G4VS40_SCHMA Loading...

Putative rhodopsin-like orphan GPCR

AlphaFold DB , UniProt , Accession G4VS40, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 497 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
1M43.8Very low40.3Very low225 Ų225136.7 Ų136.7100%1.10876%0.755SS**  094.60-83176.5164.300106.8
2D39.1Very low42Very low149 Ų149134.9 Ų134.980%0.79774%0.743SS**  trans-113.583.9-148.9-561.9000109.8N4D2-N4 PolarHBondContact O-N 3.05Å
3T44.3Very low44.4Very low117 Ų117127.8 Ų127.872%0.71870%0.703SS**  trans-80.996.1-17948.10000111.1H5T3-H5 PolarHBondContact O-N 3.11Å
4N39.1Very low47Very low146 Ų146120.4 Ų120.478%0.78166%0.664SS**  trans-60.4104174.8-75.9-28.7000112D2 T6D2-N4 PolarHBondContact O-N 3.05Å; N4-T6 PolarHBondContact O-N 2.82Å; N4-T6 VanDerWaalsContact O-N 3.12Å
5H40.6Very low49.6Very low165 Ų165120.2 Ų120.276%0.76467%0.668SS**  trans-80.980.8169.2-88.1-78.2000111.4T3 T7T3-H5 PolarHBondContact O-N 3.11Å; H5-T7 PolarHBondContact O-N 3.44Å; H5-T7 VanDerWaalsContact O-N 3.13Å
6T37.1Very low51.9Low126 Ų126118.8 Ų118.877%0.77366%0.658SS**  trans-81.878.3168.453.10000110.8N4 N8N4-T6 PolarHBondContact O-N 2.82Å; N4-T6 VanDerWaalsContact O-N 3.12Å; T6-N8 PolarHBondContact O-N 3.33Å
7T37.3Very low53.9Low112 Ų112112.2 Ų112.269%0.68762%0.622SS**  trans-78.8100.217445.60000111.2H5 S9H5-T7 PolarHBondContact O-N 3.44Å; H5-T7 VanDerWaalsContact O-N 3.13Å; T7-S9 PolarHBondContact O-N 3.24Å
8N31.1Very low55.7Low152 Ų152109.7 Ų109.781%0.81361%0.606SS**  trans-68.191168.4-80-16000110.4T6 T10T6-N8 PolarHBondContact O-N 3.33Å; N8-T10 VanDerWaalsContact C-N 3.33Å; N8-T10 PolarHBondContact O-N 3.46Å
9S36.4Very low57.6Low99 Ų99108.8 Ų108.869%0.69260%0.6SS**  trans-76.177.217852.10000111.8T7T7-S9 PolarHBondContact O-N 3.24Å
10T43.2Very low59.2Low99 Ų99105 Ų10561%0.60758%0.578SS**  trans-64.7132.1170.146.90000110.7N8 N12N8-T10 VanDerWaalsContact C-N 3.33Å; N8-T10 PolarHBondContact O-N 3.46Å; T10-N12 VanDerWaalsContact C-N 3.34Å; T10-N12 PolarHBondContact O-N 3.34Å; T10-N12 PolarHBondContact O-ND2 2.97Å
11M51.8Low60.6Low114 Ų114101.6 Ų101.656%0.56256%0.558SS**  trans-71.681.9-175.2-65.4176.474.900111.8L13 P87M11-L13 PolarHBondContact O-N 3.29Å; M11-P87 HydrophobicContact CE-CG 4.03Å
12N60.7Low62.8Low115 Ų11595 Ų9562%0.61553%0.527SS*.  trans-76.584.6179.6-68.3-43.5000111.6T10T10-N12 VanDerWaalsContact C-N 3.34Å; T10-N12 PolarHBondContact O-N 3.34Å; T10-N12 PolarHBondContact O-ND2 2.97Å
13L73.1Confident65.3Low42 Ų4292 Ų9222%0.2251%0.51CS..  trans-56.7136.2170.9-178.767.5000111.3M11 T15 V17 I18 F86 L487M11-L13 PolarHBondContact O-N 3.29Å; L13-T15 PolarHBondContact O-N 3.41Å; L13-V17 HydrophobicContact CD1-CB 4.05Å; L13-V17 HydrophobicContact CD1-CG1 3.97Å; L13-V17 HydrophobicContact CD1-CG2 4.4Å; L13-V17 HydrophobicContact CD2-CB 4.4Å; L13-V17 HydrophobicContact CD2-CG1 4.25Å; L13-V17 HydrophobicContact CG-CB 4.1Å; L13-V17 HydrophobicContact CG-CG1 4.31Å; L13-I18 HydrophobicContact CB-CD1 4.38Å; L13-I18 HydrophobicContact CB-CG1 4.36Å; L13-I18 HydrophobicContact CD2-CD1 4.43Å; L13-I18 HydrophobicContact CD2-CG1 3.61Å; L13-I18 HydrophobicContact CG-CG1 4Å; L13-F86 HydrophobicContact CD1-CE1 4.08Å; L13-F86 HydrophobicContact CD2-CD1 4.1Å; L13-F86 HydrophobicContact CD2-CE1 3.61Å; L13-L487 HydrophobicContact CD1-CD1 3.41Å; L13-L487 VanDerWaalsContact CD1-CD1 3.41Å; L13-L487 HydrophobicContact CD1-CD2 3.36Å; L13-L487 HydrophobicContact CD1-CG 3.96Å
14P80.9Confident67.6Low24 Ų2487.2 Ų87.216%0.15648%0.481CS..  trans-60.1134.3179.8-25.936.3000112.6L16 V17 I18 L357 I479P14-L16 PolarHBondContact O-N 3.28Å; P14-V17 HydrophobicContact CB-CG2 4.26Å; P14-V17 WeakPolarHBondContact O-CB 3.26Å; P14-V17 PolarHBondContact O-N 2.97Å; P14-I18 PolarHBondContact O-N 3.42Å; P14-L357 HydrophobicContact CB-CD1 3.82Å; P14-L357 HydrophobicContact CG-CD1 3.5Å; P14-L357 VanDerWaalsContact CG-CD1 3.5Å; P14-I479 HydrophobicContact CG-CD1 3.92Å
