonicContact NE2-OE1 2.66Å; H138-E142 PolarHBondContact O-N 2.97Å; E142-G144 PolarHBondContact O-N 3.3Å
143T83.4Confident80.6Confident59 Ų5952.3 Ų52.336%0.36229%0.293SS..THydrogen-bonded Turntrans-82.33.2178.456.50000113.9F40 M43 E139 M140 E141 K145F40-T143 HydrophobicContact CD1-CG2 4.16Å; F40-T143 HydrophobicContact CE1-CG2 4.07Å; M43-T143 HydrophobicContact CE-CG2 4.24Å; M43-T143 HydrophobicContact SD-CG2 3.87Å; E139-T143 WeakPolarHBondContact O-CB 3.47Å; E139-T143 VanDerWaalsContact O-CG2 3.32Å; E139-T143 WeakPolarHBondContact O-CG2 3.37Å; E139-T143 PolarHBondContact O-N 3.4Å; E139-T143 PolarHBondContact O-OG1 3.43Å; M140-T143 PolarHBondContact O-OG1 2.89Å; E141-T143 VanDerWaalsContact C-N 3.34Å; E141-T143 PolarHBondContact O-N 2.69Å; T143-K145 PolarHBondContact O-N 3.02Å
144G80.5Confident80.5Confident64 Ų6454.9 Ų54.966%0.6631%0.309SS*.THydrogen-bonded Turntrans69.114.2179.600000114.6M140 E141 E142 V146M140-G144 PolarHBondContact O-N 3.42Å; E141-G144 PolarHBondContact O-N 3.49Å; E142-G144 PolarHBondContact O-N 3.3Å; G144-V146 VanDerWaalsContact C-N 3.3Å
145K78Confident80.5Confident75 Ų7563.4 Ų63.433%0.32634%0.341SS..SBendtrans-77.4-17.9176.2-68.3-177.6-179.3179.10112.5F40 M140 T143 Y243 A246F40-K145 HydrophobicContact CE1-CD 4.49Å; M140-K145 HydrophobicContact CB-CB 4.31Å; M140-K145 WeakPolarHBondContact O-CA 3.38Å; M140-K145 PolarHBondContact O-N 3.02Å; T143-K145 PolarHBondContact O-N 3.02Å; K145-Y243 HydrophobicContact CD-CD1 4.05Å; K145-Y243 HydrophobicContact CD-CE1 3.92Å; K145-Y243 PolarHBondContact NZ-OH 3.28Å; K145-Y243 VanDerWaalsContact NZ-OH 3.1Å; K145-A246 HydrophobicContact CB-CB 4.09Å; K145-A246 HydrophobicContact CG-CB 4.49Å
146V79.8Confident80.5Confident17 Ų1764.5 Ų64.510%0.10335%0.349CS..SBendtrans-136.3149.4174.7177.20000109M140 E141 G144 Q150 L245M140-V146 HydrophobicContact CB-CB 4.27Å; M140-V146 HydrophobicContact CB-CG2 3.8Å; M140-V146 HydrophobicContact CE-CG2 3.9Å; M140-V146 PolarHBondContact O-N 3.46Å; M140-V146 VanDerWaalsContact O-N 3.12Å; M140-V146 HydrophobicContact SD-CG2 4.41Å; E141-V146 HydrophobicContact CG-CB 4.38Å; E141-V146 HydrophobicContact CG-CG1 4.39Å; G144-V146 VanDerWaalsContact C-N 3.3Å; V146-Q150 HydrophobicContact CG1-CB 4Å; V146-Q150 HydrophobicContact CG1-CG 4.39Å; V146-L245 HydrophobicContact CG2-CD2 3.51Å; V146-L245 HydrophobicContact CG2-CG 4.49Å
147A74.8Confident80.5Confident67 Ų6764.7 Ų64.755%0.55435%0.35SS*.  trans-62.7136.5176.700000111.7G149 Q150A147-G149 PolarHBondContact O-N 3.46Å; A147-Q150 PolarHBondContact O-N 2.88Å
148K70.5Confident80.7Confident186 Ų18666.3 Ų66.381%0.80936%0.36SS*.THydrogen-bonded Turntrans-58.6134.7177.5-76.5-174.3174.8-178.50111.2
149G66.2Low80.9Confident67 Ų6768.9 Ų68.969%0.69137%0.371SS*.THydrogen-bonded Turntrans82.612.817600000114.8A147 R151A147-G149 PolarHBondContact O-N 3.46Å; G149-R151 PolarHBondContact O-N 2.93Å
150Q67.9Low80.9Confident58 Ų5870.4 Ų70.427%0.27138%0.38SS..  trans-63.4129.3172.5-170152.2-45.500109.9V146 A147 S152 T160V146-Q150 HydrophobicContact CG1-CB 4Å; V146-Q150 HydrophobicContact CG1-CG 4.39Å; A147-Q150 PolarHBondContact O-N 2.88Å; Q150-S152 PolarHBondContact O-N 3.45Å; Q150-S152 VanDerWaalsContact O-N 3.08Å; Q150-T160 PolarHBondContact NE2-OG1 3.43Å
151R65.4Low81.2Confident201 Ų20170.4 Ų70.476%0.75838%0.38SS*.  trans-58.6118.8-178.8-75.8-174.9174178.8-1.5110.2G149 T153 S156G149-R151 PolarHBondContact O-N 2.93Å; R151-T153 PolarHBondContact O-N 2.86Å; R151-S156 WeakPolarHBondContact O-CB 3.13Å; R151-S156 PolarHBondContact O-OG 3.4Å; R151-S156 VanDerWaalsContact O-OG 3.1Å
152S73.3Confident81.4Confident45 Ų4573.3 Ų73.332%0.31540%0.396SS..  trans-83.852.6179.772.10000112.4K65 Q150K65-S152 WeakPolarHBondContact CE-OG 3.41Å; K65-S152 PolarHBondContact NZ-OG 3.4Å; K65-S152 VanDerWaalsContact NZ-OG 3.11Å; Q150-S152 PolarHBondContact O-N 3.45Å; Q150-S152 VanDerWaalsContact O-N 3.08Å
153T86.1Confident81.5Confident70 Ų7077.5 Ų77.543%0.42941%0.408SS..  trans-104.7153.7176.367.90000111R151 W155 S156 V157R151-T153 PolarHBondContact O-N 2.86Å; T153-W155 VanDerWaalsContact C-N 3.26Å; T153-W155 PolarHBondContact O-N 3.44Å; T153-S156 WeakPolarHBondContact O-CB 3.28Å; T153-S156 PolarHBondContact O-N 2.91Å; T153-S156 VanDerWaalsContact O-N 3.07Å; T153-S156 WeakPolarHBondContact OG1-CB 3.38Å; T153-S156 PolarHBondContact OG1-N 2.93Å; T153-V157 PolarHBondContact O-N 3.23Å; T153-V157 VanDerWaalsContact O-N 3.08Å
154V88.4Confident81.6Confident55 Ų5578.8 Ų78.833%0.33342%0.415SS..Hα-helixtrans-51.2-49.1175.6179.40000110.6P69 V130 L134 S156 V157 V158P69-V154 HydrophobicContact CG-CG1 4.22Å; P69-V154 HydrophobicContact CG-CG2 3.86Å; V130-V154 HydrophobicContact CG1-CG1 4.01Å; L134-V154 HydrophobicContact CD1-CB 4.44Å; L134-V154 HydrophobicContact CD1-CG2 3.76Å; V154-S156 VanDerWaalsContact C-N 3.33Å; V154-S156 PolarHBondContact O-N 2.66Å; V154-V157 PolarHBondContact O-N 3.38Å; V154-V158 HydrophobicContact CG1-CG2 4.46Å; V154-V158 WeakPolarHBondContact O-CG2 3.48Å; V154-V158 PolarHBondContact O-N 3.13Å
155W89Confident81.7Confident184 Ų18477.8 Ų77.870%0.69740%0.395SS*.Hα-helixtrans-62.2-38.1179.1-176.9-115.2000113.3T153 V158 K159T153-W155 VanDerWaalsContact C-N 3.26Å; T153-W155 PolarHBondContact O-N 3.44Å; W155-V158 HydrophobicContact CE3-CG1 4.37Å; W155-V158 HydrophobicContact CZ3-CG1 4.34Å; W155-V158 PolarHBondContact O-N 2.95Å; W155-K159 VanDerWaalsContact O-CB 3.24Å; W155-K159 WeakPolarHBondContact O-CB 3.44Å; W155-K159 PolarHBondContact O-N 2.9Å
156S87.7Confident82.1Confident24 Ų2475.1 Ų75.117%0.16839%0.389CS..Hα-helixtrans-63-45.2176.8-167.60000111R151 T153 V154 K159 T160R151-S156 WeakPolarHBondContact O-CB 3.13Å; R151-S156 PolarHBondContact O-OG 3.4Å; R151-S156 VanDerWaalsContact O-OG 3.1Å; T153-S156 WeakPolarHBondContact O-CB 3.28Å; T153-S156 PolarHBondContact O-N 2.91Å; T153-S156 VanDerWaalsContact O-N 3.07Å; T153-S156 WeakPolarHBondContact OG1-CB 3.38Å; T153-S156 PolarHBondContact OG1-N 2.93Å; V154-S156 VanDerWaalsContact C-N 3.33Å; V154-S156 PolarHBondContact O-N 2.66Å; S156-K159 PolarHBondContact O-N 3.28Å; S156-T160 WeakPolarHBondContact O-CB 3.46Å; S156-T160 PolarHBondContact O-N 2.98Å; S156-T160 PolarHBondContact O-OG1 2.93Å
157V88Confident82.5Confident3 Ų378.7 Ų78.72%0.01841%0.412CS..Hα-helixtrans-63-47177.9177.40000110.9V130 R133 L134 M137 T153 V154 K159 T160 V161V130-V157 HydrophobicContact CB-CG1 4.45Å; V130-V157 HydrophobicContact CG1-CB 4.24Å; V130-V157 HydrophobicContact CG1-CG1 4.11Å; V130-V157 HydrophobicContact CG2-CG1 4.32Å; R133-V157 HydrophobicContact CB-CG1 3.97Å; L134-V157 HydrophobicContact CD2-CG2 3.54Å; L134-V157 HydrophobicContact CG-CG2 3.89Å; M137-V157 HydrophobicContact CE-CG2 3.76Å; T153-V157 PolarHBondContact O-N 3.23Å; T153-V157 VanDerWaalsContact O-N 3.08Å; V154-V157 PolarHBondContact O-N 3.38Å; V157-K159 PolarHBondContact O-N 3.45Å; V157-T160 PolarHBondContact O-N 3.48Å; V157-V161 HydrophobicContact CG1-CG2 4.22Å; V157-V161 WeakPolarHBondContact O-CG2 3.3Å; V157-V161 PolarHBondContact O-N 3.45Å
158V90.6Very high83Confident37 Ų3782.2 Ų82.222%0.22442%0.421CS..Hα-helixtrans-56.6-49.3176.7168.80000111.1V130 V154 W155 T160 V161 L162 F170V130-V158 HydrophobicContact CG1-CG2 4.48Å; V130-V158 HydrophobicContact CG2-CG2 3.94Å; V154-V158 HydrophobicContact CG1-CG2 4.46Å; V154-V158 WeakPolarHBondContact O-CG2 3.48Å; V154-V158 PolarHBondContact O-N 3.13Å; W155-V158 HydrophobicContact CE3-CG1 4.37Å; W155-V158 HydrophobicContact CZ3-CG1 4.34Å; W155-V158 PolarHBondContact O-N 2.95Å; V158-T160 VanDerWaalsContact C-N 3.34Å; V158-T160 PolarHBondContact O-N 3.25Å; V158-V161 PolarHBondContact O-N 3.38Å; V158-L162 WeakPolarHBondContact O-CB 3.41Å; V158-L162 PolarHBondContact O-N 3.19Å; V158-F170 HydrophobicContact CB-CE1 4.48Å; V158-F170 HydrophobicContact CB-CZ 4.35Å; V158-F170 HydrophobicContact CG1-CE1 4.37Å; V158-F170 HydrophobicContact CG1-CZ 3.88Å; V158-F170 HydrophobicContact CG2-CE1 4.27Å
159K90Very high83.8Confident93 Ų9373.3 Ų73.340%0.40438%0.382SS..Hα-helixtrans-62.5-40.2179.6-174.9175.5-179.6176.60112W155 S156 V157 R163W155-K159 VanDerWaalsContact O-CB 3.24Å; W155-K159 WeakPolarHBondContact O-CB 3.44Å; W155-K159 PolarHBondContact O-N 2.9Å; S156-K159 PolarHBondContact O-N 3.28Å; V157-K159 PolarHBondContact O-N 3.45Å; K159-R163 WeakPolarHBondContact O-CB 3.23Å; K159-R163 WeakPolarHBondContact O-CG 3.02Å; K159-R163 PolarHBondContact O-N 3.43Å
160T87.1Confident84.9Confident33 Ų3371.6 Ų71.620%0.20236%0.356CS..Hα-helixtrans-65.6-45.2176.1-59.20000111.2Q150 S156 V157 V158 L162 R163 T164 L245Q150-T160 PolarHBondContact NE2-OG1 3.43Å; S156-T160 WeakPolarHBondContact O-CB 3.46Å; S156-T160 PolarHBondContact O-N 2.98Å; S156-T160 PolarHBondContact O-OG1 2.93Å; V157-T160 PolarHBondContact O-N 3.48Å; V158-T160 VanDerWaalsContact C-N 3.34Å; V158-T160 PolarHBondContact O-N 3.25Å; T160-L162 VanDerWaalsContact C-N 3.32Å; T160-L162 PolarHBondContact O-N 2.99Å; T160-R163 PolarHBondContact O-N 3.5Å; T160-T164 WeakPolarHBondContact O-CB 3.47Å; T160-T164 PolarHBondContact O-N 2.87Å; T160-T164 PolarHBondContact O-OG1 3.33Å; T160-L245 HydrophobicContact CG2-CD1 3.67Å
161V88.1Confident85.9Confident0 Ų073.7 Ų73.70%036%0.362CS..Hα-helixtrans-56.7-49.5176.7-177.60000110.5L129 V157 V158 R163 T164 N165 G166 F170L129-V161 HydrophobicContact CD2-CG1 4.48Å; L129-V161 HydrophobicContact CD2-CG2 3.97Å; V157-V161 HydrophobicContact CG1-CG2 4.22Å; V157-V161 WeakPolarHBondContact O-CG2 3.3Å; V157-V161 PolarHBondContact O-N 3.45Å; V158-V161 PolarHBondContact O-N 3.38Å; V161-R163 VanDerWaalsContact C-N 3.32Å; V161-R163 PolarHBondContact O-N 2.88Å; V161-T164 PolarHBondContact O-N 3.46Å; V161-N165 PolarHBondContact O-N 2.98Å; V161-G166 PolarHBondContact O-N 3.49Å; V161-F170 HydrophobicContact CB-CD1 4.48Å; V161-F170 HydrophobicContact CB-CE1 3.88Å; V161-F170 HydrophobicContact CB-CE2 4.21Å; V161-F170 HydrophobicContact CB-CZ 3.72Å; V161-F170 HydrophobicContact CG1-CD1 4.01Å; V161-F170 HydrophobicContact CG1-CD2 4.02Å; V161-F170 HydrophobicContact CG1-CE1 3.88Å; V161-F170 HydrophobicContact CG1-CE2 3.89Å; V161-F170 HydrophobicContact CG1-CG 4.07Å; V161-F170 HydrophobicContact CG1-CZ 3.81Å; V161-F170 HydrophobicContact CG2-CE1 4.07Å; V161-F170 HydrophobicContact CG2-CZ 4.37Å
162L89.7Confident86.8Confident95 Ų9565.1 Ų65.150%0.49733%0.331SS..Hα-helixtrans-63.6-37.6-177-172.963.8000112.2V158 T160 G166 P167 F170V158-L162 WeakPolarHBondContact O-CB 3.41Å; V158-L162 PolarHBondContact O-N 3.19Å; T160-L162 VanDerWaalsContact C-N 3.32Å; T160-L162 PolarHBondContact O-N 2.99Å; L162-G166 VanDerWaalsContact O-CA 3.27Å; L162-G166 WeakPolarHBondContact O-CA 3.41Å; L162-G166 PolarHBondContact O-N 2.72Å; L162-P167 HydrophobicContact CD1-CB 4.38Å; L162-F170 HydrophobicContact CB-CE2 4.49Å
163R87.6Confident87.3Confident195 Ų19563.4 Ų63.474%0.73632%0.32SS*.Hα-helixtrans-74.7-37.8178.3-78.5-173.5171.3-172.9-6.2113.6K159 T160 V161K159-R163 WeakPolarHBondContact O-CB 3.23Å; K159-R163 WeakPolarHBondContact O-CG 3.02Å; K159-R163 PolarHBondContact O-N 3.43Å; T160-R163 PolarHBondContact O-N 3.5Å; V161-R163 VanDerWaalsContact C-N 3.32Å; V161-R163 PolarHBondContact O-N 2.88Å
164T84Confident87.4Confident86 Ų8661.9 Ų61.953%0.52831%0.309SS..Hα-helixtrans-87-43.2-173.9-49.50000112.3T160 V161T160-T164 WeakPolarHBondContact O-CB 3.47Å; T160-T164 PolarHBondContact O-N 2.87Å; T160-T164 PolarHBondContact O-OG1 3.33Å; V161-T164 PolarHBondContact O-N 3.46Å
165N82.5Confident87.2Confident42 Ų4264 Ų6423%0.22532%0.322CS..Hα-helixtrans-118.5-1.7-169.9-62.2-6.2000112.9V161 Q172 S244V161-N165 PolarHBondContact O-N 2.98Å; N165-Q172 PolarHBondContact ND2-NE2 2.98Å; N165-Q172 PolarHBondContact ND2-OE1 3.15Å; N165-S244 PolarHBondContact ND2-O 3.09Å