15T85.1Confident70.1Confident118 Ų11881.6 Ų81.672%0.72445%0.451SS*.Hα-helixtrans-52.5-33.4-174.2-43.10000113.7L13 I18 L19L13-T15 PolarHBondContact O-N 3.41Å; T15-I18 WeakPolarHBondContact O-CB 3.26Å; T15-I18 PolarHBondContact O-N 3.01Å; T15-L19 PolarHBondContact O-N 3.23Å
16L86.6Confident72.7Confident98 Ų9877.1 Ų77.151%0.51344%0.437SS..Hα-helixtrans-71.6-29.6178.9-174.559.3000112.8P14 L19 I20 V361P14-L16 PolarHBondContact O-N 3.28Å; L16-L19 HydrophobicContact CD1-CD2 4.1Å; L16-L19 PolarHBondContact O-N 3.31Å; L16-I20 HydrophobicContact CG-CD1 4.27Å; L16-I20 WeakPolarHBondContact O-CD1 3.3Å; L16-I20 VanDerWaalsContact O-CG1 3.24Å; L16-I20 WeakPolarHBondContact O-CG1 3.5Å; L16-I20 PolarHBondContact O-N 3.48Å; L16-V361 HydrophobicContact CB-CG1 3.89Å; L16-V361 HydrophobicContact CD2-CG1 3.62Å; L16-V361 HydrophobicContact CG-CG1 3.53Å
17V86.5Confident75.4Confident7 Ų776.2 Ų76.24%0.04242%0.422CS..Hα-helixtrans-68.6-42.4170.9-173.40000110.4L13 P14 L19 I20 K21 F86 V361 F364L13-V17 HydrophobicContact CD1-CB 4.05Å; L13-V17 HydrophobicContact CD1-CG1 3.97Å; L13-V17 HydrophobicContact CD1-CG2 4.4Å; L13-V17 HydrophobicContact CD2-CB 4.4Å; L13-V17 HydrophobicContact CD2-CG1 4.25Å; L13-V17 HydrophobicContact CG-CB 4.1Å; L13-V17 HydrophobicContact CG-CG1 4.31Å; P14-V17 HydrophobicContact CB-CG2 4.26Å; P14-V17 WeakPolarHBondContact O-CB 3.26Å; P14-V17 PolarHBondContact O-N 2.97Å; V17-L19 VanDerWaalsContact C-N 3.3Å; V17-L19 PolarHBondContact O-N 3.21Å; V17-I20 PolarHBondContact O-N 3.03Å; V17-K21 VanDerWaalsContact O-CB 3.31Å; V17-K21 WeakPolarHBondContact O-CB 3.49Å; V17-K21 PolarHBondContact O-N 3.33Å; V17-F86 HydrophobicContact CG1-CE1 4.36Å; V17-F86 HydrophobicContact CG1-CZ 4.15Å; V17-V361 HydrophobicContact CG2-CB 4.44Å; V17-V361 HydrophobicContact CG2-CG1 4.12Å; V17-V361 HydrophobicContact CG2-CG2 3.6Å; V17-F364 HydrophobicContact CG1-CD1 4.01Å; V17-F364 HydrophobicContact CG1-CE1 3.61Å; V17-F364 HydrophobicContact CG1-CE2 4.22Å; V17-F364 HydrophobicContact CG1-CG 4.47Å; V17-F364 HydrophobicContact CG1-CZ 3.72Å
18I86.5Confident78.2Confident67 Ų6771 Ų7134%0.34439%0.39SS..Hα-helixtrans-59.2-43.9174.5-61169.9000110.1L13 P14 T15 K21 N22L13-I18 HydrophobicContact CB-CD1 4.38Å; L13-I18 HydrophobicContact CB-CG1 4.36Å; L13-I18 HydrophobicContact CD2-CD1 4.43Å; L13-I18 HydrophobicContact CD2-CG1 3.61Å; L13-I18 HydrophobicContact CG-CG1 4Å; P14-I18 PolarHBondContact O-N 3.42Å; T15-I18 WeakPolarHBondContact O-CB 3.26Å; T15-I18 PolarHBondContact O-N 3.01Å; I18-K21 PolarHBondContact O-N 3.49Å; I18-N22 WeakPolarHBondContact O-CB 3.3Å; I18-N22 PolarHBondContact O-N 3.49Å; I18-N22 PolarHBondContact O-ND2 3.12Å; I18-N22 PolarHBondContact O-OD1 2.92Å
19L90.8Very high81.3Confident93 Ų9367.2 Ų67.249%0.48737%0.369SS..Hα-helixtrans-62.4-49.5177.5-176.861.3000111.9T15 L16 V17 K21 N22 I23T15-L19 PolarHBondContact O-N 3.23Å; L16-L19 HydrophobicContact CD1-CD2 4.1Å; L16-L19 PolarHBondContact O-N 3.31Å; V17-L19 VanDerWaalsContact C-N 3.3Å; V17-L19 PolarHBondContact O-N 3.21Å; L19-K21 PolarHBondContact O-N 3.31Å; L19-N22 PolarHBondContact O-N 3.4Å; L19-I23 HydrophobicContact CD1-CD1 3.97Å; L19-I23 HydrophobicContact CD1-CG1 4.43Å; L19-I23 HydrophobicContact CG-CD1 3.9Å; L19-I23 VanDerWaalsContact O-CG1 3.28Å; L19-I23 WeakPolarHBondContact O-CG1 3.33Å; L19-I23 PolarHBondContact O-N 3.48Å