166G87.3Confident87Confident20 Ų2055.3 Ų55.321%0.20629%0.29CS..  trans67.8-170.8-172.800000113.3V161 L162 L168 G169V161-G166 PolarHBondContact O-N 3.49Å; L162-G166 VanDerWaalsContact O-CA 3.27Å; L162-G166 WeakPolarHBondContact O-CA 3.41Å; L162-G166 PolarHBondContact O-N 2.72Å; G166-L168 VanDerWaalsContact C-N 3.31Å; G166-L168 PolarHBondContact O-N 2.84Å; G166-G169 PolarHBondContact O-N 3.38Å; G166-G169 VanDerWaalsContact O-N 3.11Å
167P87.4Confident86.8Confident91 Ų9154.1 Ų54.159%0.59128%0.282SS*.G310 helixtrans-66.6-29.6-177.925.9-34.2000113.3L162 G169 F170L162-P167 HydrophobicContact CD1-CB 4.38Å; P167-G169 PolarHBondContact O-N 2.93Å; P167-F170 WeakPolarHBondContact O-CD2 3.4Å; P167-F170 PolarHBondContact O-N 2.89Å
168L87.3Confident86.7Confident141 Ų14156 Ų5674%0.73829%0.291SS*.G310 helixtrans-68.8-17175.3-65.6176.7000112.5G166 F170 Y171G166-L168 VanDerWaalsContact C-N 3.31Å; G166-L168 PolarHBondContact O-N 2.84Å; L168-F170 PolarHBondContact O-N 2.94Å; L168-Y171 PolarHBondContact O-N 3.46Å; L168-Y171 VanDerWaalsContact O-N 3.1Å
169G85.8Confident86.5Confident0 Ų056.9 Ų56.90%030%0.296CS..G310 helixtrans-59.6-25.4175.100000114.4L129 G166 P167 Y171 Q172L129-G169 WeakPolarHBondContact CD1-O 3.3Å; G166-G169 PolarHBondContact O-N 3.38Å; G166-G169 VanDerWaalsContact O-N 3.11Å; P167-G169 PolarHBondContact O-N 2.93Å; G169-Y171 VanDerWaalsContact C-N 3.26Å; G169-Y171 PolarHBondContact O-N 3.35Å; G169-Q172 WeakPolarHBondContact O-CB 3.29Å; G169-Q172 VanDerWaalsContact O-CD 3.23Å; G169-Q172 VanDerWaalsContact O-CG 3.27Å; G169-Q172 WeakPolarHBondContact O-CG 3.32Å; G169-Q172 PolarHBondContact O-N 2.86Å; G169-Q172 PolarHBondContact O-OE1 3.26Å
170F89.1Confident86.1Confident30 Ų3053.8 Ų53.813%0.13228%0.282CS..G310 helixtrans-72.3-18.5177.4-69.9-78000113.8C125 P126 L129 V130 V158 V161 L162 P167 L168 Q172C125-F170 CarbonylContact C-O 3.56Å; C125-F170 PolarHBondContact SG-O 3.12Å; C125-F170 VanDerWaalsContact SG-O 3.37Å; P126-F170 HydrophobicContact CB-CB 3.89Å; P126-F170 HydrophobicContact CB-CD1 4.23Å; P126-F170 HydrophobicContact CB-CG 4.36Å; P126-F170 HydrophobicContact CG-CB 4.1Å; L129-F170 HydrophobicContact CD2-CD1 4.37Å; V130-F170 HydrophobicContact CG2-CD1 4.39Å; V130-F170 HydrophobicContact CG2-CE1 4.09Å; V158-F170 HydrophobicContact CB-CE1 4.48Å; V158-F170 HydrophobicContact CB-CZ 4.35Å; V158-F170 HydrophobicContact CG1-CE1 4.37Å; V158-F170 HydrophobicContact CG1-CZ 3.88Å; V158-F170 HydrophobicContact CG2-CE1 4.27Å; V161-F170 HydrophobicContact CB-CD1 4.48Å; V161-F170 HydrophobicContact CB-CE1 3.88Å; V161-F170 HydrophobicContact CB-CE2 4.21Å; V161-F170 HydrophobicContact CB-CZ 3.72Å; V161-F170 HydrophobicContact CG1-CD1 4.01Å; V161-F170 HydrophobicContact CG1-CD2 4.02Å; V161-F170 HydrophobicContact CG1-CE1 3.88Å; V161-F170 HydrophobicContact CG1-CE2 3.89Å; V161-F170 HydrophobicContact CG1-CG 4.07Å; V161-F170 HydrophobicContact CG1-CZ 3.81Å; V161-F170 HydrophobicContact CG2-CE1 4.07Å; V161-F170 HydrophobicContact CG2-CZ 4.37Å; L162-F170 HydrophobicContact CB-CE2 4.49Å; P167-F170 WeakPolarHBondContact O-CD2 3.4Å; P167-F170 PolarHBondContact O-N 2.89Å; L168-F170 PolarHBondContact O-N 2.94Å; F170-Q172 VanDerWaalsContact C-N 3.31Å
171Y89.2Confident85.7Confident102 Ų10253.2 Ų53.240%0.428%0.277SS..G310 helixtrans-95.113.3179.5-64.8-84.5000112.7M122 C125 P126 L168 G169 G173 L174M122-Y171 HydrophobicContact CB-CE1 4.5Å; M122-Y171 WeakPolarHBondContact O-CE1 3.43Å; C125-Y171 HydrophobicContact CB-CD1 4.43Å; P126-Y171 HydrophobicContact CG-CE1 4.27Å; L168-Y171 PolarHBondContact O-N 3.46Å; L168-Y171 VanDerWaalsContact O-N 3.1Å; G169-Y171 VanDerWaalsContact C-N 3.26Å; G169-Y171 PolarHBondContact O-N 3.35Å; Y171-G173 PolarHBondContact O-N 3.47Å; Y171-L174 HydrophobicContact CD1-CD2 4.11Å; Y171-L174 WeakPolarHBondContact O-CB 3.38Å; Y171-L174 PolarHBondContact O-N 3.25Å
172Q85.8Confident85.2Confident22 Ų2257.1 Ų57.110%0.10330%0.297CS..THydrogen-bonded Turntrans-67.4121.6175.1-72.2167.6-9.100110L129 R133 N165 G169 F170 Q241 S244L129-Q172 HydrophobicContact CD1-CB 3.72Å; R133-Q172 VanDerWaalsContact NH2-OE1 3.09Å; N165-Q172 PolarHBondContact ND2-NE2 2.98Å; N165-Q172 PolarHBondContact ND2-OE1 3.15Å; G169-Q172 WeakPolarHBondContact O-CB 3.29Å; G169-Q172 VanDerWaalsContact O-CD 3.23Å; G169-Q172 VanDerWaalsContact O-CG 3.27Å; G169-Q172 WeakPolarHBondContact O-CG 3.32Å; G169-Q172 PolarHBondContact O-N 2.86Å; G169-Q172 PolarHBondContact O-OE1 3.26Å; F170-Q172 VanDerWaalsContact C-N 3.31Å; Q172-Q241 WeakPolarHBondContact O-CG 3.25Å; Q172-S244 PolarHBondContact OE1-OG 3.28Å
173G83.4Confident84.7Confident9 Ų954.8 Ų54.89%0.09329%0.288CS..THydrogen-bonded Turntrans92.11.8-172.200000114.4Y171 T175 S176 T177Y171-G173 PolarHBondContact O-N 3.47Å; G173-T175 VanDerWaalsContact C-N 3.32Å; G173-T175 PolarHBondContact O-N 3.08Å; G173-S176 CarbonylContact O-C 3.57Å; G173-S176 WeakPolarHBondContact O-CA 3.41Å; G173-S176 WeakPolarHBondContact O-CB 3.35Å; G173-S176 PolarHBondContact O-N 3.32Å; G173-T177 PolarHBondContact O-N 3.3Å; G173-T177 PolarHBondContact O-OG1 2.95Å
174L87.2Confident84.3Confident37 Ų3745.6 Ų45.619%0.19425%0.254CS..Hα-helixtrans-55.9-44.6176.4178.964.2000112.1M122 C125 Y171 S176 T177 I178M122-L174 HydrophobicContact CG-CD1 4.4Å; C125-L174 HydrophobicContact CB-CD1 4.21Å; Y171-L174 HydrophobicContact CD1-CD2 4.11Å; Y171-L174 WeakPolarHBondContact O-CB 3.38Å; Y171-L174 PolarHBondContact O-N 3.25Å; L174-S176 VanDerWaalsContact C-N 3.29Å; L174-S176 PolarHBondContact O-N 2.92Å; L174-T177 WeakPolarHBondContact O-CB 3.4Å; L174-T177 PolarHBondContact O-N 3.02Å; L174-T177 VanDerWaalsContact O-N 3.12Å; L174-I178 HydrophobicContact CD1-CD1 4.18Å; L174-I178 HydrophobicContact CD1-CG1 4.35Å; L174-I178 HydrophobicContact CG-CD1 4.02Å; L174-I178 WeakPolarHBondContact O-CG1 3.46Å; L174-I178 PolarHBondContact O-N 3.24Å
175T85.3Confident83.8Confident99 Ų9944.5 Ų44.561%0.60724%0.24SC*.Hα-helixtrans-58.1-44.2175-50.30000111.2G173 T177 I178 V179G173-T175 VanDerWaalsContact C-N 3.32Å; G173-T175 PolarHBondContact O-N 3.08Å; T175-T177 VanDerWaalsContact C-N 3.31Å; T175-T177 PolarHBondContact O-N 3.1Å; T175-I178 PolarHBondContact O-N 2.88Å; T175-V179 HydrophobicContact CG2-CG2 4.34Å; T175-V179 WeakPolarHBondContact O-CB 3.06Å; T175-V179 WeakPolarHBondContact O-CG2 3.37Å; T175-V179 PolarHBondContact O-N 3.48Å
176S84.4Confident83.6Confident2 Ų250.3 Ų50.31%0.01426%0.264CS..Hα-helixtrans-63.6-38.3177.1-44.20000111.4G173 L174 R180 I233 F252G173-S176 CarbonylContact O-C 3.57Å; G173-S176 WeakPolarHBondContact O-CA 3.41Å; G173-S176 WeakPolarHBondContact O-CB 3.35Å; G173-S176 PolarHBondContact O-N 3.32Å; L174-S176 VanDerWaalsContact C-N 3.29Å; L174-S176 PolarHBondContact O-N 2.92Å; S176-R180 VanDerWaalsContact O-CB 3.25Å; S176-R180 WeakPolarHBondContact O-CB 3.35Å; S176-R180 PolarHBondContact O-N 2.7Å; S176-I233 WeakPolarHBondContact O-CG2 3.22Å; S176-F252 WeakPolarHBondContact OG-CD2 3.27Å
177T84.1Confident83.4Confident0 Ų051 Ų510%027%0.265CS..Hα-helixtrans-63.9-49.6175.1-54.90000111S121 I124 G173 L174 T175 V179 R180 E181 K237S121-T177 WeakPolarHBondContact OG-CG2 3.48Å; I124-T177 HydrophobicContact CG2-CG2 4.44Å; G173-T177 PolarHBondContact O-N 3.3Å; G173-T177 PolarHBondContact O-OG1 2.95Å; L174-T177 WeakPolarHBondContact O-CB 3.4Å; L174-T177 PolarHBondContact O-N 3.02Å; L174-T177 VanDerWaalsContact O-N 3.12Å; T175-T177 VanDerWaalsContact C-N 3.31Å; T175-T177 PolarHBondContact O-N 3.1Å; T177-V179 PolarHBondContact O-N 3.48Å; T177-R180 WeakPolarHBondContact O-CB 3.19Å; T177-R180 PolarHBondContact O-N 3.04Å; T177-E181 WeakPolarHBondContact O-CG 3.19Å; T177-E181 PolarHBondContact O-N 2.8Å; T177-E181 VanDerWaalsContact O-N 3.13Å; T177-K237 VanDerWaalsContact OG1-CE 3.24Å; T177-K237 WeakPolarHBondContact OG1-CE 3.39Å; T177-K237 PolarHBondContact OG1-NZ 2.88Å
178I85.3Confident83.2Confident43 Ų4349.2 Ų49.222%0.22125%0.248CC..Hα-helixtrans-62.1-44.8179.4-66168.2000111.2I118 L174 T175 R180 E181 I182I118-I178 HydrophobicContact CG1-CG2 4.49Å; I118-I178 HydrophobicContact CG2-CD1 4.39Å; L174-I178 HydrophobicContact CD1-CD1 4.18Å; L174-I178 HydrophobicContact CD1-CG1 4.35Å; L174-I178 HydrophobicContact CG-CD1 4.02Å; L174-I178 WeakPolarHBondContact O-CG1 3.46Å; L174-I178 PolarHBondContact O-N 3.24Å; T175-I178 PolarHBondContact O-N 2.88Å; I178-R180 PolarHBondContact O-N 2.66Å; I178-E181 PolarHBondContact O-N 2.82Å; I178-I182 HydrophobicContact CG2-CD1 3.93Å; I178-I182 PolarHBondContact O-N 2.91Å
179V85Confident82.8Confident55 Ų5545.6 Ų45.633%0.33323%0.227SC..Hα-helixtrans-64-25.7177.4172.20000111.6T175 T177 P183 I233 F252T175-V179 HydrophobicContact CG2-CG2 4.34Å; T175-V179 WeakPolarHBondContact O-CB 3.06Å; T175-V179 WeakPolarHBondContact O-CG2 3.37Å; T175-V179 PolarHBondContact O-N 3.48Å; T177-V179 PolarHBondContact O-N 3.48Å; V179-P183 WeakPolarHBondContact O-CD 3.49Å; V179-P183 VanDerWaalsContact O-CG 3.3Å; V179-P183 WeakPolarHBondContact O-CG 3.38Å; V179-I233 HydrophobicContact CB-CG2 4.48Å; V179-I233 HydrophobicContact CG1-CD1 4.1Å; V179-I233 HydrophobicContact CG1-CG2 4.19Å; V179-F252 HydrophobicContact CG1-CZ 4.48Å
180R83.6Confident82.6Confident28 Ų2847.3 Ų47.311%0.10624%0.244CC..Hα-helixtrans-72-46.4175.7-169.9-171.368.1178.9-1111.7E128 S176 T177 I178 G184 V230 I233 D234 K237E128-R180 IonicContact OE1-NH1 2.76Å; E128-R180 IonicContact OE1-NH2 3.21Å; S176-R180 VanDerWaalsContact O-CB 3.25Å; S176-R180 WeakPolarHBondContact O-CB 3.35Å; S176-R180 PolarHBondContact O-N 2.7Å; T177-R180 WeakPolarHBondContact O-CB 3.19Å; T177-R180 PolarHBondContact O-N 3.04Å; I178-R180 PolarHBondContact O-N 2.66Å; R180-G184 PolarHBondContact O-N 3.23Å; R180-V230 HydrophobicContact CB-CG1 4.33Å; R180-V230 HydrophobicContact CG-CG1 3.09Å; R180-I233 HydrophobicContact CB-CB 4.48Å; R180-I233 HydrophobicContact CB-CG2 3.74Å; R180-I233 HydrophobicContact CG-CG2 4.31Å; R180-D234 WeakPolarHBondContact CD-OD1 3.19Å; R180-D234 IonicContact CZ-OD1 3.59Å; R180-D234 IonicContact NH1-OD1 2.7Å; R180-D234 PolarHBondContact NH1-OD1 3.3Å; R180-K237 VanDerWaalsContact CZ-NZ 3.31Å
181E78.4Confident82.4Confident20 Ų2046.5 Ų46.59%0.09324%0.243CC..Hα-helixtrans-68.5-46.9-172.5-62.3-56.2128.500111.9S117 T177 I178 G184 Y185S117-E181 WeakPolarHBondContact OG-CB 3.18Å; T177-E181 WeakPolarHBondContact O-CG 3.19Å; T177-E181 PolarHBondContact O-N 2.8Å; T177-E181 VanDerWaalsContact O-N 3.13Å; I178-E181 PolarHBondContact O-N 2.82Å; E181-G184 PolarHBondContact O-N 3.07Å; E181-Y185 HydrophobicContact CB-CD2 4.32Å; E181-Y185 HydrophobicContact CB-CE2 4.24Å; E181-Y185 WeakPolarHBondContact O-CD2 3.15Å; E181-Y185 PolarHBondContact O-N 2.87Å; E181-Y185 VanDerWaalsContact OE2-CE2 3.29Å; E181-Y185 WeakPolarHBondContact OE2-CE2 3.41Å
182I77.8Confident82.1Confident83 Ų8343.9 Ų43.943%0.42623%0.233SC..Hα-helixtrans-61.6-54-170.4-62.9168.4000113I178 G184 F186I178-I182 HydrophobicContact CG2-CD1 3.93Å; I178-I182 PolarHBondContact O-N 2.91Å; I182-G184 VanDerWaalsContact C-N 3.29Å; I182-G184 PolarHBondContact O-N 2.99Å; I182-F186 PolarHBondContact O-N 3.12Å
183P78.6Confident81.9Confident46 Ų4644.5 Ų44.530%0.29924%0.236SC..Hα-helixtrans-68-32.1177.7-1732.8000112V179 F186 C187V179-P183 WeakPolarHBondContact O-CD 3.49Å; V179-P183 VanDerWaalsContact O-CG 3.3Å; V179-P183 WeakPolarHBondContact O-CG 3.38Å; P183-F186 PolarHBondContact O-N 3.26Å; P183-C187 WeakPolarHBondContact O-CB 3.41Å; P183-C187 PolarHBondContact O-N 2.97Å; P183-C187 PolarHBondContact O-SG 3.22Å; P183-C187 VanDerWaalsContact O-SG 3.42Å
184G78.1Confident82.1Confident2 Ų248.5 Ų48.52%0.02126%0.258CS..Hα-helixtrans-60-51.1178.700000112.4R180 E181 I182 C187 F188R180-G184 PolarHBondContact O-N 3.23Å; E181-G184 PolarHBondContact O-N 3.07Å; I182-G184 VanDerWaalsContact C-N 3.29Å; I182-G184 PolarHBondContact O-N 2.99Å; G184-C187 PolarHBondContact O-N 3.16Å; G184-F188 WeakPolarHBondContact O-CB 3.41Å; G184-F188 PolarHBondContact O-N 2.77Å
185Y74.8Confident82Confident62 Ų6247.7 Ų47.724%0.24326%0.256CS..Hα-helixtrans-62.9-43.1177.3-79.9-67.3000112.2E181 C187 F188 F189E181-Y185 HydrophobicContact CB-CD2 4.32Å; E181-Y185 HydrophobicContact CB-CE2 4.24Å; E181-Y185 WeakPolarHBondContact O-CD2 3.15Å; E181-Y185 PolarHBondContact O-N 2.87Å; E181-Y185 VanDerWaalsContact OE2-CE2 3.29Å; E181-Y185 WeakPolarHBondContact OE2-CE2 3.41Å; Y185-C187 PolarHBondContact O-N 3.48Å; Y185-F188 PolarHBondContact O-N 3.47Å; Y185-F189 HydrophobicContact CD1-CD2 4.45Å; Y185-F189 AromaticContact CD1-CE2 3.88Å; Y185-F189 HydrophobicContact CD1-CE2 3.88Å; Y185-F189 VanDerWaalsContact O-CD2 3.25Å; Y185-F189 WeakPolarHBondContact O-CD2 3.26Å; Y185-F189 PolarHBondContact O-N 2.76Å
186F78.6Confident81.9Confident164 Ų16443.8 Ų43.872%0.71923%0.229SC*.Hα-helixtrans-58.2-48.4177.1-179.2-96000112I182 P183 G190I182-F186 PolarHBondContact O-N 3.12Å; P183-F186 PolarHBondContact O-N 3.26Å; F186-G190 PolarHBondContact O-N 2.92Å
187C82.3Confident81.8Confident35 Ų3546.7 Ų46.724%0.23625%0.247CC..Hα-helixtrans-67.8-37.8179.2-70.90000112.8P183 G184 Y185 A191 V229P183-C187 WeakPolarHBondContact O-CB 3.41Å; P183-C187 PolarHBondContact O-N 2.97Å; P183-C187 PolarHBondContact O-SG 3.22Å; P183-C187 VanDerWaalsContact O-SG 3.42Å; G184-C187 PolarHBondContact O-N 3.16Å; Y185-C187 PolarHBondContact O-N 3.48Å; C187-A191 WeakPolarHBondContact O-CB 3.47Å; C187-A191 PolarHBondContact O-N 3.41Å; C187-V229 HydrophobicContact CB-CG2 4.42Å
188F83.6Confident82Confident54 Ų5451 Ų5124%0.23727%0.274CS..Hα-helixtrans-59.7-56.3175.7178.1-96.2000111.5G184 Y185 A191 Y192 G222 L226G184-F188 WeakPolarHBondContact O-CB 3.41Å; G184-F188 PolarHBondContact O-N 2.77Å; Y185-F188 PolarHBondContact O-N 3.47Å; F188-A191 PolarHBondContact O-N 3.3Å; F188-Y192 WeakPolarHBondContact O-CB 3.46Å; F188-Y192 PolarHBondContact O-N 3.48Å; F188-G222 VanDerWaalsContact CD2-C 3.44Å; F188-L226 HydrophobicContact CB-CB 4.07Å; F188-L226 HydrophobicContact CB-CD1 3.76Å; F188-L226 HydrophobicContact CB-CG 4.47Å; F188-L226 HydrophobicContact CD2-CB 4.43Å; F188-L226 HydrophobicContact CD2-CD1 4.22Å; F188-L226 HydrophobicContact CG-CD1 4.26Å
189F78.9Confident82Confident65 Ų6552 Ų5229%0.28528%0.277SS..Hα-helixtrans-67.9-38-177.2-76.6-68.5000111.9A110 Y185 Y192 E193A110-F189 HydrophobicContact CB-CB 4.37Å; A110-F189 HydrophobicContact CB-CD1 4.36Å; A110-F189 HydrophobicContact CB-CD2 3.27Å; A110-F189 HydrophobicContact CB-CE2 3.47Å; A110-F189 VanDerWaalsContact CB-CE2 3.47Å; A110-F189 HydrophobicContact CB-CG 3.76Å; A110-F189 HydrophobicContact CB-CZ 4.12Å; Y185-F189 HydrophobicContact CD1-CD2 4.45Å; Y185-F189 AromaticContact CD1-CE2 3.88Å; Y185-F189 HydrophobicContact CD1-CE2 3.88Å; Y185-F189 VanDerWaalsContact O-CD2 3.25Å; Y185-F189 WeakPolarHBondContact O-CD2 3.26Å; Y185-F189 PolarHBondContact O-N 2.76Å; F189-Y192 PolarHBondContact O-N 2.93Å; F189-E193 WeakPolarHBondContact O-CB 3.28Å; F189-E193 PolarHBondContact O-N 3.5Å
190G81.9Confident82.1Confident35 Ų3549.8 Ų49.836%0.36126%0.264SS..Hα-helixtrans-60.6-50.4174.900000112.3F186 E193 V194F186-G190 PolarHBondContact O-N 2.92Å; G190-E193 PolarHBondContact O-N 3.49Å; G190-V194 WeakPolarHBondContact O-CB 3.29Å; G190-V194 VanDerWaalsContact O-CG2 3.26Å; G190-V194 WeakPolarHBondContact O-CG2 3.34Å; G190-V194 PolarHBondContact O-N 3.17Å
191A84.6Confident82.3Confident14 Ų1456.4 Ų56.412%0.11630%0.296CS..Hα-helixtrans-66.5-38.8178.400000112.2C187 F188 C195 F221 C225C187-A191 WeakPolarHBondContact O-CB 3.47Å; C187-A191 PolarHBondContact O-N 3.41Å; F188-A191 PolarHBondContact O-N 3.3Å; A191-C195 VanDerWaalsContact O-CB 3.28Å; A191-C195 WeakPolarHBondContact O-CB 3.46Å; A191-C195 PolarHBondContact O-N 3.23Å; A191-F221 HydrophobicContact CB-CD1 4.18Å; A191-F221 HydrophobicContact CB-CE1 4.19Å; A191-C225 HydrophobicContact CB-CB 3.82Å
192Y83.1Confident82.7Confident46 Ų4663.3 Ų63.318%0.1833%0.328CS..Hα-helixtrans-59.7-50.7174.7175.9-100.4000111.8F188 F189 C195 R196 L215F188-Y192 WeakPolarHBondContact O-CB 3.46Å; F188-Y192 PolarHBondContact O-N 3.48Å; F189-Y192 PolarHBondContact O-N 2.93Å; Y192-C195 PolarHBondContact O-N 2.82Å; Y192-R196 HydrophobicContact CE1-CG 4.3Å; Y192-R196 HydrophobicContact CE2-CG 4.45Å; Y192-R196 WeakPolarHBondContact O-CG 3.39Å; Y192-R196 PolarHBondContact O-N 3.34Å; Y192-L215 HydrophobicContact CE2-CD1 4.24Å; Y192-L215 WeakPolarHBondContact OH-CD1 3.49Å
193E81.1Confident83Confident35 Ų3564.1 Ų64.116%0.16433%0.331CS..Hα-helixtrans-67.4-38.9-179.4-83.5-58.6125.700113.1F189 G190 C195 R196 T197 K207F189-E193 WeakPolarHBondContact O-CB 3.28Å; F189-E193 PolarHBondContact O-N 3.5Å; G190-E193 PolarHBondContact O-N 3.49Å; E193-C195 VanDerWaalsContact C-N 3.32Å; E193-C195 PolarHBondContact O-N 3.45Å; E193-R196 PolarHBondContact O-N 3.21Å; E193-R196 IonicContact OE1-CZ 3.01Å; E193-R196 IonicContact OE1-NH1 2.65Å; E193-R196 PolarHBondContact OE1-NH1 3.26Å; E193-T197 WeakPolarHBondContact O-CB 3.23Å; E193-T197 PolarHBondContact O-N 2.79Å; E193-T197 PolarHBondContact O-OG1 3.34Å; E193-K207 IonicContact OE2-NZ 3.98Å; E193-K207 PolarHBondContact OE2-NZ 3.4Å
194V86.6Confident83.2Confident93 Ų9365.3 Ų65.356%0.56435%0.351SS*.Hα-helixtrans-61.4-43.9174.1168.50000110.5G190 T197 T198G190-V194 WeakPolarHBondContact O-CB 3.29Å; G190-V194 VanDerWaalsContact O-CG2 3.26Å; G190-V194 WeakPolarHBondContact O-CG2 3.34Å; G190-V194 PolarHBondContact O-N 3.17Å; V194-T197 PolarHBondContact O-N 3.08Å; V194-T198 WeakPolarHBondContact O-CB 3.5Å; V194-T198 PolarHBondContact O-N 2.64Å; V194-T198 PolarHBondContact O-OG1 3.16Å
195C85.3Confident83.5Confident21 Ų2167.8 Ų67.814%0.14237%0.366CS..Hα-helixtrans-65-46.9179.3-1570000111.3A191 Y192 E193 T197 T198 F199 F221A191-C195 VanDerWaalsContact O-CB 3.28Å; A191-C195 WeakPolarHBondContact O-CB 3.46Å; A191-C195 PolarHBondContact O-N 3.23Å; Y192-C195 PolarHBondContact O-N 2.82Å; E193-C195 VanDerWaalsContact C-N 3.32Å; E193-C195 PolarHBondContact O-N 3.45Å; C195-T197 PolarHBondContact O-N 2.85Å; C195-T198 PolarHBondContact O-N 2.83Å; C195-F199 VanDerWaalsContact O-CD2 3.25Å; C195-F199 WeakPolarHBondContact O-CD2 3.46Å; C195-F199 PolarHBondContact O-N 3.32Å; C195-F199 VanDerWaalsContact SG-CE2 3.54Å; C195-F221 HydrophobicContact CB-CD1 4.34Å
196R83.1Confident83.8Confident16 Ų1670 Ų706%0.0638%0.382CS..Hα-helixtrans-58.2-45174.9-72.8-17666.2-16211.6112.7Y192 E193 T198 F199 A200 K207 D208 I210 S218Y192-R196 HydrophobicContact CE1-CG 4.3Å; Y192-R196 HydrophobicContact CE2-CG 4.45Å; Y192-R196 WeakPolarHBondContact O-CG 3.39Å; Y192-R196 PolarHBondContact O-N 3.34Å; E193-R196 PolarHBondContact O-N 3.21Å; E193-R196 IonicContact OE1-CZ 3.01Å; E193-R196 IonicContact OE1-NH1 2.65Å; E193-R196 PolarHBondContact OE1-NH1 3.26Å; R196-T198 VanDerWaalsContact C-N 3.3Å; R196-T198 PolarHBondContact O-N 3.4Å; R196-F199 PolarHBondContact O-N 3.19Å; R196-A200 VanDerWaalsContact O-CB 3.29Å; R196-A200 WeakPolarHBondContact O-CB 3.11Å; R196-A200 PolarHBondContact O-N 3.08Å; R196-K207 VanDerWaalsContact NH2-C 3.34Å; R196-K207 PolarHBondContact NH2-O 3.4Å; R196-D208 IonicContact CZ-OD1 3.59Å; R196-D208 IonicContact NH2-OD1 2.74Å; R196-D208 PolarHBondContact NH2-OD1 3.44Å; R196-I210 HydrophobicContact CB-CD1 4.06Å; R196-I210 HydrophobicContact CG-CD1 3.66Å; R196-S218 PolarHBondContact N-OG 3.17Å
197T84.1Confident83.5Confident63 Ų6365.5 Ų65.539%0.38736%0.362SS..Hα-helixtrans-62.6-40.2179.1-54.10000111.1E193 V194 C195 H201 K207E193-T197 WeakPolarHBondContact O-CB 3.23Å; E193-T197 PolarHBondContact O-N 2.79Å; E193-T197 PolarHBondContact O-OG1 3.34Å; V194-T197 PolarHBondContact O-N 3.08Å; C195-T197 PolarHBondContact O-N 2.85Å; T197-H201 WeakPolarHBondContact O-CB 3.33Å; T197-H201 PolarHBondContact O-N 2.87Å; T197-K207 WeakPolarHBondContact OG1-CE 3.38Å; T197-K207 PolarHBondContact OG1-NZ 2.91Å; T197-K207 VanDerWaalsContact OG1-NZ 3.08Å
198T86.8Confident83.2Confident91 Ų9170.1 Ų70.156%0.55839%0.385SS*.Hα-helixtrans-65.6-44.1177.9-54.10000111.3V194 C195 R196 H201 H202V194-T198 WeakPolarHBondContact O-CB 3.5Å; V194-T198 PolarHBondContact O-N 2.64Å; V194-T198 PolarHBondContact O-OG1 3.16Å; C195-T198 PolarHBondContact O-N 2.83Å; R196-T198 VanDerWaalsContact C-N 3.3Å; R196-T198 PolarHBondContact O-N 3.4Å; T198-H201 PolarHBondContact O-N 2.98Å; T198-H202 WeakPolarHBondContact O-CB 3.3Å; T198-H202 PolarHBondContact O-N 2.96Å
199F87.1Confident83Confident64 Ų6471.3 Ų71.328%0.28140%0.4SS..Hα-helixtrans-65.4-45176.1-81.2-63.9000112.6C195 R196 H201 H202 M203 I210 P214 F217C195-F199 VanDerWaalsContact O-CD2 3.25Å; C195-F199 WeakPolarHBondContact O-CD2 3.46Å; C195-F199 PolarHBondContact O-N 3.32Å; C195-F199 VanDerWaalsContact SG-CE2 3.54Å; R196-F199 PolarHBondContact O-N 3.19Å; F199-H201 VanDerWaalsContact C-N 3.34Å; F199-H201 PolarHBondContact O-N 3.4Å; F199-H202 PolarHBondContact O-N 2.87Å; F199-M203 WeakPolarHBondContact O-CB 3.37Å; F199-M203 VanDerWaalsContact O-CG 3.3Å; F199-M203 WeakPolarHBondContact O-CG 3.42Å; F199-M203 PolarHBondContact O-N 3.14Å; F199-I210 HydrophobicContact CB-CG2 4.41Å; F199-P214 HydrophobicContact CB-CB 4.02Å; F199-P214 HydrophobicContact CD1-CB 3.92Å; F199-P214 HydrophobicContact CD1-CG 4.17Å; F199-P214 HydrophobicContact CD2-CB 3.87Å; F199-P214 HydrophobicContact CE1-CB 4.33Å; F199-P214 HydrophobicContact CE1-CG 4.47Å; F199-P214 HydrophobicContact CE2-CB 4.27Å; F199-P214 HydrophobicContact CG-CB 3.69Å; F199-P214 HydrophobicContact CG-CG 4.41Å; F199-P214 HydrophobicContact CZ-CB 4.49Å; F199-F217 HydrophobicContact CE2-CB 4.17Å; F199-F217 HydrophobicContact CZ-CB 4.28Å
200A86.1Confident83Confident8 Ų868.4 Ų68.47%0.06639%0.387CS..Hα-helixtrans-56.9-4717600000111.4R196 H202 M203 G204 T205 K207 I210R196-A200 VanDerWaalsContact O-CB 3.29Å; R196-A200 WeakPolarHBondContact O-CB 3.11Å; R196-A200 PolarHBondContact O-N 3.08Å; A200-H202 PolarHBondContact O-N 2.9Å; A200-M203 PolarHBondContact O-N 3.44Å; A200-G204 PolarHBondContact O-N 2.87Å; A200-T205 WeakPolarHBondContact CB-O 3.33Å; A200-T205 PolarHBondContact O-N 3.4Å; A200-T205 VanDerWaalsContact O-N 3.12Å; A200-K207 HydrophobicContact CB-CG 4.19Å; A200-I210 HydrophobicContact CB-CG2 3.86Å
201H86.9Confident83Confident167 Ų16768.8 Ų68.877%0.77339%0.391SS*.Hα-helixtrans-63.3-40.4176.5-174.3-82.3000112.5T197 T198 F199T197-H201 WeakPolarHBondContact O-CB 3.33Å; T197-H201 PolarHBondContact O-N 2.87Å; T198-H201 PolarHBondContact O-N 2.98Å; F199-H201 VanDerWaalsContact C-N 3.34Å; F199-H201 PolarHBondContact O-N 3.4Å
202H87.1Confident82.9Confident165 Ų16574.4 Ų74.476%0.76442%0.418SS*.Hα-helixtrans-71.1-33179.8-163.870.5000112.9T198 F199 A200T198-H202 WeakPolarHBondContact O-CB 3.3Å; T198-H202 PolarHBondContact O-N 2.96Å; F199-H202 PolarHBondContact O-N 2.87Å; A200-H202 PolarHBondContact O-N 2.9Å
203M85.6Confident83Confident100 Ų10078 Ų7849%0.49344%0.439SS..Hα-helixtrans-89.4-10179.7-62.8-178.477.200113.1F199 A200 T205 P214F199-M203 WeakPolarHBondContact O-CB 3.37Å; F199-M203 VanDerWaalsContact O-CG 3.3Å; F199-M203 WeakPolarHBondContact O-CG 3.42Å; F199-M203 PolarHBondContact O-N 3.14Å; A200-M203 PolarHBondContact O-N 3.44Å; M203-T205 HydrophobicContact CB-CG2 4.07Å; M203-T205 PolarHBondContact O-N 3.12Å; M203-P214 HydrophobicContact SD-CG 4Å
204G82.6Confident83.1Confident71 Ų7177.1 Ų77.173%0.73244%0.437SS*.THydrogen-bonded Turntrans6526-174.900000113.3A200A200-G204 PolarHBondContact O-N 2.87Å
205T84.3Confident82.9Confident54 Ų5476.1 Ų76.133%0.33143%0.428SS..SBendtrans-115.5167.9-177.769.90000111A200 M203A200-T205 WeakPolarHBondContact CB-O 3.33Å; A200-T205 PolarHBondContact O-N 3.4Å; A200-T205 VanDerWaalsContact O-N 3.12Å; M203-T205 HydrophobicContact CB-CG2 4.07Å; M203-T205 PolarHBondContact O-N 3.12Å