20I89.8Confident84.1Confident31 Ų3167 Ų6716%0.15936%0.36CS..Hα-helixtrans-59.2-47.3177-67161.4000110.5L16 V17 N22 I23 C24 V361 F364 R368L16-I20 HydrophobicContact CG-CD1 4.27Å; L16-I20 WeakPolarHBondContact O-CD1 3.3Å; L16-I20 VanDerWaalsContact O-CG1 3.24Å; L16-I20 WeakPolarHBondContact O-CG1 3.5Å; L16-I20 PolarHBondContact O-N 3.48Å; V17-I20 PolarHBondContact O-N 3.03Å; I20-N22 PolarHBondContact O-N 2.94Å; I20-I23 PolarHBondContact O-N 3.01Å; I20-C24 PolarHBondContact O-N 3.33Å; I20-C24 PolarHBondContact O-SG 2.94Å; I20-C24 VanDerWaalsContact O-SG 3.36Å; I20-V361 HydrophobicContact CD1-CG1 3.77Å; I20-F364 HydrophobicContact CB-CD1 4.24Å; I20-F364 HydrophobicContact CB-CE1 3.99Å; I20-F364 HydrophobicContact CD1-CD1 4.18Å; I20-F364 HydrophobicContact CG2-CD1 3.84Å; I20-F364 HydrophobicContact CG2-CE1 3.61Å; I20-R368 HydrophobicContact CG2-CB 4.43Å
21K88.6Confident86.6Confident34 Ų3462.9 Ų62.915%0.14833%0.334CS..Hα-helixtrans-53.8-51176.7-173.8-176.2103.7136.30111.5V17 I18 L19 I23 C24 I25 Y82 F86V17-K21 VanDerWaalsContact O-CB 3.31Å; V17-K21 WeakPolarHBondContact O-CB 3.49Å; V17-K21 PolarHBondContact O-N 3.33Å; I18-K21 PolarHBondContact O-N 3.49Å; L19-K21 PolarHBondContact O-N 3.31Å; K21-I23 VanDerWaalsContact C-N 3.28Å; K21-I23 PolarHBondContact O-N 3Å; K21-C24 PolarHBondContact O-N 3.29Å; K21-I25 HydrophobicContact CG-CD1 4.05Å; K21-I25 WeakPolarHBondContact O-CG1 3.37Å; K21-I25 PolarHBondContact O-N 3.13Å; K21-I25 VanDerWaalsContact O-N 3.14Å; K21-Y82 VanDerWaalsContact CD-O 3.25Å; K21-Y82 WeakPolarHBondContact CD-O 3.46Å; K21-Y82 VanDerWaalsContact CE-O 3.29Å; K21-Y82 WeakPolarHBondContact CE-O 3.43Å; K21-Y82 HydrophobicContact CG-CD1 4.19Å; K21-Y82 PolarHBondContact NZ-O 3.44Å; K21-F86 HydrophobicContact CD-CB 4.25Å; K21-F86 HydrophobicContact CD-CD1 4.11Å; K21-F86 HydrophobicContact CD-CG 4.04Å
22N90.4Very high88.8Confident88 Ų8858.3 Ų58.347%0.47131%0.312SS..Hα-helixtrans-68.7-26-177.3-67.4-5.9000112.8I18 L19 I20 P26I18-N22 WeakPolarHBondContact O-CB 3.3Å; I18-N22 PolarHBondContact O-N 3.49Å; I18-N22 PolarHBondContact O-ND2 3.12Å; I18-N22 PolarHBondContact O-OD1 2.92Å; L19-N22 PolarHBondContact O-N 3.4Å; I20-N22 PolarHBondContact O-N 2.94Å; N22-P26 WeakPolarHBondContact O-CD 3.4Å
23I92.3Very high90.4Very high86 Ų8658.3 Ų58.344%0.44131%0.31SS..Hα-helixtrans-75.8-40.7171.9-69.8166.9000111.3L19 I20 K21 P26 F27L19-I23 HydrophobicContact CD1-CD1 3.97Å; L19-I23 HydrophobicContact CD1-CG1 4.43Å; L19-I23 HydrophobicContact CG-CD1 3.9Å; L19-I23 VanDerWaalsContact O-CG1 3.28Å; L19-I23 WeakPolarHBondContact O-CG1 3.33Å; L19-I23 PolarHBondContact O-N 3.48Å; I20-I23 PolarHBondContact O-N 3.01Å; K21-I23 VanDerWaalsContact C-N 3.28Å; K21-I23 PolarHBondContact O-N 3Å; I23-P26 VanDerWaalsContact O-CD 3.29Å; I23-P26 WeakPolarHBondContact O-CD 3.39Å; I23-P26 VanDerWaalsContact O-CG 3.3Å; I23-P26 WeakPolarHBondContact O-CG 3.45Å; I23-F27 HydrophobicContact CG2-CD2 4.41Å; I23-F27 HydrophobicContact CG2-CE2 4.04Å; I23-F27 VanDerWaalsContact O-CD2 3.24Å; I23-F27 WeakPolarHBondContact O-CD2 3.36Å
24C91.8Very high91.5Very high16 Ų1661.9 Ų61.911%0.10832%0.324CS..Hα-helixtrans-71.8-36.6-177-69.40000114I20 K21 F27 Y28I20-C24 PolarHBondContact O-N 3.33Å; I20-C24 PolarHBondContact O-SG 2.94Å; I20-C24 VanDerWaalsContact O-SG 3.36Å; K21-C24 PolarHBondContact O-N 3.29Å; C24-F27 PolarHBondContact O-N 3.25Å; C24-F27 VanDerWaalsContact O-N 3.1Å; C24-Y28 HydrophobicContact CB-CD2 4.24Å; C24-Y28 HydrophobicContact CB-CE2 3.85Å; C24-Y28 WeakPolarHBondContact O-CD2 3.48Å; C24-Y28 PolarHBondContact O-N 3.37Å
25I92.3Very high92.2Very high27 Ų2760.7 Ų60.714%0.13832%0.317CS..Hα-helixtrans-50.8-52-179.5-72.3164.1000113.5K21 F27 Y28 L29K21-I25 HydrophobicContact CG-CD1 4.05Å; K21-I25 WeakPolarHBondContact O-CG1 3.37Å; K21-I25 PolarHBondContact O-N 3.13Å; K21-I25 VanDerWaalsContact O-N 3.14Å; I25-F27 VanDerWaalsContact C-N 3.32Å; I25-F27 PolarHBondContact O-N 2.97Å; I25-Y28 PolarHBondContact O-N 3.4Å; I25-L29 HydrophobicContact CG2-CD1 3.85Å; I25-L29 HydrophobicContact CG2-CG 4.48Å; I25-L29 WeakPolarHBondContact O-CG 3.34Å; I25-L29 PolarHBondContact O-N 3.4Å
26P94.3Very high92.8Very high72 Ų7257.7 Ų57.747%0.46830%0.296SS..Hα-helixtrans-65.3-30.3178.623.9-34.1000113.6N22 I23 L30N22-P26 WeakPolarHBondContact O-CD 3.4Å; I23-P26 VanDerWaalsContact O-CD 3.29Å; I23-P26 WeakPolarHBondContact O-CD 3.39Å; I23-P26 VanDerWaalsContact O-CG 3.3Å; I23-P26 WeakPolarHBondContact O-CG 3.45Å; P26-L30 VanDerWaalsContact O-CB 3.29Å; P26-L30 WeakPolarHBondContact O-CB 3.32Å; P26-L30 PolarHBondContact O-N 2.94Å
27F94.6Very high93.2Very high107 Ų10759 Ų5947%0.46930%0.298SS..Hα-helixtrans-66.8-44.9172.4-74.4-69.7000111.6I23 C24 I25 L30 I31 V372I23-F27 HydrophobicContact CG2-CD2 4.41Å; I23-F27 HydrophobicContact CG2-CE2 4.04Å; I23-F27 VanDerWaalsContact O-CD2 3.24Å; I23-F27 WeakPolarHBondContact O-CD2 3.36Å; C24-F27 PolarHBondContact O-N 3.25Å; C24-F27 VanDerWaalsContact O-N 3.1Å; I25-F27 VanDerWaalsContact C-N 3.32Å; I25-F27 PolarHBondContact O-N 2.97Å; F27-L30 WeakPolarHBondContact O-CB 3.39Å; F27-L30 PolarHBondContact O-N 3.48Å; F27-I31 VanDerWaalsContact O-CG1 3.25Å; F27-I31 WeakPolarHBondContact O-CG1 3.41Å; F27-I31 PolarHBondContact O-N 3.37Å; F27-V372 HydrophobicContact CB-CG1 4.36Å; F27-V372 HydrophobicContact CB-CG2 4.48Å
28Y95Very high93.6Very high1 Ų158.8 Ų58.80%0.00430%0.297CS..Hα-helixtrans-62.7-42.6176.4-68.1-46.5000112.2C24 I25 L30 I31 L32 L75 T78 I79 R368 V372 Y375C24-Y28 HydrophobicContact CB-CD2 4.24Å; C24-Y28 HydrophobicContact CB-CE2 3.85Å; C24-Y28 WeakPolarHBondContact O-CD2 3.48Å; C24-Y28 PolarHBondContact O-N 3.37Å; I25-Y28 PolarHBondContact O-N 3.4Å; Y28-L30 VanDerWaalsContact C-N 3.35Å; Y28-L30 PolarHBondContact O-N 3.39Å; Y28-I31 PolarHBondContact O-N 3.22Å; Y28-L32 WeakPolarHBondContact O-CB 3.37Å; Y28-L32 PolarHBondContact O-N 2.93Å; Y28-L75 HydrophobicContact CD1-CD1 3.52Å; Y28-L75 HydrophobicContact CE1-CD1 4.32Å; Y28-L75 HydrophobicContact CG-CD1 3.94Å; Y28-T78 HydrophobicContact CE2-CG2 4.22Å; Y28-I79 HydrophobicContact CG-CG1 4.48Å; Y28-R368 PolarHBondContact OH-O 2.94Å; Y28-V372 HydrophobicContact CD1-CG2 4.06Å; Y28-V372 HydrophobicContact CE1-CB 4.33Å; Y28-V372 HydrophobicContact CE1-CG2 3.47Å; Y28-V372 VanDerWaalsContact CE1-CG2 3.47Å; Y28-V372 HydrophobicContact CE2-CG2 4.45Å; Y28-Y375 HydrophobicContact CD1-CD2 4.37Å; Y28-Y375 AromaticContact CE1-CD2 3.86Å; Y28-Y375 HydrophobicContact CE1-CD2 3.86Å; Y28-Y375 HydrophobicContact CE1-CE2 4.45Å
29L96Very high94Very high74 Ų7455.6 Ų55.639%0.38728%0.28SS..Hα-helixtrans-61.2-41.3174.2-72.3168.1000112.2I25 L32 I33 I79I25-L29 HydrophobicContact CG2-CD1 3.85Å; I25-L29 HydrophobicContact CG2-CG 4.48Å; I25-L29 WeakPolarHBondContact O-CG 3.34Å; I25-L29 PolarHBondContact O-N 3.4Å; L29-L32 PolarHBondContact O-N 3.37Å; L29-I33 VanDerWaalsContact O-CG1 3.3Å; L29-I33 WeakPolarHBondContact O-CG1 3.35Å; L29-I33 PolarHBondContact O-N 3.21Å; L29-I79 HydrophobicContact CD2-CD1 4.28Å; L29-I79 HydrophobicContact CD2-CG2 4.05Å
30L95.6Very high94.2Very high93 Ų9352.4 Ų52.449%0.48727%0.27SS..Hα-helixtrans-62.8-46.6176.2-170.672.9000111.4P26 F27 Y28 L32 I33 F34P26-L30 VanDerWaalsContact O-CB 3.29Å; P26-L30 WeakPolarHBondContact O-CB 3.32Å; P26-L30 PolarHBondContact O-N 2.94Å; F27-L30 WeakPolarHBondContact O-CB 3.39Å; F27-L30 PolarHBondContact O-N 3.48Å; Y28-L30 VanDerWaalsContact C-N 3.35Å; Y28-L30 PolarHBondContact O-N 3.39Å; L30-L32 VanDerWaalsContact C-N 3.35Å; L30-L32 PolarHBondContact O-N 2.87Å; L30-I33 PolarHBondContact O-N 3.13Å; L30-F34 HydrophobicContact CD1-CD2 3.76Å; L30-F34 HydrophobicContact CD1-CE2 3.59Å; L30-F34 HydrophobicContact CG-CD2 4.04Å; L30-F34 HydrophobicContact CG-CE2 4.29Å; L30-F34 WeakPolarHBondContact O-CB 3.31Å; L30-F34 WeakPolarHBondContact O-CD2 3.5Å; L30-F34 PolarHBondContact O-N 3.2Å