206D80.4Confident82.8Confident109 Ų10981.2 Ų81.258%0.58345%0.451SS*.  trans-75.2157171.8-163.516.1000111.6D208 S209D206-D208 PolarHBondContact O-N 3.02Å; D206-D208 VanDerWaalsContact O-N 3.09Å; D206-S209 WeakPolarHBondContact O-CA 3.33Å; D206-S209 PolarHBondContact O-N 2.83Å
207K72.2Confident83Confident69 Ų6987 Ų8730%0.348%0.477SS..G310 helixtrans-57.1-29.2-175.3-71.5-175.4173.6-165.80113.9E193 R196 T197 A200 S209 I210E193-K207 IonicContact OE2-NZ 3.98Å; E193-K207 PolarHBondContact OE2-NZ 3.4Å; R196-K207 VanDerWaalsContact NH2-C 3.34Å; R196-K207 PolarHBondContact NH2-O 3.4Å; T197-K207 WeakPolarHBondContact OG1-CE 3.38Å; T197-K207 PolarHBondContact OG1-NZ 2.91Å; T197-K207 VanDerWaalsContact OG1-NZ 3.08Å; A200-K207 HydrophobicContact CB-CG 4.19Å; K207-S209 VanDerWaalsContact C-N 3.3Å; K207-I210 WeakPolarHBondContact O-CG1 3.49Å
208D75.1Confident83Confident132 Ų13284 Ų8471%0.70646%0.459SS*.G310 helixtrans-85.4-7.2-179.7-63.3-29.9000112.7R196 D206R196-D208 IonicContact CZ-OD1 3.59Å; R196-D208 IonicContact NH2-OD1 2.74Å; R196-D208 PolarHBondContact NH2-OD1 3.44Å; D206-D208 PolarHBondContact O-N 3.02Å; D206-D208 VanDerWaalsContact O-N 3.09Å
209S80.2Confident82.8Confident79 Ų7980.8 Ų80.855%0.55244%0.444SS*.G310 helixtrans-110.19.9-177.5-57.90000113.8D206 K207 G211D206-S209 WeakPolarHBondContact O-CA 3.33Å; D206-S209 PolarHBondContact O-N 2.83Å; K207-S209 VanDerWaalsContact C-N 3.3Å; S209-G211 PolarHBondContact O-N 3.46Å; S209-G211 VanDerWaalsContact O-N 3.09Å
210I79.3Confident82.8Confident4 Ų480 Ų802%0.02145%0.454CS..SBendtrans-68.5-4.9-177.263177.3000114.1R196 F199 A200 K207 P214 L215R196-I210 HydrophobicContact CB-CD1 4.06Å; R196-I210 HydrophobicContact CG-CD1 3.66Å; F199-I210 HydrophobicContact CB-CG2 4.41Å; A200-I210 HydrophobicContact CB-CG2 3.86Å; K207-I210 WeakPolarHBondContact O-CG1 3.49Å; I210-P214 HydrophobicContact CB-CB 4.08Å; I210-P214 HydrophobicContact CD1-CB 4.28Å; I210-P214 HydrophobicContact CG1-CB 4.27Å; I210-P214 WeakPolarHBondContact O-CB 3.24Å; I210-P214 VanDerWaalsContact O-CD 3.23Å; I210-P214 WeakPolarHBondContact O-CD 3.4Å; I210-P214 WeakPolarHBondContact O-CG 3.07Å; I210-L215 HydrophobicContact CD1-CB 4.5Å; I210-L215 HydrophobicContact CD1-CD1 4.34Å
211G82.2Confident82.8Confident43 Ų4384.8 Ų84.844%0.44347%0.474SS..  trans73.7170179.500000114.1S209 L213 L215S209-G211 PolarHBondContact O-N 3.46Å; S209-G211 VanDerWaalsContact O-N 3.09Å; G211-L213 PolarHBondContact O-N 3.45Å; G211-L215 VanDerWaalsContact O-CB 3.27Å; G211-L215 WeakPolarHBondContact O-CB 3.23Å; G211-L215 PolarHBondContact O-N 3.32Å
212I82.4Confident82.7Confident132 Ų13276.9 Ų76.968%0.67744%0.437SS*.Hα-helixtrans-66-40.2-170-62168.8000112L215 M216I212-L215 WeakPolarHBondContact O-CB 3.41Å; I212-L215 PolarHBondContact O-N 3.29Å; I212-M216 HydrophobicContact CG2-CG 4.15Å; I212-M216 HydrophobicContact CG2-SD 3.8Å; I212-M216 WeakPolarHBondContact O-CB 3.17Å; I212-M216 VanDerWaalsContact O-CG 3.24Å; I212-M216 WeakPolarHBondContact O-CG 3.48Å; I212-M216 PolarHBondContact O-N 2.98Å
213L83.8Confident82.5Confident121 Ų12169.8 Ų69.863%0.63441%0.409SS*.Hα-helixtrans-66.7-54.8-175.7-79.7171.7000112.7G211 L215 M216 F217G211-L213 PolarHBondContact O-N 3.45Å; L213-L215 PolarHBondContact O-N 3.4Å; L213-M216 PolarHBondContact O-N 3.39Å; L213-F217 WeakPolarHBondContact O-CD2 3.24Å; L213-F217 PolarHBondContact O-N 3.18Å
214P84.6Confident82.5Confident18 Ų1866.5 Ų66.512%0.11740%0.398CS..Hα-helixtrans-57.1-35.2172.8-32.742000113.9F199 M203 I210 F217 S218F199-P214 HydrophobicContact CB-CB 4.02Å; F199-P214 HydrophobicContact CD1-CB 3.92Å; F199-P214 HydrophobicContact CD1-CG 4.17Å; F199-P214 HydrophobicContact CD2-CB 3.87Å; F199-P214 HydrophobicContact CE1-CB 4.33Å; F199-P214 HydrophobicContact CE1-CG 4.47Å; F199-P214 HydrophobicContact CE2-CB 4.27Å; F199-P214 HydrophobicContact CG-CB 3.69Å; F199-P214 HydrophobicContact CG-CG 4.41Å; F199-P214 HydrophobicContact CZ-CB 4.49Å; M203-P214 HydrophobicContact SD-CG 4Å; I210-P214 HydrophobicContact CB-CB 4.08Å; I210-P214 HydrophobicContact CD1-CB 4.28Å; I210-P214 HydrophobicContact CG1-CB 4.27Å; I210-P214 WeakPolarHBondContact O-CB 3.24Å; I210-P214 VanDerWaalsContact O-CD 3.23Å; I210-P214 WeakPolarHBondContact O-CD 3.4Å; I210-P214 WeakPolarHBondContact O-CG 3.07Å; P214-F217 PolarHBondContact O-N 3.2Å; P214-S218 WeakPolarHBondContact O-CB 3.27Å; P214-S218 PolarHBondContact O-N 3.07Å; P214-S218 PolarHBondContact O-OG 3.32Å
215L82.7Confident82.7Confident71 Ų7164.6 Ų64.637%0.37237%0.373SS..Hα-helixtrans-64.8-46175.4-171.168.6000111.9Y192 I210 G211 I212 L213 S218 G219Y192-L215 HydrophobicContact CE2-CD1 4.24Å; Y192-L215 WeakPolarHBondContact OH-CD1 3.49Å; I210-L215 HydrophobicContact CD1-CB 4.5Å; I210-L215 HydrophobicContact CD1-CD1 4.34Å; G211-L215 VanDerWaalsContact O-CB 3.27Å; G211-L215 WeakPolarHBondContact O-CB 3.23Å; G211-L215 PolarHBondContact O-N 3.32Å; I212-L215 WeakPolarHBondContact O-CB 3.41Å; I212-L215 PolarHBondContact O-N 3.29Å; L213-L215 PolarHBondContact O-N 3.4Å; L215-S218 PolarHBondContact O-N 3.45Å; L215-G219 PolarHBondContact O-N 2.93Å
216M83.2Confident82.8Confident128 Ų12863.7 Ų63.763%0.63137%0.365SS*.Hα-helixtrans-61.6-43.7175.2-74.6177.77200111.9I212 L213 G219 G220I212-M216 HydrophobicContact CG2-CG 4.15Å; I212-M216 HydrophobicContact CG2-SD 3.8Å; I212-M216 WeakPolarHBondContact O-CB 3.17Å; I212-M216 VanDerWaalsContact O-CG 3.24Å; I212-M216 WeakPolarHBondContact O-CG 3.48Å; I212-M216 PolarHBondContact O-N 2.98Å; L213-M216 PolarHBondContact O-N 3.39Å; M216-G219 PolarHBondContact O-N 2.89Å; M216-G220 PolarHBondContact O-N 3.26Å
217F86.9Confident83.1Confident137 Ų13762 Ų6260%0.60135%0.351SS*.Hα-helixtrans-63.2-43175.7-89-74.1000112F199 L213 P214 G219 G220 F221F199-F217 HydrophobicContact CE2-CB 4.17Å; F199-F217 HydrophobicContact CZ-CB 4.28Å; L213-F217 WeakPolarHBondContact O-CD2 3.24Å; L213-F217 PolarHBondContact O-N 3.18Å; P214-F217 PolarHBondContact O-N 3.2Å; F217-G219 VanDerWaalsContact C-N 3.33Å; F217-G219 PolarHBondContact O-N 3.39Å; F217-G220 PolarHBondContact O-N 2.87Å; F217-F221 VanDerWaalsContact O-CB 3.31Å; F217-F221 WeakPolarHBondContact O-CB 3.36Å; F217-F221 PolarHBondContact O-N 3.06Å
218S83.6Confident83.8Confident0 Ų062.6 Ų62.60%036%0.357CS..Hα-helixtrans-61.1-43.1176.9-58.70000111.3R196 P214 L215 G222R196-S218 PolarHBondContact N-OG 3.17Å; P214-S218 WeakPolarHBondContact O-CB 3.27Å; P214-S218 PolarHBondContact O-N 3.07Å; P214-S218 PolarHBondContact O-OG 3.32Å; L215-S218 PolarHBondContact O-N 3.45Å; S218-G222 PolarHBondContact O-N 3.22Å
219G83.5Confident84.3Confident24 Ų2459.6 Ų59.625%0.24734%0.343CS..Hα-helixtrans-64.4-44.7174.800000113L215 M216 F217 G222 G223L215-G219 PolarHBondContact O-N 2.93Å; M216-G219 PolarHBondContact O-N 2.89Å; F217-G219 VanDerWaalsContact C-N 3.33Å; F217-G219 PolarHBondContact O-N 3.39Å; G219-G222 PolarHBondContact O-N 3.02Å; G219-G223 PolarHBondContact O-N 3.27Å
220G85.2Confident84.7Confident48 Ų4856 Ų5650%0.49532%0.318SS..Hα-helixtrans-64.2-43.8177.700000113M216 F217 G223 A224M216-G220 PolarHBondContact O-N 3.26Å; F217-G220 PolarHBondContact O-N 2.87Å; G220-G223 PolarHBondContact O-N 3.49Å; G220-A224 PolarHBondContact O-N 3.47Å
221F86.2Confident85.2Confident109 Ų10955.8 Ų55.848%0.47832%0.317SS..Hα-helixtrans-64.9-45.6175.9-176-107.2000111.5A191 C195 F217 G223 A224 C225A191-F221 HydrophobicContact CB-CD1 4.18Å; A191-F221 HydrophobicContact CB-CE1 4.19Å; C195-F221 HydrophobicContact CB-CD1 4.34Å; F217-F221 VanDerWaalsContact O-CB 3.31Å; F217-F221 WeakPolarHBondContact O-CB 3.36Å; F217-F221 PolarHBondContact O-N 3.06Å; F221-G223 VanDerWaalsContact C-N 3.3Å; F221-G223 PolarHBondContact O-N 2.87Å; F221-A224 PolarHBondContact O-N 2.98Å; F221-C225 PolarHBondContact O-N 3.45Å; F221-C225 PolarHBondContact O-SG 3.11Å
222G84.8Confident85.6Confident0 Ų054.5 Ų54.50%030%0.301CS..Hα-helixtrans-57-44173.400000112.4F188 S218 G219 C225 L226F188-G222 VanDerWaalsContact CD2-C 3.44Å; S218-G222 PolarHBondContact O-N 3.22Å; G219-G222 PolarHBondContact O-N 3.02Å; G222-C225 PolarHBondContact O-N 3.38Å; G222-L226 WeakPolarHBondContact O-CB 3.24Å; G222-L226 PolarHBondContact O-N 2.71Å
223G83.9Confident86.1Confident17 Ų1749.3 Ų49.318%0.17527%0.274CS..Hα-helixtrans-61.8-42.617500000113.2G219 G220 F221 L226 W227G219-G223 PolarHBondContact O-N 3.27Å; G220-G223 PolarHBondContact O-N 3.49Å; F221-G223 VanDerWaalsContact C-N 3.3Å; F221-G223 PolarHBondContact O-N 2.87Å; G223-L226 PolarHBondContact O-N 3.47Å; G223-W227 PolarHBondContact O-N 3.49Å
224A84.9Confident86.3Confident31 Ų3143.7 Ų43.726%0.25625%0.245SC..Hα-helixtrans-63.5-45.2176.500000111.8G220 F221 W227 L228 M276G220-A224 PolarHBondContact O-N 3.47Å; F221-A224 PolarHBondContact O-N 2.98Å; A224-W227 PolarHBondContact O-N 2.97Å; A224-L228 VanDerWaalsContact O-CG 3.3Å; A224-L228 WeakPolarHBondContact O-CG 3.49Å; A224-L228 PolarHBondContact O-N 3.3Å; A224-M276 HydrophobicContact CB-CE 4.39Å
225C86.5Confident86.6Confident31 Ų3142.8 Ų42.821%0.20924%0.239CC..Hα-helixtrans-61.2-44.3175.7-71.80000112.2A191 F221 G222 W227 L228 V229A191-C225 HydrophobicContact CB-CB 3.82Å; F221-C225 PolarHBondContact O-N 3.45Å; F221-C225 PolarHBondContact O-SG 3.11Å; G222-C225 PolarHBondContact O-N 3.38Å; C225-W227 PolarHBondContact O-N 2.97Å; C225-L228 PolarHBondContact O-N 3.49Å; C225-V229 WeakPolarHBondContact O-CG2 3.13Å; C225-V229 PolarHBondContact O-N 2.91Å
226L87.6Confident87Confident34 Ų3439.4 Ų39.418%0.17822%0.221CC..Hα-helixtrans-54.3-55.2173.1175.2159.8000110.1F188 G222 G223 L228 V229 V230F188-L226 HydrophobicContact CB-CB 4.07Å; F188-L226 HydrophobicContact CB-CD1 3.76Å; F188-L226 HydrophobicContact CB-CG 4.47Å; F188-L226 HydrophobicContact CD2-CB 4.43Å; F188-L226 HydrophobicContact CD2-CD1 4.22Å; F188-L226 HydrophobicContact CG-CD1 4.26Å; G222-L226 WeakPolarHBondContact O-CB 3.24Å; G222-L226 PolarHBondContact O-N 2.71Å; G223-L226 PolarHBondContact O-N 3.47Å; L226-L228 VanDerWaalsContact C-N 3.3Å; L226-L228 PolarHBondContact O-N 2.97Å; L226-V229 PolarHBondContact O-N 3.27Å; L226-V230 HydrophobicContact CD2-CB 4.38Å; L226-V230 HydrophobicContact CD2-CG2 4.16Å; L226-V230 HydrophobicContact CG-CG2 4.14Å; L226-V230 WeakPolarHBondContact O-CB 3.44Å; L226-V230 WeakPolarHBondContact O-CG2 3.35Å; L226-V230 PolarHBondContact O-N 3.43Å
227W85.8Confident87.4Confident73 Ų7333.5 Ų33.528%0.27719%0.192SC..Hα-helixtrans-61.3-40.2-176.3-80.5113.9000111.8G223 A224 C225 V229 V230 Y231 T275G223-W227 PolarHBondContact O-N 3.49Å; A224-W227 PolarHBondContact O-N 2.97Å; C225-W227 PolarHBondContact O-N 2.97Å; W227-V229 VanDerWaalsContact C-N 3.35Å; W227-V229 PolarHBondContact O-N 3.35Å; W227-V230 PolarHBondContact O-N 3.09Å; W227-Y231 HydrophobicContact CE3-CD2 4.18Å; W227-Y231 WeakPolarHBondContact O-CB 3.4Å; W227-Y231 PolarHBondContact O-N 2.98Å; W227-T275 HydrophobicContact CD2-CG2 4.04Å; W227-T275 HydrophobicContact CE3-CG2 4.02Å; W227-T275 HydrophobicContact CH2-CG2 4.09Å; W227-T275 HydrophobicContact CZ2-CG2 4.1Å; W227-T275 HydrophobicContact CZ3-CG2 4.05Å
228L86.8Confident87.5Confident83 Ų8327.1 Ų27.144%0.43517%0.165SC..Hα-helixtrans-61.8-37.8178.8-74.1172.5000113.8A224 C225 L226 Y269 L272A224-L228 VanDerWaalsContact O-CG 3.3Å; A224-L228 WeakPolarHBondContact O-CG 3.49Å; A224-L228 PolarHBondContact O-N 3.3Å; C225-L228 PolarHBondContact O-N 3.49Å; L226-L228 VanDerWaalsContact C-N 3.3Å; L226-L228 PolarHBondContact O-N 2.97Å; L228-Y269 WeakPolarHBondContact O-CE1 3.33Å; L228-Y269 PolarHBondContact O-OH 2.84Å; L228-L272 HydrophobicContact CD2-CD2 4.14Å
229V86.6Confident87.7Confident68 Ų6827.6 Ų27.641%0.41217%0.167SC..Hα-helixtrans-79.9-38.9179.8173.20000111.4C187 C225 L226 W227 P232C187-V229 HydrophobicContact CB-CG2 4.42Å; C225-V229 WeakPolarHBondContact O-CG2 3.13Å; C225-V229 PolarHBondContact O-N 2.91Å; L226-V229 PolarHBondContact O-N 3.27Å; W227-V229 VanDerWaalsContact C-N 3.35Å; W227-V229 PolarHBondContact O-N 3.35Å; V229-P232 WeakPolarHBondContact O-CD 3.33Å
230V89.1Confident88Confident4 Ų427.4 Ų27.42%0.02416%0.159CC..Hα-helixtrans-82.3-24.9-172.2175.90000112.3R180 L226 W227 I233 D234R180-V230 HydrophobicContact CB-CG1 4.33Å; R180-V230 HydrophobicContact CG-CG1 3.09Å; L226-V230 HydrophobicContact CD2-CB 4.38Å; L226-V230 HydrophobicContact CD2-CG2 4.16Å; L226-V230 HydrophobicContact CG-CG2 4.14Å; L226-V230 WeakPolarHBondContact O-CB 3.44Å; L226-V230 WeakPolarHBondContact O-CG2 3.35Å; L226-V230 PolarHBondContact O-N 3.43Å; W227-V230 PolarHBondContact O-N 3.09Å; V230-I233 WeakPolarHBondContact O-CB 3.31Å; V230-I233 PolarHBondContact O-N 2.89Å; V230-D234 PolarHBondContact O-N 3.33Å
231Y89.6Confident88.1Confident0 Ų025.1 Ų25.10%014%0.136CC..Hα-helixtrans-53.3-44.8-172.7-143.6-91.2000114.9Q38 W227 I233 D234 C235 L268 Y269 S270 G271 L272 T275Q38-Y231 PolarHBondContact NE2-OH 3.5Å; Q38-Y231 VanDerWaalsContact NE2-OH 3.08Å; W227-Y231 HydrophobicContact CE3-CD2 4.18Å; W227-Y231 WeakPolarHBondContact O-CB 3.4Å; W227-Y231 PolarHBondContact O-N 2.98Å; Y231-I233 VanDerWaalsContact C-N 3.28Å; Y231-I233 PolarHBondContact O-N 2.88Å; Y231-D234 PolarHBondContact O-N 2.86Å; Y231-C235 PolarHBondContact O-N 3.17Å; Y231-L268 WeakPolarHBondContact CD1-O 3.4Å; Y231-Y269 HydrophobicContact CD1-CD1 4.18Å; Y231-Y269 HydrophobicContact CG-CD1 4.27Å; Y231-S270 WeakPolarHBondContact CE1-O 3.47Å; Y231-S270 PolarHBondContact OH-O 2.96Å; Y231-G271 VanDerWaalsContact CZ-C 3.43Å; Y231-G271 WeakPolarHBondContact OH-CA 3.4Å; Y231-G271 PolarHBondContact OH-O 3.15Å; Y231-L272 HydrophobicContact CD2-CB 4.34Å; Y231-L272 HydrophobicContact CD2-CD1 3.57Å; Y231-L272 HydrophobicContact CE1-CB 4.26Å; Y231-L272 HydrophobicContact CE2-CB 4.09Å; Y231-L272 HydrophobicContact CE2-CD1 3.84Å; Y231-L272 HydrophobicContact CG-CD1 4.18Å; Y231-L272 VanDerWaalsContact CZ-N 3.27Å; Y231-L272 PolarHBondContact OH-N 2.95Å; Y231-L272 VanDerWaalsContact OH-N 3.11Å; Y231-T275 HydrophobicContact CE2-CG2 4.38Å; Y231-T275 PolarHBondContact OH-OG1 3.43Å
232P90.8Very high88Confident15 Ų1520 Ų2010%0.09711%0.113CC..Hα-helixtrans-58.2-39.5177.8-27.537.5000113.5V229 C235 V236 L268 Y269V229-P232 WeakPolarHBondContact O-CD 3.33Å; P232-C235 PolarHBondContact O-N 3.03Å; P232-V236 WeakPolarHBondContact O-CG2 3.47Å; P232-V236 PolarHBondContact O-N 2.88Å; P232-L268 HydrophobicContact CB-CB 4.06Å; P232-L268 HydrophobicContact CB-CD1 4.24Å; P232-L268 HydrophobicContact CB-CD2 4.39Å; P232-L268 HydrophobicContact CB-CG 4.46Å; P232-L268 HydrophobicContact CG-CB 4.4Å; P232-Y269 HydrophobicContact CG-CE1 4.34Å; P232-Y269 HydrophobicContact CG-CE2 3.97Å
233I91.3Very high87.9Confident23 Ų2322.1 Ų22.112%0.11812%0.122CC..Hα-helixtrans-69.2-41.8179.3-57.4164.2000109.6S176 V179 R180 V230 Y231 V236 K237 F252S176-I233 WeakPolarHBondContact O-CG2 3.22Å; V179-I233 HydrophobicContact CB-CG2 4.48Å; V179-I233 HydrophobicContact CG1-CD1 4.1Å; V179-I233 HydrophobicContact CG1-CG2 4.19Å; R180-I233 HydrophobicContact CB-CB 4.48Å; R180-I233 HydrophobicContact CB-CG2 3.74Å; R180-I233 HydrophobicContact CG-CG2 4.31Å; V230-I233 WeakPolarHBondContact O-CB 3.31Å; V230-I233 PolarHBondContact O-N 2.89Å; Y231-I233 VanDerWaalsContact C-N 3.28Å; Y231-I233 PolarHBondContact O-N 2.88Å; I233-V236 PolarHBondContact O-N 2.87Å; I233-K237 WeakPolarHBondContact O-CB 3.33Å; I233-K237 PolarHBondContact O-N 2.88Å; I233-F252 HydrophobicContact CB-CE2 4.42Å; I233-F252 HydrophobicContact CG1-CZ 4.22Å; I233-F252 HydrophobicContact CG2-CE2 3.81Å; I233-F252 HydrophobicContact CG2-CZ 4.19Å
234D89.6Confident87.6Confident3 Ų321.4 Ų21.42%0.01611%0.114CC..Hα-helixtrans-63.9-39.3177.6-169.582.9000112.2K34 Q38 R180 V230 Y231 K237 S238K34-D234 WeakPolarHBondContact CE-OD2 3.31Å; K34-D234 IonicContact NZ-OD1 2.79Å; K34-D234 IonicContact NZ-OD2 3.91Å; K34-D234 PolarHBondContact NZ-OD2 3.32Å; Q38-D234 PolarHBondContact NE2-OD2 3.4Å; R180-D234 WeakPolarHBondContact CD-OD1 3.19Å; R180-D234 IonicContact CZ-OD1 3.59Å; R180-D234 IonicContact NH1-OD1 2.7Å; R180-D234 PolarHBondContact NH1-OD1 3.3Å; V230-D234 PolarHBondContact O-N 3.33Å; Y231-D234 PolarHBondContact O-N 2.86Å; D234-K237 WeakPolarHBondContact O-CB 3.29Å; D234-K237 PolarHBondContact O-N 3.07Å; D234-S238 PolarHBondContact O-N 3.31Å; D234-S238 PolarHBondContact O-OG 3.46Å
235C90.2Very high86.8Confident0 Ų020.8 Ų20.80%011%0.107CC..Hα-helixtrans-62.2-44.8173.7-174.10000112.1Q38 Y231 P232 S238 R239 L268Q38-C235 HydrophobicContact CG-CB 4.42Å; Y231-C235 PolarHBondContact O-N 3.17Å; P232-C235 PolarHBondContact O-N 3.03Å; C235-S238 PolarHBondContact O-N 2.87Å; C235-R239 PolarHBondContact O-N 3.2Å; C235-L268 VanDerWaalsContact CB-O 3.24Å; C235-L268 WeakPolarHBondContact CB-O 3.34Å
236V91.4Very high85.8Confident0 Ų021.5 Ų21.50%011%0.114CC..Hα-helixtrans-62.3-43.9175.4174.30000111.3P232 I233 R239 I240 F252 T255 F256 I259 L268P232-V236 WeakPolarHBondContact O-CG2 3.47Å; P232-V236 PolarHBondContact O-N 2.88Å; I233-V236 PolarHBondContact O-N 2.87Å; V236-R239 PolarHBondContact O-N 3.43Å; V236-I240 HydrophobicContact CG1-CD1 3.72Å; V236-I240 HydrophobicContact CG1-CG1 4.4Å; V236-I240 WeakPolarHBondContact O-CG1 3.31Å; V236-I240 PolarHBondContact O-N 3.07Å; V236-F252 HydrophobicContact CB-CD2 4.18Å; V236-F252 HydrophobicContact CB-CE2 3.85Å; V236-F252 HydrophobicContact CG1-CD2 3.44Å; V236-F252 VanDerWaalsContact CG1-CD2 3.44Å; V236-F252 HydrophobicContact CG1-CE2 3.63Å; V236-F252 HydrophobicContact CG1-CG 4.23Å; V236-F252 HydrophobicContact CG2-CE2 4.35Å; V236-T255 HydrophobicContact CG1-CG2 4Å; V236-F256 HydrophobicContact CG2-CB 3.92Å; V236-F256 HydrophobicContact CG2-CD2 3.85Å; V236-F256 HydrophobicContact CG2-CG 4.4Å; V236-I259 HydrophobicContact CG2-CD1 3.8Å; V236-L268 HydrophobicContact CG2-CD2 4.21Å
237K90.7Very high84.6Confident3 Ų322.5 Ų22.51%0.01313%0.133CC..Hα-helixtrans-56.4-52.2177.4175.9-173167175.80111.4E128 T177 R180 I233 D234 R239 I240 Q241E128-K237 IonicContact OE1-NZ 3.72Å; E128-K237 PolarHBondContact OE1-NZ 2.74Å; E128-K237 WeakPolarHBondContact OE2-CE 3.34Å; E128-K237 IonicContact OE2-NZ 2.66Å; E128-K237 PolarHBondContact OE2-NZ 2.85Å; T177-K237 VanDerWaalsContact OG1-CE 3.24Å; T177-K237 WeakPolarHBondContact OG1-CE 3.39Å; T177-K237 PolarHBondContact OG1-NZ 2.88Å; R180-K237 VanDerWaalsContact CZ-NZ 3.31Å; I233-K237 WeakPolarHBondContact O-CB 3.33Å; I233-K237 PolarHBondContact O-N 2.88Å; D234-K237 WeakPolarHBondContact O-CB 3.29Å; D234-K237 PolarHBondContact O-N 3.07Å; K237-R239 VanDerWaalsContact C-N 3.29Å; K237-R239 PolarHBondContact O-N 3.47Å; K237-I240 PolarHBondContact O-N 3.03Å; K237-Q241 HydrophobicContact CG-CG 4.4Å; K237-Q241 WeakPolarHBondContact O-CG 3.39Å; K237-Q241 PolarHBondContact O-N 3.37Å
238S88.6Confident83.4Confident4 Ų426.8 Ų26.83%0.02815%0.149CC..Hα-helixtrans-56.8-42.9-179.6-68.20000111.8Q38 D234 C235 Q241 V242Q38-S238 VanDerWaalsContact OE1-CB 3.3Å; Q38-S238 PolarHBondContact OE1-OG 3.04Å; D234-S238 PolarHBondContact O-N 3.31Å; D234-S238 PolarHBondContact O-OG 3.46Å; C235-S238 PolarHBondContact O-N 2.87Å; S238-Q241 PolarHBondContact O-N 2.88Å; S238-V242 WeakPolarHBondContact O-CB 3.4Å; S238-V242 VanDerWaalsContact O-CG2 3.26Å; S238-V242 WeakPolarHBondContact O-CG2 3.42Å; S238-V242 PolarHBondContact O-N 2.79Å
239R89.6Confident82.1Confident10 Ų1028 Ų284%0.03815%0.153CC..Hα-helixtrans-64.9-43.8177.1-71-177-173.5-138.93.6113.2Q38 C235 V236 K237 Q241 V242 Y243 T255 E263Q38-R239 VanDerWaalsContact O-CZ 3.3Å; Q38-R239 PolarHBondContact O-NE 2.84Å; Q38-R239 PolarHBondContact O-NH2 2.79Å; Q38-R239 VanDerWaalsContact O-NH2 3.08Å; C235-R239 PolarHBondContact O-N 3.2Å; V236-R239 PolarHBondContact O-N 3.43Å; K237-R239 VanDerWaalsContact C-N 3.29Å; K237-R239 PolarHBondContact O-N 3.47Å; R239-Q241 VanDerWaalsContact C-N 3.35Å; R239-V242 PolarHBondContact O-N 3.49Å; R239-Y243 HydrophobicContact CB-CD2 4.15Å; R239-Y243 HydrophobicContact CB-CE2 4.28Å; R239-Y243 HydrophobicContact CG-CE2 4.26Å; R239-Y243 VanDerWaalsContact O-CB 3.27Å; R239-Y243 WeakPolarHBondContact O-CB 3.46Å; R239-Y243 PolarHBondContact O-N 3.37Å; R239-T255 HydrophobicContact CB-CG2 4.2Å; R239-E263 IonicContact CZ-OE1 2.93Å; R239-E263 IonicContact CZ-OE2 3.63Å; R239-E263 VanDerWaalsContact CZ-OE2 3.3Å; R239-E263 VanDerWaalsContact NH1-CD 3.26Å; R239-E263 IonicContact NH1-OE1 2.66Å; R239-E263 PolarHBondContact NH1-OE1 3.27Å; R239-E263 IonicContact NH1-OE2 2.69Å; R239-E263 PolarHBondContact NH1-OE2 3.03Å; R239-E263 VanDerWaalsContact NH1-OE2 3.12Å; R239-E263 IonicContact NH2-OE1 3.85Å; R239-E263 IonicContact NH2-OE2 3.69Å; R239-E263 PolarHBondContact NH2-OE2 3.43Å
240I88.6Confident81.3Confident19 Ų1927.7 Ų27.710%0.09715%0.146CC..Hα-helixtrans-61.9-45.9177-69.4170.9000110V236 K237 V242 S244 T255V236-I240 HydrophobicContact CG1-CD1 3.72Å; V236-I240 HydrophobicContact CG1-CG1 4.4Å; V236-I240 WeakPolarHBondContact O-CG1 3.31Å; V236-I240 PolarHBondContact O-N 3.07Å; K237-I240 PolarHBondContact O-N 3.03Å; I240-V242 VanDerWaalsContact C-N 3.35Å; I240-V242 PolarHBondContact O-N 3.38Å; I240-S244 WeakPolarHBondContact O-CB 3.4Å; I240-S244 PolarHBondContact O-N 3.46Å; I240-S244 VanDerWaalsContact O-N 3.14Å; I240-S244 PolarHBondContact O-OG 3.46Å; I240-T255 HydrophobicContact CG1-CG2 4.13Å
241Q86.8Confident80.9Confident1 Ų129.6 Ų29.61%0.00517%0.167CC..Hα-helixtrans-65-37-179.3-72.8-176.3-25.600112.6L129 C132 R133 Q172 K237 S238 R239 S244L129-Q241 HydrophobicContact CD1-CG 4.46Å; C132-Q241 HydrophobicContact CB-CB 4.34Å; C132-Q241 PolarHBondContact SG-OE1 3.39Å; C132-Q241 VanDerWaalsContact SG-OE1 3.4Å; R133-Q241 WeakPolarHBondContact CG-O 3.31Å; R133-Q241 PolarHBondContact NE-O 3.09Å; Q172-Q241 WeakPolarHBondContact O-CG 3.25Å; K237-Q241 HydrophobicContact CG-CG 4.4Å; K237-Q241 WeakPolarHBondContact O-CG 3.39Å; K237-Q241 PolarHBondContact O-N 3.37Å; S238-Q241 PolarHBondContact O-N 2.88Å; R239-Q241 VanDerWaalsContact C-N 3.35Å; Q241-S244 PolarHBondContact O-OG 2.94Å; Q241-S244 VanDerWaalsContact O-OG 3.06Å
242V84.6Confident80.8Confident0 Ų031.1 Ų31.10%017%0.174CC..Hα-helixtrans-79.2-50.8178.5178.80000112.1V35 T39 F40 C132 A136 M140 S238 R239 I240 S244 L245V35-V242 HydrophobicContact CG1-CG2 4.24Å; T39-V242 HydrophobicContact CG2-CB 3.84Å; T39-V242 HydrophobicContact CG2-CG1 3.74Å; T39-V242 HydrophobicContact CG2-CG2 4.26Å; F40-V242 HydrophobicContact CE2-CG1 4.5Å; C132-V242 HydrophobicContact CB-CG2 4.09Å; A136-V242 HydrophobicContact CB-CB 4.39Å; A136-V242 HydrophobicContact CB-CG1 3.56Å; A136-V242 HydrophobicContact CB-CG2 3.83Å; M140-V242 HydrophobicContact CE-CG1 3.89Å; M140-V242 WeakPolarHBondContact CE-O 3.49Å; M140-V242 HydrophobicContact CG-CG1 3.98Å; M140-V242 HydrophobicContact SD-CG1 3.48Å; M140-V242 WeakPolarHBondContact SD-CG1 3.48Å; S238-V242 WeakPolarHBondContact O-CB 3.4Å; S238-V242 VanDerWaalsContact O-CG2 3.26Å; S238-V242 WeakPolarHBondContact O-CG2 3.42Å; S238-V242 PolarHBondContact O-N 2.79Å; R239-V242 PolarHBondContact O-N 3.49Å; I240-V242 VanDerWaalsContact C-N 3.35Å; I240-V242 PolarHBondContact O-N 3.38Å; V242-S244 VanDerWaalsContact C-N 3.34Å; V242-S244 PolarHBondContact O-N 3.04Å; V242-L245 PolarHBondContact O-N 3.47Å