31I96.1Very high94.4Very high14 Ų1452.6 Ų52.67%0.07227%0.271CS..Hα-helixtrans-60.6-44.2177.1-67.8165.4000110.6F27 Y28 G35 L71 L75 V372 Y375 T376 A379F27-I31 VanDerWaalsContact O-CG1 3.25Å; F27-I31 WeakPolarHBondContact O-CG1 3.41Å; F27-I31 PolarHBondContact O-N 3.37Å; Y28-I31 PolarHBondContact O-N 3.22Å; I31-G35 WeakPolarHBondContact O-CA 3.49Å; I31-G35 PolarHBondContact O-N 2.93Å; I31-L71 HydrophobicContact CG2-CD2 4.32Å; I31-L75 HydrophobicContact CB-CD2 4.06Å; I31-L75 HydrophobicContact CG2-CD2 3.62Å; I31-V372 HydrophobicContact CD1-CG1 4.19Å; I31-Y375 WeakPolarHBondContact CG2-O 3.44Å; I31-T376 HydrophobicContact CD1-CG2 3.67Å; I31-T376 HydrophobicContact CG1-CG2 4.02Å; I31-A379 HydrophobicContact CG2-CB 3.86Å
32L96.7Very high94.5Very high18 Ų1851 Ų519%0.09426%0.264CS..Hα-helixtrans-60.2-51.4178-177.364000111.5Y28 L29 L30 G35 L36 L71 L75 L76 I79Y28-L32 WeakPolarHBondContact O-CB 3.37Å; Y28-L32 PolarHBondContact O-N 2.93Å; L29-L32 PolarHBondContact O-N 3.37Å; L30-L32 VanDerWaalsContact C-N 3.35Å; L30-L32 PolarHBondContact O-N 2.87Å; L32-G35 PolarHBondContact O-N 2.85Å; L32-L36 HydrophobicContact CD1-CD1 3.71Å; L32-L36 HydrophobicContact CD1-CG 4.02Å; L32-L36 HydrophobicContact CG-CD1 3.96Å; L32-L36 WeakPolarHBondContact O-CB 3.43Å; L32-L36 VanDerWaalsContact O-CG 3.25Å; L32-L36 WeakPolarHBondContact O-CG 3.45Å; L32-L36 PolarHBondContact O-N 3.4Å; L32-L71 HydrophobicContact CD1-CB 4.06Å; L32-L71 WeakPolarHBondContact CD1-O 3.18Å; L32-L75 HydrophobicContact CB-CD2 3.86Å; L32-L75 HydrophobicContact CB-CG 4.48Å; L32-L75 HydrophobicContact CD1-CD2 4.34Å; L32-L76 HydrophobicContact CD2-CD1 4.08Å; L32-I79 HydrophobicContact CB-CD1 4.14Å; L32-I79 HydrophobicContact CD2-CD1 3.78Å
33I96.1Very high94.6Very high114 Ų11447.7 Ų47.759%0.58525%0.247SC*.Hα-helixtrans-62.8-48.8-178.6-67.5165.8000111L29 L30 F37L29-I33 VanDerWaalsContact O-CG1 3.3Å; L29-I33 WeakPolarHBondContact O-CG1 3.35Å; L29-I33 PolarHBondContact O-N 3.21Å; L30-I33 PolarHBondContact O-N 3.13Å; I33-F37 VanDerWaalsContact O-CB 3.29Å; I33-F37 WeakPolarHBondContact O-CB 3.38Å; I33-F37 PolarHBondContact O-N 3.05Å
34F95.4Very high94.5Very high117 Ų11746.2 Ų46.251%0.51324%0.242SC..Hα-helixtrans-68.1-36.5-179.6-88.9-93.1000112.8L30 G38L30-F34 HydrophobicContact CD1-CD2 3.76Å; L30-F34 HydrophobicContact CD1-CE2 3.59Å; L30-F34 HydrophobicContact CG-CD2 4.04Å; L30-F34 HydrophobicContact CG-CE2 4.29Å; L30-F34 WeakPolarHBondContact O-CB 3.31Å; L30-F34 WeakPolarHBondContact O-CD2 3.5Å; L30-F34 PolarHBondContact O-N 3.2Å; F34-G38 WeakPolarHBondContact O-CA 3.45Å; F34-G38 PolarHBondContact O-N 3.39Å
35G96.6Very high94.2Very high0 Ų045.6 Ų45.60%024%0.238CC..Hα-helixtrans-70.3-48.9179.600000112.9I31 L32 F37 G38 N39I31-G35 WeakPolarHBondContact O-CA 3.49Å; I31-G35 PolarHBondContact O-N 2.93Å; L32-G35 PolarHBondContact O-N 2.85Å; G35-F37 VanDerWaalsContact C-N 3.34Å; G35-F37 PolarHBondContact O-N 2.95Å; G35-G38 PolarHBondContact O-N 3.42Å; G35-N39 VanDerWaalsContact O-CB 3.28Å; G35-N39 WeakPolarHBondContact O-CB 3.4Å; G35-N39 PolarHBondContact O-N 3.35Å; G35-N39 PolarHBondContact O-ND2 3.48Å
36L97.1Very high93.9Very high54 Ų5444.8 Ų44.828%0.28323%0.234SC..Hα-helixtrans-59.1-45.6176.4-67176.2000111.4L32 G40 I68 L71 L72L32-L36 HydrophobicContact CD1-CD1 3.71Å; L32-L36 HydrophobicContact CD1-CG 4.02Å; L32-L36 HydrophobicContact CG-CD1 3.96Å; L32-L36 WeakPolarHBondContact O-CB 3.43Å; L32-L36 VanDerWaalsContact O-CG 3.25Å; L32-L36 WeakPolarHBondContact O-CG 3.45Å; L32-L36 PolarHBondContact O-N 3.4Å; L36-G40 PolarHBondContact O-N 3Å; L36-I68 HydrophobicContact CD2-CB 4.45Å; L36-I68 HydrophobicContact CD2-CG1 4.45Å; L36-I68 HydrophobicContact CD2-CG2 3.95Å; L36-L71 HydrophobicContact CD2-CB 4.14Å; L36-L71 HydrophobicContact CD2-CD1 4.49Å; L36-L72 HydrophobicContact CD1-CD2 4.06Å; L36-L72 HydrophobicContact CD2-CD1 4.41Å; L36-L72 HydrophobicContact CD2-CD2 3.99Å; L36-L72 HydrophobicContact CD2-CG 3.92Å