243Y82.9Confident80.6Confident45 Ų4537 Ų3718%0.17620%0.201CC..Hα-helixtrans-76.4-17.5-172.6-64.8-27.2000115.2T39 F40 K145 R239 L245 A246T39-Y243 HydrophobicContact CG2-CD1 4.12Å; T39-Y243 HydrophobicContact CG2-CE1 3.4Å; T39-Y243 VanDerWaalsContact CG2-CE1 3.4Å; T39-Y243 HydrophobicContact CG2-CE2 4.16Å; T39-Y243 VanDerWaalsContact CG2-CZ 3.45Å; T39-Y243 PolarHBondContact O-OH 2.86Å; F40-Y243 AromaticContact CE1-CE1 3.97Å; F40-Y243 HydrophobicContact CE1-CE1 3.97Å; F40-Y243 AromaticContact CZ-CE1 3.99Å; F40-Y243 HydrophobicContact CZ-CE1 3.99Å; K145-Y243 HydrophobicContact CD-CD1 4.05Å; K145-Y243 HydrophobicContact CD-CE1 3.92Å; K145-Y243 PolarHBondContact NZ-OH 3.28Å; K145-Y243 VanDerWaalsContact NZ-OH 3.1Å; R239-Y243 HydrophobicContact CB-CD2 4.15Å; R239-Y243 HydrophobicContact CB-CE2 4.28Å; R239-Y243 HydrophobicContact CG-CE2 4.26Å; R239-Y243 VanDerWaalsContact O-CB 3.27Å; R239-Y243 WeakPolarHBondContact O-CB 3.46Å; R239-Y243 PolarHBondContact O-N 3.37Å; Y243-L245 PolarHBondContact O-N 2.98Å; Y243-L245 VanDerWaalsContact O-N 3.13Å; Y243-A246 PolarHBondContact O-N 3.23Å
244S77Confident80.5Confident2 Ų243.3 Ų43.31%0.01423%0.228CC..G310 helixtrans-61.6-17.6173.847.90000114.5R133 N165 Q172 I240 Q241 V242 Q249R133-S244 PolarHBondContact NH2-OG 3.1Å; N165-S244 PolarHBondContact ND2-O 3.09Å; Q172-S244 PolarHBondContact OE1-OG 3.28Å; I240-S244 WeakPolarHBondContact O-CB 3.4Å; I240-S244 PolarHBondContact O-N 3.46Å; I240-S244 VanDerWaalsContact O-N 3.14Å; I240-S244 PolarHBondContact O-OG 3.46Å; Q241-S244 PolarHBondContact O-OG 2.94Å; Q241-S244 VanDerWaalsContact O-OG 3.06Å; V242-S244 VanDerWaalsContact C-N 3.34Å; V242-S244 PolarHBondContact O-N 3.04Å; S244-Q249 VanDerWaalsContact CB-NE2 3.26Å; S244-Q249 PolarHBondContact O-NE2 2.93Å
245L68.9Low80.5Confident19 Ų1943.9 Ų43.910%0.09923%0.232CC..G310 helixtrans-71.8-30.3171.5-168.379.1000112.3M137 M140 V146 T160 V242 Y243 G247M137-L245 HydrophobicContact CE-CD2 3.72Å; M140-L245 HydrophobicContact CE-CB 3.77Å; M140-L245 HydrophobicContact CE-CD2 3.6Å; M140-L245 HydrophobicContact CE-CG 4.3Å; M140-L245 HydrophobicContact SD-CD2 4.32Å; V146-L245 HydrophobicContact CG2-CD2 3.51Å; V146-L245 HydrophobicContact CG2-CG 4.49Å; T160-L245 HydrophobicContact CG2-CD1 3.67Å; V242-L245 PolarHBondContact O-N 3.47Å; Y243-L245 PolarHBondContact O-N 2.98Å; Y243-L245 VanDerWaalsContact O-N 3.13Å; L245-G247 PolarHBondContact O-N 2.9Å
246A65.2Low80.5Confident45 Ų4546.7 Ų46.737%0.37224%0.244SC..G310 helixtrans-85.818.9-179.600000112.4K145 Y243 R248K145-A246 HydrophobicContact CB-CB 4.09Å; K145-A246 HydrophobicContact CG-CB 4.49Å; Y243-A246 PolarHBondContact O-N 3.23Å; A246-R248 PolarHBondContact O-N 3.22Å
247G62.5Low80.5Confident55 Ų5552.4 Ų52.457%0.56727%0.272SS*.THydrogen-bonded Turntrans75-2.9-178.800000115.3L245 Q249L245-G247 PolarHBondContact O-N 2.9Å; G247-Q249 PolarHBondContact O-N 3.43Å
248R60.2Low80.4Confident164 Ų16453.6 Ų53.662%0.61929%0.285SS*.  trans-87.388.9-179-161.1167.1178.9148.7-0.9110.8A246 E250A246-R248 PolarHBondContact O-N 3.22Å; R248-E250 HydrophobicContact CG-CG 4.23Å; R248-E250 IonicContact CZ-OE1 3.34Å; R248-E250 IonicContact NE-OE1 3.21Å; R248-E250 PolarHBondContact NE-OE1 2.97Å; R248-E250 IonicContact NH2-OE1 2.79Å; R248-E250 PolarHBondContact NH2-OE1 3.33Å; R248-E250 PolarHBondContact O-N 3.3Å
249Q60.5Low80.5Confident109 Ų10953.5 Ų53.551%0.50928%0.284SS..  trans-88.880.5176-63.6-76.9-57.900110.1S244 G247S244-Q249 VanDerWaalsContact CB-NE2 3.26Å; S244-Q249 PolarHBondContact O-NE2 2.93Å; G247-Q249 PolarHBondContact O-N 3.43Å
250E69.8Low80.6Confident60 Ų6055.6 Ų55.628%0.2830%0.296SS..  trans-95.4133.1170.6-71.6-179.6-167.900110R248 K254 T255R248-E250 HydrophobicContact CG-CG 4.23Å; R248-E250 IonicContact CZ-OE1 3.34Å; R248-E250 IonicContact NE-OE1 3.21Å; R248-E250 PolarHBondContact NE-OE1 2.97Å; R248-E250 IonicContact NH2-OE1 2.79Å; R248-E250 PolarHBondContact NH2-OE1 3.33Å; R248-E250 PolarHBondContact O-N 3.3Å; E250-K254 HydrophobicContact CB-CB 4.25Å; E250-T255 WeakPolarHBondContact CB-OG1 3.45Å
251G80.3Confident80.7Confident45 Ų4565.2 Ų65.246%0.46433%0.331SS..  trans-70161.5173.800000111.8M253 K254 T255G251-M253 VanDerWaalsContact C-N 3.34Å; G251-M253 PolarHBondContact O-N 3.16Å; G251-M253 VanDerWaalsContact O-N 3.16Å; G251-K254 PolarHBondContact O-N 3.33Å; G251-T255 PolarHBondContact O-N 2.96Å; G251-T255 PolarHBondContact O-OG1 2.95Å
252F86.6Confident80.8Confident32 Ų3270.2 Ų70.214%0.1436%0.361CS..Hα-helixtrans-43.1-53.4-176.2179.9-93.6000113.9S176 V179 I233 V236 K254 T255 F256S176-F252 WeakPolarHBondContact OG-CD2 3.27Å; V179-F252 HydrophobicContact CG1-CZ 4.48Å; I233-F252 HydrophobicContact CB-CE2 4.42Å; I233-F252 HydrophobicContact CG1-CZ 4.22Å; I233-F252 HydrophobicContact CG2-CE2 3.81Å; I233-F252 HydrophobicContact CG2-CZ 4.19Å; V236-F252 HydrophobicContact CB-CD2 4.18Å; V236-F252 HydrophobicContact CB-CE2 3.85Å; V236-F252 HydrophobicContact CG1-CD2 3.44Å; V236-F252 VanDerWaalsContact CG1-CD2 3.44Å; V236-F252 HydrophobicContact CG1-CE2 3.63Å; V236-F252 HydrophobicContact CG1-CG 4.23Å; V236-F252 HydrophobicContact CG2-CE2 4.35Å; F252-K254 PolarHBondContact O-N 2.98Å; F252-T255 PolarHBondContact O-N 2.98Å; F252-F256 WeakPolarHBondContact O-CB 3.17Å; F252-F256 PolarHBondContact O-N 3.11Å
253M88.3Confident80.9Confident137 Ų13773.9 Ų73.968%0.67538%0.378SS*.Hα-helixtrans-65.8-36.6-176.8-71.2-60.616500113.4G251 M257G251-M253 VanDerWaalsContact C-N 3.34Å; G251-M253 PolarHBondContact O-N 3.16Å; G251-M253 VanDerWaalsContact O-N 3.16Å; M253-M257 WeakPolarHBondContact O-CB 3.27Å; M253-M257 PolarHBondContact O-N 3.42Å
254K88.8Confident81.3Confident157 Ų15773 Ų7368%0.68338%0.383SS*.Hα-helixtrans-67.4-45.5177.2-72.2-172.4179.2-1790110.7E250 G251 F252 G258E250-K254 HydrophobicContact CB-CB 4.25Å; G251-K254 PolarHBondContact O-N 3.33Å; F252-K254 PolarHBondContact O-N 2.98Å; K254-G258 PolarHBondContact O-N 2.95Å
255T88.4Confident81.9Confident14 Ų1478.6 Ų78.69%0.08641%0.407CS..Hα-helixtrans-64.8-44.6177.4-56.10000111.5V236 R239 I240 E250 G251 F252 G258 I259V236-T255 HydrophobicContact CG1-CG2 4Å; R239-T255 HydrophobicContact CB-CG2 4.2Å; I240-T255 HydrophobicContact CG1-CG2 4.13Å; E250-T255 WeakPolarHBondContact CB-OG1 3.45Å; G251-T255 PolarHBondContact O-N 2.96Å; G251-T255 PolarHBondContact O-OG1 2.95Å; F252-T255 PolarHBondContact O-N 2.98Å; T255-G258 PolarHBondContact O-N 3.36Å; T255-I259 HydrophobicContact CG2-CD1 4.21Å; T255-I259 VanDerWaalsContact O-CG1 3.27Å; T255-I259 WeakPolarHBondContact O-CG1 3.45Å; T255-I259 PolarHBondContact O-N 3.38Å
256F90.8Very high82.8Confident60 Ų6083.1 Ų83.126%0.26344%0.436SS..Hα-helixtrans-57.8-52.5177178.4-103000112.1V236 F252 G258 I259 I260 L268V236-F256 HydrophobicContact CG2-CB 3.92Å; V236-F256 HydrophobicContact CG2-CD2 3.85Å; V236-F256 HydrophobicContact CG2-CG 4.4Å; F252-F256 WeakPolarHBondContact O-CB 3.17Å; F252-F256 PolarHBondContact O-N 3.11Å; F256-G258 VanDerWaalsContact C-N 3.28Å; F256-G258 PolarHBondContact O-N 3.3Å; F256-I259 PolarHBondContact O-N 3.38Å; F256-I260 HydrophobicContact CD1-CD1 4.04Å; F256-I260 HydrophobicContact CE1-CD1 3.46Å; F256-I260 VanDerWaalsContact CE1-CD1 3.46Å; F256-I260 HydrophobicContact CE2-CD1 4.06Å; F256-I260 HydrophobicContact CZ-CD1 3.48Å; F256-I260 VanDerWaalsContact CZ-CD1 3.48Å; F256-I260 PolarHBondContact O-N 3.08Å; F256-L268 HydrophobicContact CD2-CD1 4.39Å; F256-L268 HydrophobicContact CD2-CD2 4.1Å; F256-L268 HydrophobicContact CE2-CD1 3.73Å; F256-L268 HydrophobicContact CE2-CD2 4.21Å; F256-L268 HydrophobicContact CZ-CD1 4.37Å
257M90.7Very high83.9Confident120 Ų12081.5 Ų81.559%0.59142%0.423SS*.Hα-helixtrans-66.4-33.7179.2-16364.4179.800112M253 R261M253-M257 WeakPolarHBondContact O-CB 3.27Å; M253-M257 PolarHBondContact O-N 3.42Å; M257-R261 WeakPolarHBondContact O-CB 3.34Å; M257-R261 PolarHBondContact O-N 2.89Å
258G89.6Confident85.2Confident27 Ų2778.9 Ų78.928%0.27840%0.396SS..Hα-helixtrans-57.1-53.2172.900000111.8K254 T255 F256 I260 R261 T262K254-G258 PolarHBondContact O-N 2.95Å; T255-G258 PolarHBondContact O-N 3.36Å; F256-G258 VanDerWaalsContact C-N 3.28Å; F256-G258 PolarHBondContact O-N 3.3Å; G258-I260 PolarHBondContact O-N 3.29Å; G258-R261 PolarHBondContact O-N 3.43Å; G258-T262 PolarHBondContact O-N 2.98Å; G258-T262 PolarHBondContact O-OG1 2.98Å
259I90.1Very high86.6Confident3 Ų374.4 Ų74.42%0.01538%0.379CS..Hα-helixtrans-57-49.8179.2-62.7163.6000110.8V236 T255 F256 R261 T262 E263 G264 A267 L268V236-I259 HydrophobicContact CG2-CD1 3.8Å; T255-I259 HydrophobicContact CG2-CD1 4.21Å; T255-I259 VanDerWaalsContact O-CG1 3.27Å; T255-I259 WeakPolarHBondContact O-CG1 3.45Å; T255-I259 PolarHBondContact O-N 3.38Å; F256-I259 PolarHBondContact O-N 3.38Å; I259-R261 VanDerWaalsContact C-N 3.28Å; I259-R261 PolarHBondContact O-N 3.21Å; I259-T262 PolarHBondContact O-N 2.92Å; I259-E263 WeakPolarHBondContact O-CA 3.48Å; I259-E263 WeakPolarHBondContact O-CB 3.33Å; I259-E263 PolarHBondContact O-N 3.45Å; I259-G264 PolarHBondContact O-N 3.49Å; I259-A267 HydrophobicContact CG2-CB 4.03Å; I259-L268 HydrophobicContact CB-CD2 4.29Å; I259-L268 HydrophobicContact CD1-CD2 3.96Å; I259-L268 HydrophobicContact CG2-CD2 3.89Å; I259-L268 HydrophobicContact CG2-CG 4.14Å
260I92.2Very high88Confident53 Ų5370.2 Ų70.227%0.27236%0.362SS..Hα-helixtrans-59.6-42.5-178.4-68.3176.4000110.9F256 G258 G264 L268F256-I260 HydrophobicContact CD1-CD1 4.04Å; F256-I260 HydrophobicContact CE1-CD1 3.46Å; F256-I260 VanDerWaalsContact CE1-CD1 3.46Å; F256-I260 HydrophobicContact CE2-CD1 4.06Å; F256-I260 HydrophobicContact CZ-CD1 3.48Å; F256-I260 VanDerWaalsContact CZ-CD1 3.48Å; F256-I260 PolarHBondContact O-N 3.08Å; G258-I260 PolarHBondContact O-N 3.29Å; I260-G264 VanDerWaalsContact O-CA 3.3Å; I260-G264 WeakPolarHBondContact O-CA 3.49Å; I260-G264 PolarHBondContact O-N 3.27Å; I260-L268 HydrophobicContact CD1-CD1 4.17Å; I260-L268 HydrophobicContact CG1-CD1 3.92Å
261R90.6Very high88.8Confident222 Ų22267.5 Ų67.584%0.83835%0.35SS*.Hα-helixtrans-73.5-35.6-177-171.5174.8179.8162.61113.2M257 G258 I259M257-R261 WeakPolarHBondContact O-CB 3.34Å; M257-R261 PolarHBondContact O-N 2.89Å; G258-R261 PolarHBondContact O-N 3.43Å; I259-R261 VanDerWaalsContact C-N 3.28Å; I259-R261 PolarHBondContact O-N 3.21Å
262T88.6Confident89.2Confident105 Ų10567 Ų6764%0.64434%0.336SS*.Hα-helixtrans-95.9-32.2-173.758.50000113.8G258 I259G258-T262 PolarHBondContact O-N 2.98Å; G258-T262 PolarHBondContact O-OG1 2.98Å; I259-T262 PolarHBondContact O-N 2.92Å
263E87.8Confident89.4Confident77 Ų7769.4 Ų69.436%0.3635%0.354SS..Hα-helixtrans-124.8-11.2-170.4-63.3170.3-147.400113.2P41 R239 I259 A267P41-E263 WeakPolarHBondContact CG-OE2 3.42Å; R239-E263 IonicContact CZ-OE1 2.93Å; R239-E263 IonicContact CZ-OE2 3.63Å; R239-E263 VanDerWaalsContact CZ-OE2 3.3Å; R239-E263 VanDerWaalsContact NH1-CD 3.26Å; R239-E263 IonicContact NH1-OE1 2.66Å; R239-E263 PolarHBondContact NH1-OE1 3.27Å; R239-E263 IonicContact NH1-OE2 2.69Å; R239-E263 PolarHBondContact NH1-OE2 3.03Å; R239-E263 VanDerWaalsContact NH1-OE2 3.12Å; R239-E263 IonicContact NH2-OE1 3.85Å; R239-E263 IonicContact NH2-OE2 3.69Å; R239-E263 PolarHBondContact NH2-OE2 3.43Å; I259-E263 WeakPolarHBondContact O-CA 3.48Å; I259-E263 WeakPolarHBondContact O-CB 3.33Å; I259-E263 PolarHBondContact O-N 3.45Å; E263-A267 HydrophobicContact CB-CB 3.64Å
264G89.6Confident89.5Confident26 Ų2662.9 Ų62.927%0.26832%0.322SS..  trans86.9170.118000000113.8I259 I260 T266 A267I259-G264 PolarHBondContact O-N 3.49Å; I260-G264 VanDerWaalsContact O-CA 3.3Å; I260-G264 WeakPolarHBondContact O-CA 3.49Å; I260-G264 PolarHBondContact O-N 3.27Å; G264-T266 PolarHBondContact O-N 2.68Å; G264-A267 WeakPolarHBondContact O-CB 3.48Å; G264-A267 PolarHBondContact O-N 3.16Å
265F89.4Confident89.5Confident120 Ų12055.7 Ų55.753%0.52629%0.291SS..G310 helixtrans-66.7-35.4-175.6-175.7-98.6000113.1A267 L268 Y269F265-A267 PolarHBondContact O-N 2.82Å; F265-L268 HydrophobicContact CD2-CD1 3.86Å; F265-L268 HydrophobicContact CE2-CD1 4.04Å; F265-L268 VanDerWaalsContact O-CB 3.3Å; F265-L268 WeakPolarHBondContact O-CB 3.24Å; F265-L268 PolarHBondContact O-N 3.32Å; F265-L268 VanDerWaalsContact O-N 3.15Å; F265-Y269 HydrophobicContact CD1-CE2 4.47Å; F265-Y269 HydrophobicContact CE1-CD2 4.44Å; F265-Y269 AromaticContact CE1-CE2 3.73Å; F265-Y269 HydrophobicContact CE1-CE2 3.73Å; F265-Y269 HydrophobicContact CZ-CE2 4.02Å
266T88.3Confident89.5Confident115 Ų11558.3 Ų58.371%0.70630%0.303SS*.G310 helixtrans-65.7-24.2-179.352.50000112.9G264 L268 Y269G264-T266 PolarHBondContact O-N 2.68Å; T266-L268 PolarHBondContact O-N 3.3Å; T266-Y269 PolarHBondContact O-N 2.9Å
267A88Confident89.5Confident11 Ų1158.7 Ų58.79%0.09131%0.307CS..G310 helixtrans-63-26.3175.600000112.7I259 E263 G264 F265 Y269 S270I259-A267 HydrophobicContact CG2-CB 4.03Å; E263-A267 HydrophobicContact CB-CB 3.64Å; G264-A267 WeakPolarHBondContact O-CB 3.48Å; G264-A267 PolarHBondContact O-N 3.16Å; F265-A267 PolarHBondContact O-N 2.82Å; A267-Y269 PolarHBondContact O-N 3.39Å; A267-S270 VanDerWaalsContact O-CB 3.29Å; A267-S270 WeakPolarHBondContact O-CB 3.35Å; A267-S270 PolarHBondContact O-N 3.39Å; A267-S270 VanDerWaalsContact O-N 3.15Å
268L90.2Very high89.5Confident0 Ų055.4 Ų55.40%029%0.288CS..G310 helixtrans-62.8-23.1174.1-67.5167.1000112.3Y231 P232 C235 V236 F256 I259 I260 F265 T266Y231-L268 WeakPolarHBondContact CD1-O 3.4Å; P232-L268 HydrophobicContact CB-CB 4.06Å; P232-L268 HydrophobicContact CB-CD1 4.24Å; P232-L268 HydrophobicContact CB-CD2 4.39Å; P232-L268 HydrophobicContact CB-CG 4.46Å; P232-L268 HydrophobicContact CG-CB 4.4Å; C235-L268 VanDerWaalsContact CB-O 3.24Å; C235-L268 WeakPolarHBondContact CB-O 3.34Å; V236-L268 HydrophobicContact CG2-CD2 4.21Å; F256-L268 HydrophobicContact CD2-CD1 4.39Å; F256-L268 HydrophobicContact CD2-CD2 4.1Å; F256-L268 HydrophobicContact CE2-CD1 3.73Å; F256-L268 HydrophobicContact CE2-CD2 4.21Å; F256-L268 HydrophobicContact CZ-CD1 4.37Å; I259-L268 HydrophobicContact CB-CD2 4.29Å; I259-L268 HydrophobicContact CD1-CD2 3.96Å; I259-L268 HydrophobicContact CG2-CD2 3.89Å; I259-L268 HydrophobicContact CG2-CG 4.14Å; I260-L268 HydrophobicContact CD1-CD1 4.17Å; I260-L268 HydrophobicContact CG1-CD1 3.92Å; F265-L268 HydrophobicContact CD2-CD1 3.86Å; F265-L268 HydrophobicContact CE2-CD1 4.04Å; F265-L268 VanDerWaalsContact O-CB 3.3Å; F265-L268 WeakPolarHBondContact O-CB 3.24Å; F265-L268 PolarHBondContact O-N 3.32Å; F265-L268 VanDerWaalsContact O-N 3.15Å; T266-L268 PolarHBondContact O-N 3.3Å
269Y90.9Very high89.4Confident70 Ų7056.6 Ų56.628%0.27529%0.29SS..G310 helixtrans-98.17.1178.9-69-87.7000114.1L228 Y231 P232 F265 T266 A267 G271 L272L228-Y269 WeakPolarHBondContact O-CE1 3.33Å; L228-Y269 PolarHBondContact O-OH 2.84Å; Y231-Y269 HydrophobicContact CD1-CD1 4.18Å; Y231-Y269 HydrophobicContact CG-CD1 4.27Å; P232-Y269 HydrophobicContact CG-CE1 4.34Å; P232-Y269 HydrophobicContact CG-CE2 3.97Å; F265-Y269 HydrophobicContact CD1-CE2 4.47Å; F265-Y269 HydrophobicContact CE1-CD2 4.44Å; F265-Y269 AromaticContact CE1-CE2 3.73Å; F265-Y269 HydrophobicContact CE1-CE2 3.73Å; F265-Y269 HydrophobicContact CZ-CE2 4.02Å; T266-Y269 PolarHBondContact O-N 2.9Å; A267-Y269 PolarHBondContact O-N 3.39Å; Y269-G271 PolarHBondContact O-N 3.07Å; Y269-L272 HydrophobicContact CD1-CD2 4.29Å; Y269-L272 WeakPolarHBondContact O-CB 3.47Å; Y269-L272 PolarHBondContact O-N 3.44Å; Y269-L272 VanDerWaalsContact O-N 3.14Å
270S88.1Confident89.3Confident21 Ų2164.7 Ų64.715%0.14733%0.325CS..THydrogen-bonded Turntrans-61.4120176.7-174.90000110.8M37 Q38 Y231 A267M37-S270 PolarHBondContact O-OG 3.47Å; Q38-S270 WeakPolarHBondContact CG-O 3.5Å; Y231-S270 WeakPolarHBondContact CE1-O 3.47Å; Y231-S270 PolarHBondContact OH-O 2.96Å; A267-S270 VanDerWaalsContact O-CB 3.29Å; A267-S270 WeakPolarHBondContact O-CB 3.35Å; A267-S270 PolarHBondContact O-N 3.39Å; A267-S270 VanDerWaalsContact O-N 3.15Å
271G87.4Confident89.3Confident3 Ų364.6 Ų64.63%0.03133%0.328CS..THydrogen-bonded Turntrans98.70.9-177.900000115Y231 Y269 T273 P274 T275Y231-G271 VanDerWaalsContact CZ-C 3.43Å; Y231-G271 WeakPolarHBondContact OH-CA 3.4Å; Y231-G271 PolarHBondContact OH-O 3.15Å; Y269-G271 PolarHBondContact O-N 3.07Å; G271-T273 PolarHBondContact O-N 3.32Å; G271-P274 VanDerWaalsContact C-CD 3.44Å; G271-P274 WeakPolarHBondContact O-CD 3.2Å; G271-P274 WeakPolarHBondContact O-CG 3.49Å; G271-T275 PolarHBondContact O-N 2.99Å; G271-T275 PolarHBondContact O-OG1 3.43Å
272L88.9Confident89.2Confident33 Ų3354.1 Ų54.117%0.17329%0.289CS..Hα-helixtrans-60-40.4176.9-179.863.8000110.7L228 Y231 Y269 T275 M276L228-L272 HydrophobicContact CD2-CD2 4.14Å; Y231-L272 HydrophobicContact CD2-CB 4.34Å; Y231-L272 HydrophobicContact CD2-CD1 3.57Å; Y231-L272 HydrophobicContact CE1-CB 4.26Å; Y231-L272 HydrophobicContact CE2-CB 4.09Å; Y231-L272 HydrophobicContact CE2-CD1 3.84Å; Y231-L272 HydrophobicContact CG-CD1 4.18Å; Y231-L272 VanDerWaalsContact CZ-N 3.27Å; Y231-L272 PolarHBondContact OH-N 2.95Å; Y231-L272 VanDerWaalsContact OH-N 3.11Å; Y269-L272 HydrophobicContact CD1-CD2 4.29Å; Y269-L272 WeakPolarHBondContact O-CB 3.47Å; Y269-L272 PolarHBondContact O-N 3.44Å; Y269-L272 VanDerWaalsContact O-N 3.14Å; L272-T275 WeakPolarHBondContact O-CA 3.29Å; L272-T275 WeakPolarHBondContact O-CB 3.18Å; L272-T275 PolarHBondContact O-N 2.85Å; L272-T275 VanDerWaalsContact O-N 3.12Å; L272-M276 HydrophobicContact CD1-CE 4.47Å; L272-M276 HydrophobicContact CD1-CG 4.22Å; L272-M276 HydrophobicContact CG-CG 4.29Å; L272-M276 WeakPolarHBondContact O-CG 3.48Å; L272-M276 PolarHBondContact O-N 2.89Å
273T89.9Confident89.3Confident84 Ų8452.4 Ų52.452%0.51528%0.276SS..Hα-helixtrans-56.1-55.9176.7-50.20000113.4F47 G271 T275 M276 I277F47-T273 HydrophobicContact CB-CG2 4.46Å; G271-T273 PolarHBondContact O-N 3.32Å; T273-T275 PolarHBondContact O-N 3.35Å; T273-M276 PolarHBondContact O-N 2.78Å; T273-I277 HydrophobicContact CG2-CD1 3.81Å; T273-I277 HydrophobicContact CG2-CG1 4.47Å; T273-I277 WeakPolarHBondContact O-CG1 3.33Å; T273-I277 PolarHBondContact O-N 3.41Å
274P90.4Very high89.3Confident0 Ų050.2 Ų50.20%027%0.274CS..Hα-helixtrans-59.1-33.2175.312.6-22.9000112.7F30 I33 K34 M37 F47 G271 R278F30-P274 HydrophobicContact CB-CB 4.5Å; I33-P274 HydrophobicContact CG2-CG 4.42Å; K34-P274 HydrophobicContact CB-CG 4.3Å; M37-P274 HydrophobicContact SD-CG 4.15Å; F47-P274 HydrophobicContact CD2-CB 3.58Å; F47-P274 HydrophobicContact CD2-CG 3.88Å; F47-P274 HydrophobicContact CE2-CB 3.76Å; G271-P274 VanDerWaalsContact C-CD 3.44Å; G271-P274 WeakPolarHBondContact O-CD 3.2Å; G271-P274 WeakPolarHBondContact O-CG 3.49Å; P274-R278 WeakPolarHBondContact O-CB 3.39Å; P274-R278 PolarHBondContact O-N 2.84Å
275T89.1Confident89.5Confident6 Ų650 Ų504%0.03727%0.27CS..Hα-helixtrans-65.9-44.2177.9-49.50000111.5K34 W227 Y231 G271 L272 T273 R278 T279K34-T275 WeakPolarHBondContact CD-OG1 3.13Å; W227-T275 HydrophobicContact CD2-CG2 4.04Å; W227-T275 HydrophobicContact CE3-CG2 4.02Å; W227-T275 HydrophobicContact CH2-CG2 4.09Å; W227-T275 HydrophobicContact CZ2-CG2 4.1Å; W227-T275 HydrophobicContact CZ3-CG2 4.05Å; Y231-T275 HydrophobicContact CE2-CG2 4.38Å; Y231-T275 PolarHBondContact OH-OG1 3.43Å; G271-T275 PolarHBondContact O-N 2.99Å; G271-T275 PolarHBondContact O-OG1 3.43Å; L272-T275 WeakPolarHBondContact O-CA 3.29Å; L272-T275 WeakPolarHBondContact O-CB 3.18Å; L272-T275 PolarHBondContact O-N 2.85Å; L272-T275 VanDerWaalsContact O-N 3.12Å; T273-T275 PolarHBondContact O-N 3.35Å; T275-R278 WeakPolarHBondContact O-CB 3.29Å; T275-R278 PolarHBondContact O-N 2.86Å; T275-T279 PolarHBondContact O-OG1 3.37Å
276M88Confident89.6Confident69 Ų6946.8 Ų46.834%0.3426%0.258SS..Hα-helixtrans-67.4-43176.8-69.2-60.4-143.800112A224 L272 T273 R278 T279A224-M276 HydrophobicContact CB-CE 4.39Å; L272-M276 HydrophobicContact CD1-CE 4.47Å; L272-M276 HydrophobicContact CD1-CG 4.22Å; L272-M276 HydrophobicContact CG-CG 4.29Å; L272-M276 WeakPolarHBondContact O-CG 3.48Å; L272-M276 PolarHBondContact O-N 2.89Å; T273-M276 PolarHBondContact O-N 2.78Å; M276-R278 VanDerWaalsContact C-N 3.32Å; M276-R278 PolarHBondContact O-N 2.96Å; M276-T279 PolarHBondContact O-N 2.94Å
277I91.3Very high89.7Confident67 Ų6747 Ų4734%0.34425%0.25SC..Hα-helixtrans-63.8-40.7178.2-64.7170.3000110.3F30 F47 T273 T279 P281F30-I277 HydrophobicContact CD1-CB 4.4Å; F30-I277 HydrophobicContact CD1-CG2 4.11Å; F30-I277 HydrophobicContact CE1-CB 4.2Å; F30-I277 HydrophobicContact CE1-CG2 3.44Å; F30-I277 VanDerWaalsContact CE1-CG2 3.44Å; F30-I277 HydrophobicContact CZ-CG2 3.97Å; F47-I277 HydrophobicContact CD1-CD1 4Å; F47-I277 HydrophobicContact CE1-CD1 3.77Å; F47-I277 HydrophobicContact CZ-CD1 4.41Å; T273-I277 HydrophobicContact CG2-CD1 3.81Å; T273-I277 HydrophobicContact CG2-CG1 4.47Å; T273-I277 WeakPolarHBondContact O-CG1 3.33Å; T273-I277 PolarHBondContact O-N 3.41Å; I277-T279 VanDerWaalsContact C-N 3.25Å; I277-T279 PolarHBondContact O-N 3.42Å; I277-P281 WeakPolarHBondContact O-CD 3.14Å
278R91.2Very high89.9Confident52 Ų5251.3 Ų51.320%0.19627%0.27CS..Hα-helixtrans-54.2-38.2178.5178.5-167.8153.8101.9-10.6113.2G27 F30 D31 P274 T275 M276 F280 P281 A282G27-R278 VanDerWaalsContact CA-NH1 3.35Å; G27-R278 PolarHBondContact O-NH1 3.04Å; F30-R278 HydrophobicContact CB-CB 3.59Å; F30-R278 HydrophobicContact CB-CG 3.96Å; F30-R278 HydrophobicContact CD2-CB 4.09Å; F30-R278 HydrophobicContact CD2-CG 4.27Å; F30-R278 HydrophobicContact CG-CB 3.85Å; F30-R278 HydrophobicContact CG-CG 4.37Å; D31-R278 WeakPolarHBondContact OD1-CD 3.28Å; D31-R278 IonicContact OD1-CZ 3.12Å; D31-R278 IonicContact OD1-NE 2.59Å; D31-R278 PolarHBondContact OD1-NE 2.68Å; D31-R278 IonicContact OD1-NH1 2.71Å; D31-R278 PolarHBondContact OD1-NH1 3.05Å; D31-R278 IonicContact OD2-CZ 3.3Å; D31-R278 IonicContact OD2-NH1 3.62Å; D31-R278 PolarHBondContact OD2-NH1 2.93Å; D31-R278 IonicContact OD2-NH2 3.92Å; P274-R278 WeakPolarHBondContact O-CB 3.39Å; P274-R278 PolarHBondContact O-N 2.84Å; T275-R278 WeakPolarHBondContact O-CB 3.29Å; T275-R278 PolarHBondContact O-N 2.86Å; M276-R278 VanDerWaalsContact C-N 3.32Å; M276-R278 PolarHBondContact O-N 2.96Å; R278-F280 VanDerWaalsContact C-N 3.25Å; R278-F280 PolarHBondContact O-N 3.48Å; R278-P281 WeakPolarHBondContact O-CD 3.42Å; R278-P281 WeakPolarHBondContact O-CG 3.34Å; R278-A282 HydrophobicContact CG-CB 4.17Å; R278-A282 WeakPolarHBondContact O-CB 3.12Å; R278-A282 PolarHBondContact O-N 3.49Å
279T86.6Confident90.1Very high52 Ų5252.4 Ų52.432%0.31928%0.28SS..Hα-helixtrans-55.9-40.9-171.8-54.80000112.1T275 M276 I277 N283T275-T279 PolarHBondContact O-OG1 3.37Å; M276-T279 PolarHBondContact O-N 2.94Å; I277-T279 VanDerWaalsContact C-N 3.25Å; I277-T279 PolarHBondContact O-N 3.42Å; T279-N283 WeakPolarHBondContact CG2-ND2 3.37Å; T279-N283 WeakPolarHBondContact O-CB 3.38Å; T279-N283 PolarHBondContact O-N 2.68Å; T279-N283 VanDerWaalsContact O-N 3.07Å; T279-N283 PolarHBondContact O-ND2 2.87Å
280F88.7Confident90.1Very high172 Ų17252.7 Ų52.775%0.75428%0.281SS*.Hα-helixtrans-67.4-58.9-179.6-67.2-84.7000114.1R278 A282 G284R278-F280 VanDerWaalsContact C-N 3.25Å; R278-F280 PolarHBondContact O-N 3.48Å; F280-A282 VanDerWaalsContact C-N 3.35Å; F280-A282 PolarHBondContact O-N 2.86Å; F280-G284 PolarHBondContact O-N 3.43Å
281P91.6Very high90.2Very high51 Ų5157.3 Ų57.333%0.33130%0.3SS..Hα-helixtrans-65.3-36.5179.426.3-33.7000112.4S26 F30 I277 R278 A285S26-P281 PolarHBondContact OG-O 2.7Å; F30-P281 HydrophobicContact CD2-CG 4.4Å; F30-P281 HydrophobicContact CE2-CG 3.63Å; F30-P281 HydrophobicContact CZ-CG 4.05Å; I277-P281 WeakPolarHBondContact O-CD 3.14Å; R278-P281 WeakPolarHBondContact O-CD 3.42Å; R278-P281 WeakPolarHBondContact O-CG 3.34Å; P281-A285 WeakPolarHBondContact O-CB 3.49Å; P281-A285 PolarHBondContact O-N 2.85Å