37F95.3Very high93.1Very high126 Ų12646.6 Ų46.655%0.55324%0.236SC*.Hα-helixtrans-67.1-47.9178.3-178.6-105.9000112.7I33 G35 G40 L41I33-F37 VanDerWaalsContact O-CB 3.29Å; I33-F37 WeakPolarHBondContact O-CB 3.38Å; I33-F37 PolarHBondContact O-N 3.05Å; G35-F37 VanDerWaalsContact C-N 3.34Å; G35-F37 PolarHBondContact O-N 2.95Å; F37-G40 PolarHBondContact O-N 2.96Å; F37-L41 HydrophobicContact CD1-CD1 4.07Å; F37-L41 HydrophobicContact CE1-CD1 3.48Å; F37-L41 VanDerWaalsContact CE1-CD1 3.48Å; F37-L41 HydrophobicContact CE1-CG 4.32Å; F37-L41 HydrophobicContact CE2-CD1 4.3Å; F37-L41 HydrophobicContact CE2-CG 4.42Å; F37-L41 HydrophobicContact CZ-CD1 3.62Å; F37-L41 HydrophobicContact CZ-CG 4.21Å; F37-L41 WeakPolarHBondContact O-CG 3.37Å; F37-L41 PolarHBondContact O-N 2.92Å
38G94.7Very high92.1Very high2 Ų243.1 Ų43.12%0.02123%0.225CC..Hα-helixtrans-65.3-42.6-177.700000113.1F34 G35 T42 F382F34-G38 WeakPolarHBondContact O-CA 3.45Å; F34-G38 PolarHBondContact O-N 3.39Å; G35-G38 PolarHBondContact O-N 3.42Å; G38-T42 WeakPolarHBondContact O-CB 3.4Å; G38-T42 PolarHBondContact O-N 3.45Å; G38-T42 PolarHBondContact O-OG1 2.73Å; G38-F382 WeakPolarHBondContact O-CB 3.48Å; G38-F382 WeakPolarHBondContact O-CD2 3.47Å; G38-F382 WeakPolarHBondContact O-CG 3.49Å
39N95.3Very high90.4Very high0 Ų051.7 Ų51.70%026%0.262CS..Hα-helixtrans-72.7-37.7177.1-68.4-27.9000111.6G35 L41 T42 V43 A64 D67 I68 F378G35-N39 VanDerWaalsContact O-CB 3.28Å; G35-N39 WeakPolarHBondContact O-CB 3.4Å; G35-N39 PolarHBondContact O-N 3.35Å; G35-N39 PolarHBondContact O-ND2 3.48Å; N39-L41 PolarHBondContact O-N 3.03Å; N39-T42 WeakPolarHBondContact O-CA 3.33Å; N39-T42 WeakPolarHBondContact O-CB 3.4Å; N39-T42 PolarHBondContact O-N 3.18Å; N39-T42 VanDerWaalsContact O-N 3.08Å; N39-V43 WeakPolarHBondContact O-CG2 3.4Å; N39-V43 PolarHBondContact O-N 3.01Å; N39-A64 HydrophobicContact CB-CB 4.05Å; N39-A64 WeakPolarHBondContact CB-O 3.49Å; N39-D67 VanDerWaalsContact ND2-CB 3.33Å; N39-D67 WeakPolarHBondContact ND2-CB 3.5Å; N39-I68 HydrophobicContact CB-CD1 3.84Å; N39-I68 HydrophobicContact CB-CG1 3.63Å; N39-F378 PolarHBondContact ND2-O 3.17Å
40G95Very high88.7Confident27 Ų2758.4 Ų58.428%0.27828%0.282SS..Hα-helixtrans-57.1-48171.400000112.3L36 F37 T42 V43 V44L36-G40 PolarHBondContact O-N 3Å; F37-G40 PolarHBondContact O-N 2.96Å; G40-T42 VanDerWaalsContact C-N 3.32Å; G40-T42 PolarHBondContact O-N 3.14Å; G40-V43 PolarHBondContact O-N 3.15Å; G40-V44 WeakPolarHBondContact O-CG2 3.38Å; G40-V44 PolarHBondContact O-N 3.47Å; G40-V44 VanDerWaalsContact O-N 3.15Å
41L92.2Very high87.1Confident34 Ų3455 Ų5518%0.17827%0.265CS..Hα-helixtrans-60.8-39.7172.4-74.9-176.1000112.4F37 N39 V44 I45 F382F37-L41 HydrophobicContact CD1-CD1 4.07Å; F37-L41 HydrophobicContact CE1-CD1 3.48Å; F37-L41 VanDerWaalsContact CE1-CD1 3.48Å; F37-L41 HydrophobicContact CE1-CG 4.32Å; F37-L41 HydrophobicContact CE2-CD1 4.3Å; F37-L41 HydrophobicContact CE2-CG 4.42Å; F37-L41 HydrophobicContact CZ-CD1 3.62Å; F37-L41 HydrophobicContact CZ-CG 4.21Å; F37-L41 WeakPolarHBondContact O-CG 3.37Å; F37-L41 PolarHBondContact O-N 2.92Å; N39-L41 PolarHBondContact O-N 3.03Å; L41-V44 PolarHBondContact O-N 2.87Å; L41-I45 HydrophobicContact CB-CD1 4.33Å; L41-I45 WeakPolarHBondContact O-CB 3.38Å; L41-I45 WeakPolarHBondContact O-CD1 3.49Å; L41-I45 WeakPolarHBondContact O-CG1 3.41Å; L41-I45 PolarHBondContact O-N 2.86Å; L41-F382 HydrophobicContact CB-CD2 4.08Å; L41-F382 HydrophobicContact CB-CE2 3.69Å; L41-F382 HydrophobicContact CB-CZ 4.23Å; L41-F382 HydrophobicContact CD1-CE1 4.14Å; L41-F382 HydrophobicContact CD1-CE2 3.93Å; L41-F382 HydrophobicContact CD1-CZ 3.58Å
42T91.8Very high85.3Confident0 Ų059.1 Ų59.10%028%0.283CS..Hα-helixtrans-58.8-49.7176.9-62.40000111.1G38 N39 G40 V44 I45 L46 A64 Y385 F392G38-T42 WeakPolarHBondContact O-CB 3.4Å; G38-T42 PolarHBondContact O-N 3.45Å; G38-T42 PolarHBondContact O-OG1 2.73Å; N39-T42 WeakPolarHBondContact O-CA 3.33Å; N39-T42 WeakPolarHBondContact O-CB 3.4Å; N39-T42 PolarHBondContact O-N 3.18Å; N39-T42 VanDerWaalsContact O-N 3.08Å; G40-T42 VanDerWaalsContact C-N 3.32Å; G40-T42 PolarHBondContact O-N 3.14Å; T42-V44 PolarHBondContact O-N 3.15Å; T42-I45 PolarHBondContact O-N 3.46Å; T42-L46 HydrophobicContact CG2-CD1 3.76Å; T42-L46 HydrophobicContact CG2-CG 4.1Å; T42-L46 WeakPolarHBondContact O-CB 3.46Å; T42-L46 VanDerWaalsContact O-CG 3.27Å; T42-L46 WeakPolarHBondContact O-CG 3.35Å; T42-L46 PolarHBondContact O-N 2.85Å; T42-A64 HydrophobicContact CG2-CB 3.94Å; T42-Y385 HydrophobicContact CG2-CD2 3.88Å; T42-Y385 HydrophobicContact CG2-CE2 3.54Å; T42-F392 HydrophobicContact CG2-CE2 4.45Å
43V92.5Very high83.7Confident19 Ų1967 Ų6712%0.11532%0.32CS..Hα-helixtrans-57.1-49.8178173.90000110.8N39 G40 I45 L46 Q47 T61 A64 I65N39-V43 WeakPolarHBondContact O-CG2 3.4Å; N39-V43 PolarHBondContact O-N 3.01Å; G40-V43 PolarHBondContact O-N 3.15Å; V43-I45 PolarHBondContact O-N 3.31Å; V43-L46 PolarHBondContact O-N 2.84Å; V43-Q47 VanDerWaalsContact CG1-NE2 3.34Å; V43-Q47 WeakPolarHBondContact O-CB 3.36Å; V43-Q47 VanDerWaalsContact O-CG 3.26Å; V43-Q47 WeakPolarHBondContact O-CG 3.41Å; V43-Q47 PolarHBondContact O-N 3.08Å; V43-T61 HydrophobicContact CG1-CG2 4.14Å; V43-T61 HydrophobicContact CG2-CG2 4.36Å; V43-A64 HydrophobicContact CG2-CB 3.9Å; V43-I65 HydrophobicContact CG2-CD1 4.41Å; V43-I65 HydrophobicContact CG2-CG1 3.73Å
44V89.5Confident82.9Confident56 Ų5662 Ų6234%0.33930%0.296SS..Hα-helixtrans-61.5-43.6179.5172.70000112.3G40 L41 T42 W399G40-V44 WeakPolarHBondContact O-CG2 3.38Å; G40-V44 PolarHBondContact O-N 3.47Å; G40-V44 VanDerWaalsContact O-N 3.15Å; L41-V44 PolarHBondContact O-N 2.87Å; T42-V44 PolarHBondContact O-N 3.15Å; V44-W399 HydrophobicContact CG1-CD2 4.02Å; V44-W399 HydrophobicContact CG1-CE3 4.1Å; V44-W399 HydrophobicContact CG1-CH2 3.57Å; V44-W399 HydrophobicContact CG1-CZ2 3.47Å; V44-W399 VanDerWaalsContact CG1-CZ2 3.47Å; V44-W399 HydrophobicContact CG1-CZ3 3.89Å
45I86.9Confident82.5Confident3 Ų356.5 Ų56.52%0.01527%0.271CS..Hα-helixtrans-68.5-43.7-179.2-69.2161.8000111.1L41 T42 V43 S48 F382 F392 Q395 A396 W399L41-I45 HydrophobicContact CB-CD1 4.33Å; L41-I45 WeakPolarHBondContact O-CB 3.38Å; L41-I45 WeakPolarHBondContact O-CD1 3.49Å; L41-I45 WeakPolarHBondContact O-CG1 3.41Å; L41-I45 PolarHBondContact O-N 2.86Å; T42-I45 PolarHBondContact O-N 3.46Å; V43-I45 PolarHBondContact O-N 3.31Å; I45-S48 VanDerWaalsContact O-CB 3.27Å; I45-S48 WeakPolarHBondContact O-CB 3.38Å; I45-S48 PolarHBondContact O-N 3.34Å; I45-F382 HydrophobicContact CD1-CE2 4.03Å; I45-F392 HydrophobicContact CB-CE2 4.05Å; I45-F392 HydrophobicContact CB-CZ 4.31Å; I45-F392 HydrophobicContact CD1-CE1 4.24Å; I45-F392 HydrophobicContact CD1-CE2 4.45Å; I45-F392 HydrophobicContact CD1-CZ 3.9Å; I45-F392 HydrophobicContact CG2-CD2 3.86Å; I45-F392 HydrophobicContact CG2-CE2 3.6Å; I45-F392 HydrophobicContact CG2-CZ 4.14Å; I45-Q395 HydrophobicContact CG2-CB 3.94Å; I45-A396 HydrophobicContact CD1-CB 3.72Å; I45-W399 HydrophobicContact CG1-CG 4.4Å
46L84.1Confident82.1Confident10 Ų1056.5 Ų56.55%0.05227%0.271CS..Hα-helixtrans-70.8-29.4-178.3-67-171000113T42 V43 S48 L57 L60 T61 F392T42-L46 HydrophobicContact CG2-CD1 3.76Å; T42-L46 HydrophobicContact CG2-CG 4.1Å; T42-L46 WeakPolarHBondContact O-CB 3.46Å; T42-L46 VanDerWaalsContact O-CG 3.27Å; T42-L46 WeakPolarHBondContact O-CG 3.35Å; T42-L46 PolarHBondContact O-N 2.85Å; V43-L46 PolarHBondContact O-N 2.84Å; L46-S48 PolarHBondContact O-N 3.39Å; L46-L57 HydrophobicContact CD2-CD2 4.16Å; L46-L60 HydrophobicContact CD1-CB 3.61Å; L46-T61 WeakPolarHBondContact CB-OG1 3.32Å; L46-F392 HydrophobicContact CD2-CD2 4.03Å; L46-F392 HydrophobicContact CD2-CE2 3.95Å; L46-F392 HydrophobicContact CG-CE2 4.29Å