282A89.9Confident90.5Very high2 Ų264.1 Ų64.12%0.01733%0.329CS..Hα-helixtrans-65.8-50.4179.400000111.9S26 R278 F280 A285 L286S26-A282 WeakPolarHBondContact OG-CA 3.37Å; R278-A282 HydrophobicContact CG-CB 4.17Å; R278-A282 WeakPolarHBondContact O-CB 3.12Å; R278-A282 PolarHBondContact O-N 3.49Å; F280-A282 VanDerWaalsContact C-N 3.35Å; F280-A282 PolarHBondContact O-N 2.86Å; A282-A285 PolarHBondContact O-N 3.28Å; A282-L286 WeakPolarHBondContact O-CB 3.29Å; A282-L286 PolarHBondContact O-N 2.96Å
283N89.1Confident90.7Very high70 Ų7064.2 Ų64.237%0.37433%0.333SS..Hα-helixtrans-70.1-37.9178.7-65.6-16000111.5T279 A285 L286 F287T279-N283 WeakPolarHBondContact CG2-ND2 3.37Å; T279-N283 WeakPolarHBondContact O-CB 3.38Å; T279-N283 PolarHBondContact O-N 2.68Å; T279-N283 VanDerWaalsContact O-N 3.07Å; T279-N283 PolarHBondContact O-ND2 2.87Å; N283-A285 PolarHBondContact O-N 3.24Å; N283-L286 WeakPolarHBondContact O-CB 3.34Å; N283-L286 PolarHBondContact O-N 2.89Å; N283-F287 HydrophobicContact CB-CE2 4.46Å; N283-F287 WeakPolarHBondContact O-CD2 3.03Å; N283-F287 PolarHBondContact O-N 3.41Å
284G89.8Confident90.7Very high30 Ų3064.7 Ų64.731%0.30933%0.325SS..Hα-helixtrans-59.1-47.4174.400000111.7F280 L286 F287 L288F280-G284 PolarHBondContact O-N 3.43Å; G284-L286 VanDerWaalsContact C-N 3.34Å; G284-L286 PolarHBondContact O-N 3.5Å; G284-F287 PolarHBondContact O-N 2.93Å; G284-L288 VanDerWaalsContact O-CB 3.29Å; G284-L288 WeakPolarHBondContact O-CB 3.27Å; G284-L288 WeakPolarHBondContact O-CD1 3.24Å; G284-L288 WeakPolarHBondContact O-CG 3.47Å; G284-L288 PolarHBondContact O-N 2.96Å
285A92.9Very high90.7Very high23 Ų2371 Ų7119%0.1935%0.353CS..Hα-helixtrans-63.9-38.3176.500000112.5A22 S26 P281 A282 N283 A289A22-A285 HydrophobicContact CB-CB 4.17Å; S26-A285 VanDerWaalsContact OG-CB 3.31Å; S26-A285 WeakPolarHBondContact OG-CB 3.31Å; P281-A285 WeakPolarHBondContact O-CB 3.49Å; P281-A285 PolarHBondContact O-N 2.85Å; A282-A285 PolarHBondContact O-N 3.28Å; N283-A285 PolarHBondContact O-N 3.24Å; A285-A289 WeakPolarHBondContact O-CB 3.38Å; A285-A289 PolarHBondContact O-N 2.88Å
286L92.1Very high90.9Very high52 Ų5277.6 Ų77.627%0.27238%0.381SS..Hα-helixtrans-56-57.8174.5176.764.5000111.2G19 C23 A282 N283 G284 Y290G19-L286 WeakPolarHBondContact O-CD1 3.16Å; C23-L286 HydrophobicContact CB-CB 3.94Å; C23-L286 HydrophobicContact CB-CD1 4.17Å; A282-L286 WeakPolarHBondContact O-CB 3.29Å; A282-L286 PolarHBondContact O-N 2.96Å; N283-L286 WeakPolarHBondContact O-CB 3.34Å; N283-L286 PolarHBondContact O-N 2.89Å; G284-L286 VanDerWaalsContact C-N 3.34Å; G284-L286 PolarHBondContact O-N 3.5Å; L286-Y290 VanDerWaalsContact O-CB 3.24Å; L286-Y290 WeakPolarHBondContact O-CB 3.46Å; L286-Y290 PolarHBondContact O-N 3.02Å
287F90.4Very high91Very high120 Ų12076.3 Ų76.353%0.52638%0.375SS..Hα-helixtrans-66.7-44.8-175.8-73.4-64.1000111.7N283 G284 A289 Y290 E291N283-F287 HydrophobicContact CB-CE2 4.46Å; N283-F287 WeakPolarHBondContact O-CD2 3.03Å; N283-F287 PolarHBondContact O-N 3.41Å; G284-F287 PolarHBondContact O-N 2.93Å; F287-A289 PolarHBondContact O-N 2.89Å; F287-Y290 PolarHBondContact O-N 2.88Å; F287-E291 WeakPolarHBondContact O-CB 3.46Å; F287-E291 WeakPolarHBondContact O-CG 3.21Å; F287-E291 PolarHBondContact O-N 2.77Å
288L92.1Very high90.9Very high100 Ų10074.4 Ų74.452%0.52437%0.365SS..Hα-helixtrans-58.7-51.9177-72.1170.6000111.1G284 Y290 E291 F292G284-L288 VanDerWaalsContact O-CB 3.29Å; G284-L288 WeakPolarHBondContact O-CB 3.27Å; G284-L288 WeakPolarHBondContact O-CD1 3.24Å; G284-L288 WeakPolarHBondContact O-CG 3.47Å; G284-L288 PolarHBondContact O-N 2.96Å; L288-Y290 VanDerWaalsContact C-N 3.33Å; L288-Y290 PolarHBondContact O-N 3.26Å; L288-E291 PolarHBondContact O-N 3.21Å; L288-F292 HydrophobicContact CD2-CD2 4.44Å; L288-F292 HydrophobicContact CD2-CE2 4.07Å; L288-F292 WeakPolarHBondContact O-CB 3.23Å; L288-F292 VanDerWaalsContact O-CD2 3.29Å; L288-F292 WeakPolarHBondContact O-CD2 3.36Å; L288-F292 PolarHBondContact O-N 2.9Å
289A93.7Very high90.7Very high24 Ų2476.7 Ų76.720%0.19838%0.381CS..Hα-helixtrans-64.5-39.3-178.700000111.9A22 A285 F287 S293A22-A289 HydrophobicContact CB-CB 3.5Å; A285-A289 WeakPolarHBondContact O-CB 3.38Å; A285-A289 PolarHBondContact O-N 2.88Å; F287-A289 PolarHBondContact O-N 2.89Å; A289-S293 WeakPolarHBondContact O-CB 3.44Å; A289-S293 PolarHBondContact O-N 3.43Å; A289-S293 PolarHBondContact O-OG 3.36Å
290Y91.9Very high90.7Very high75 Ų7579 Ų7929%0.29440%0.395SS..Hα-helixtrans-61.1-54.4174.9176.8-95.7000111.8A15 L286 F287 L288 S293 R294A15-Y290 HydrophobicContact CB-CD2 3.72Å; A15-Y290 HydrophobicContact CB-CE2 3.83Å; A15-Y290 HydrophobicContact CB-CG 4.46Å; L286-Y290 VanDerWaalsContact O-CB 3.24Å; L286-Y290 WeakPolarHBondContact O-CB 3.46Å; L286-Y290 PolarHBondContact O-N 3.02Å; F287-Y290 PolarHBondContact O-N 2.88Å; L288-Y290 VanDerWaalsContact C-N 3.33Å; L288-Y290 PolarHBondContact O-N 3.26Å; Y290-S293 PolarHBondContact O-N 3.42Å; Y290-R294 WeakPolarHBondContact O-CB 3.24Å; Y290-R294 PolarHBondContact O-N 2.92Å; Y290-R294 WeakPolarHBondContact OH-CD 3.34Å
291E90.2Very high90.4Very high118 Ų11874.3 Ų74.355%0.55138%0.38SS*.Hα-helixtrans-64.6-46.4-176.2-73-178.3-175.900112.2F287 L288 R294 K295F287-E291 WeakPolarHBondContact O-CB 3.46Å; F287-E291 WeakPolarHBondContact O-CG 3.21Å; F287-E291 PolarHBondContact O-N 2.77Å; L288-E291 PolarHBondContact O-N 3.21Å; E291-R294 PolarHBondContact O-N 3Å; E291-K295 VanDerWaalsContact O-CB 3.23Å; E291-K295 WeakPolarHBondContact O-CB 3.47Å; E291-K295 PolarHBondContact O-N 3.41Å
292F93.1Very high89.1Confident146 Ų14675.2 Ų75.264%0.6440%0.399SS*.Hα-helixtrans-63.9-43.6178.3-87.9-79.5000111.8L288 F296L288-F292 HydrophobicContact CD2-CD2 4.44Å; L288-F292 HydrophobicContact CD2-CE2 4.07Å; L288-F292 WeakPolarHBondContact O-CB 3.23Å; L288-F292 VanDerWaalsContact O-CD2 3.29Å; L288-F292 WeakPolarHBondContact O-CD2 3.36Å; L288-F292 PolarHBondContact O-N 2.9Å; F292-F296 VanDerWaalsContact O-CB 3.24Å; F292-F296 WeakPolarHBondContact O-CB 3.33Å; F292-F296 PolarHBondContact O-N 3.19Å
293S91.9Very high87.5Confident36 Ų3678.7 Ų78.725%0.25243%0.427SS..Hα-helixtrans-67.7-43.5-179.3-62.20000111A289 Y290 M297A289-S293 WeakPolarHBondContact O-CB 3.44Å; A289-S293 PolarHBondContact O-N 3.43Å; A289-S293 PolarHBondContact O-OG 3.36Å; Y290-S293 PolarHBondContact O-N 3.42Å; S293-M297 WeakPolarHBondContact O-CB 3.44Å; S293-M297 WeakPolarHBondContact O-CE 3.44Å; S293-M297 WeakPolarHBondContact O-CG 3.14Å; S293-M297 PolarHBondContact O-N 2.95Å
294R90.8Very high87.4Confident93 Ų9379.2 Ų79.235%0.35143%0.43SS..Hα-helixtrans-61.7-47.9176-176.8168.3175.8-90.1-3.4111.6I11 D12 A15 Y290 E291 M297 M298I11-R294 HydrophobicContact CG2-CG 4.03Å; D12-R294 WeakPolarHBondContact OD1-CD 3.1Å; D12-R294 IonicContact OD1-CZ 3.98Å; D12-R294 IonicContact OD1-NE 2.89Å; D12-R294 PolarHBondContact OD1-NE 3.46Å; A15-R294 HydrophobicContact CB-CB 3.78Å; Y290-R294 WeakPolarHBondContact O-CB 3.24Å; Y290-R294 PolarHBondContact O-N 2.92Å; Y290-R294 WeakPolarHBondContact OH-CD 3.34Å; E291-R294 PolarHBondContact O-N 3Å; R294-M297 PolarHBondContact O-N 3.34Å; R294-M298 WeakPolarHBondContact O-CB 3.35Å; R294-M298 VanDerWaalsContact O-CG 3.24Å; R294-M298 WeakPolarHBondContact O-CG 3.27Å; R294-M298 PolarHBondContact O-N 3.42Å
295K91Very high87.3Confident134 Ų13481.7 Ų81.758%0.58344%0.436SS*.Hα-helixtrans-60.5-50.2178.1-175.5177179.3-1800111.4E291 M297 M298 D299E291-K295 VanDerWaalsContact O-CB 3.23Å; E291-K295 WeakPolarHBondContact O-CB 3.47Å; E291-K295 PolarHBondContact O-N 3.41Å; K295-M297 VanDerWaalsContact C-N 3.32Å; K295-M297 PolarHBondContact O-N 2.7Å; K295-M298 PolarHBondContact O-N 2.8Å; K295-D299 PolarHBondContact O-N 3.22Å
296F92.3Very high87Confident143 Ų14385 Ų8563%0.62745%0.45SS*.Hα-helixtrans-57.2-44.4178.7179-98.6000112.3F292 T300F292-F296 VanDerWaalsContact O-CB 3.24Å; F292-F296 WeakPolarHBondContact O-CB 3.33Å; F292-F296 PolarHBondContact O-N 3.19Å; F296-T300 WeakPolarHBondContact O-CB 3.45Å; F296-T300 PolarHBondContact O-N 3Å; F296-T300 PolarHBondContact O-OG1 3.08Å
297M91.2Very high86.7Confident43 Ų4386.9 Ų86.921%0.21246%0.461CS..Hα-helixtrans-69.3-36.8178.1-72.4-177.1-78.600113.2I11 A15 S293 R294 K295 T300 V301I11-M297 HydrophobicContact CD1-CB 4.38Å; I11-M297 HydrophobicContact CG1-CB 4.02Å; I11-M297 HydrophobicContact CG2-CB 3.91Å; I11-M297 HydrophobicContact CG2-CE 4.08Å; I11-M297 HydrophobicContact CG2-SD 4.48Å; I11-M297 WeakPolarHBondContact O-CE 3.42Å; A15-M297 HydrophobicContact CB-CE 3.85Å; S293-M297 WeakPolarHBondContact O-CB 3.44Å; S293-M297 WeakPolarHBondContact O-CE 3.44Å; S293-M297 WeakPolarHBondContact O-CG 3.14Å; S293-M297 PolarHBondContact O-N 2.95Å; R294-M297 PolarHBondContact O-N 3.34Å; K295-M297 VanDerWaalsContact C-N 3.32Å; K295-M297 PolarHBondContact O-N 2.7Å; M297-T300 PolarHBondContact O-N 3.01Å; M297-V301 WeakPolarHBondContact O-CG2 3.33Å; M297-V301 PolarHBondContact O-N 3.43Å; M297-V301 VanDerWaalsContact O-N 3.12Å
298M87.9Confident86.4Confident27 Ų2784.9 Ų84.913%0.13346%0.456CS..Hα-helixtrans-63.1-47.8173.9-72.5-70-178.100111.1P3 Q8 I11 R294 K295 T300 V301 G302 A303P3-M298 HydrophobicContact CG-CE 4.29Å; P3-M298 HydrophobicContact CG-SD 3.83Å; Q8-M298 HydrophobicContact CG-CE 4.12Å; I11-M298 HydrophobicContact CB-CE 4.35Å; I11-M298 HydrophobicContact CD1-CE 3.95Å; I11-M298 HydrophobicContact CD1-CG 4.32Å; I11-M298 HydrophobicContact CD1-SD 3.67Å; I11-M298 HydrophobicContact CG2-CE 3.97Å; I11-M298 HydrophobicContact CG2-CG 4.32Å; R294-M298 WeakPolarHBondContact O-CB 3.35Å; R294-M298 VanDerWaalsContact O-CG 3.24Å; R294-M298 WeakPolarHBondContact O-CG 3.27Å; R294-M298 PolarHBondContact O-N 3.42Å; K295-M298 PolarHBondContact O-N 2.8Å; M298-T300 VanDerWaalsContact C-N 3.26Å; M298-T300 PolarHBondContact O-N 3.2Å; M298-V301 PolarHBondContact O-N 3.35Å; M298-V301 VanDerWaalsContact O-N 3.12Å; M298-G302 PolarHBondContact O-N 3.12Å; M298-A303 PolarHBondContact O-N 3.39Å; M298-A303 HydrophobicContact SD-CB 4.36Å
299D88.1Confident86.1Confident100 Ų10083.9 Ų83.954%0.53545%0.452SS..Hα-helixtrans-58.5-39.5176.5-64.2-16.6000111K295 V301 G302K295-D299 PolarHBondContact O-N 3.22Å; D299-V301 VanDerWaalsContact C-N 3.35Å; D299-V301 PolarHBondContact O-N 3.31Å; D299-G302 PolarHBondContact O-N 3.12Å
300T85.7Confident85.5Confident100 Ų10088.1 Ų88.161%0.61347%0.47SS*.Hα-helixtrans-67.6-32.6179.1-54.60000113F296 M297 M298 G302F296-T300 WeakPolarHBondContact O-CB 3.45Å; F296-T300 PolarHBondContact O-N 3Å; F296-T300 PolarHBondContact O-OG1 3.08Å; M297-T300 PolarHBondContact O-N 3.01Å; M298-T300 VanDerWaalsContact C-N 3.26Å; M298-T300 PolarHBondContact O-N 3.2Å; T300-G302 PolarHBondContact O-N 3.47Å
301V83.2Confident85Confident74 Ų7489.2 Ų89.245%0.44848%0.484SS..THydrogen-bonded Turntrans-80.9-3.3178.51730000111.7P3 I7 I11 M297 M298 D299P3-V301 HydrophobicContact CB-CG1 4.32Å; I7-V301 HydrophobicContact CG2-CG1 4Å; I7-V301 HydrophobicContact CG2-CG2 4.2Å; I11-V301 HydrophobicContact CD1-CG2 4.24Å; M297-V301 WeakPolarHBondContact O-CG2 3.33Å; M297-V301 PolarHBondContact O-N 3.43Å; M297-V301 VanDerWaalsContact O-N 3.12Å; M298-V301 PolarHBondContact O-N 3.35Å; M298-V301 VanDerWaalsContact O-N 3.12Å; D299-V301 VanDerWaalsContact C-N 3.35Å; D299-V301 PolarHBondContact O-N 3.31Å
302G64.1Low84.6Confident70 Ų7086.8 Ų86.872%0.72248%0.478SS*.THydrogen-bonded Turntrans73.528.8-178.800000113M298 D299 T300M298-G302 PolarHBondContact O-N 3.12Å; D299-G302 PolarHBondContact O-N 3.12Å; T300-G302 PolarHBondContact O-N 3.47Å
303A55.8Low83.8Confident75 Ų7581.4 Ų81.462%0.6246%0.463SS*.  trans-97.20175.400000111.7P3 M298P3-A303 HydrophobicContact CG-CB 4.19Å; M298-A303 PolarHBondContact O-N 3.39Å; M298-A303 HydrophobicContact SD-CB 4.36Å

Retrieved 303 of 303 residues in 192 ms (Link to these results)

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