47Q78.1Confident81.7Confident110 Ų11054.5 Ų54.551%0.51426%0.261SS..THydrogen-bonded Turntrans-65.5-10.1172.5-76.8-179.514.700114.1V43 K49 Q52V43-Q47 VanDerWaalsContact CG1-NE2 3.34Å; V43-Q47 WeakPolarHBondContact O-CB 3.36Å; V43-Q47 VanDerWaalsContact O-CG 3.26Å; V43-Q47 WeakPolarHBondContact O-CG 3.41Å; V43-Q47 PolarHBondContact O-N 3.08Å; Q47-K49 PolarHBondContact O-N 3.05Å; Q47-Q52 PolarHBondContact O-NE2 3.02Å
48S74.6Confident81.5Confident33 Ų3349.7 Ų49.723%0.23124%0.241CC..  trans-56.4120.7176.2-176.90000112.2I45 L46 R50 L51I45-S48 VanDerWaalsContact O-CB 3.27Å; I45-S48 WeakPolarHBondContact O-CB 3.38Å; I45-S48 PolarHBondContact O-N 3.34Å; L46-S48 PolarHBondContact O-N 3.39Å; S48-R50 PolarHBondContact O-N 2.96Å; S48-L51 PolarHBondContact O-N 2.88Å
49K59.6Low81.4Confident182 Ų18250.3 Ų50.379%0.79124%0.243SC*.THydrogen-bonded Turntrans-50.6-25.6-178.1-68.3-176.9178.8178.30114.3Q47 L51Q47-K49 PolarHBondContact O-N 3.05Å; K49-L51 PolarHBondContact O-N 2.96Å
50R60.2Low81.3Confident214 Ų21450.5 Ų50.581%0.80824%0.244SC*.THydrogen-bonded Turntrans-69.6-16.8176.8-168.5169.9-177.6169.61.6113.7S48S48-R50 PolarHBondContact O-N 2.96Å
51L61.4Low81.2Confident23 Ų2350.2 Ų50.212%0.1224%0.236CC..THydrogen-bonded Turntrans-105.7-40.3-176.7-64.9178.6000113.5S48 K49 Q53 L57 R314 Q395S48-L51 PolarHBondContact O-N 2.88Å; K49-L51 PolarHBondContact O-N 2.96Å; L51-Q53 PolarHBondContact O-N 2.9Å; L51-L57 HydrophobicContact CB-CD1 3.69Å; L51-L57 WeakPolarHBondContact O-CD1 3.41Å; L51-R314 PolarHBondContact O-NH2 2.88Å; L51-Q395 HydrophobicContact CD1-CG 4.39Å
52Q58.9Low81.4Confident99 Ų9949.6 Ų49.646%0.46323%0.234SC..  trans-44.7-15.6-165-69.1-179.1-12.400118.6Q47 S54Q47-Q52 PolarHBondContact O-NE2 3.02Å; Q52-S54 PolarHBondContact O-N 3.15Å
53Q62.5Low81.6Confident183 Ų18349.6 Ų49.686%0.85523%0.234SC*.SBendtrans-74.228.6-176.2-60.6-175.5-19.700115.4L51L51-Q53 PolarHBondContact O-N 2.9Å
54S78.5Confident81.7Confident11 Ų1148.7 Ų48.78%0.07723%0.228CC..SBendtrans-145.2122.8-177.11710000111.9Q52 T56 L57 R123Q52-S54 PolarHBondContact O-N 3.15Å; S54-T56 VanDerWaalsContact C-N 3.35Å; S54-T56 PolarHBondContact O-N 3.27Å; S54-L57 WeakPolarHBondContact O-CB 3.21Å; S54-L57 PolarHBondContact O-N 3.42Å; S54-R123 PolarHBondContact OG-NH2 3.07Å; S54-R123 VanDerWaalsContact OG-NH2 3.08Å
55S88Confident82.1Confident1 Ų149 Ų491%0.00723%0.227CC..Hα-helixtrans-39-54.1174.548.90000114.4L57 I58 Y59 D122 C137S55-L57 PolarHBondContact O-N 3.4Å; S55-I58 WeakPolarHBondContact O-CB 3.45Å; S55-I58 PolarHBondContact O-N 2.98Å; S55-Y59 PolarHBondContact O-N 3.41Å; S55-D122 VanDerWaalsContact CB-OD1 3.23Å; S55-D122 WeakPolarHBondContact CB-OD1 3.15Å; S55-D122 PolarHBondContact OG-OD1 3.38Å; S55-D122 PolarHBondContact OG-OD2 2.98Å; S55-D122 VanDerWaalsContact OG-OD2 3.09Å; S55-C137 PolarHBondContact OG-O 3.05Å
56T88.3Confident82.6Confident0 Ų049.2 Ų49.20%023%0.229CC..Hα-helixtrans-45.7-35.7174.6-88.60000114.9S54 I58 Y59 L60 V119 D122 R123S54-T56 VanDerWaalsContact C-N 3.35Å; S54-T56 PolarHBondContact O-N 3.27Å; T56-I58 VanDerWaalsContact C-N 3.31Å; T56-I58 PolarHBondContact O-N 2.94Å; T56-Y59 PolarHBondContact O-N 3.24Å; T56-L60 HydrophobicContact CG2-CD1 3.67Å; T56-L60 HydrophobicContact CG2-CG 4.19Å; T56-L60 VanDerWaalsContact O-CG 3.29Å; T56-L60 WeakPolarHBondContact O-CG 3.2Å; T56-L60 PolarHBondContact O-N 2.88Å; T56-V119 HydrophobicContact CG2-CG2 3.69Å; T56-V119 WeakPolarHBondContact OG1-CG2 3.41Å; T56-D122 PolarHBondContact OG1-OD2 3.44Å; T56-R123 VanDerWaalsContact CB-CZ 3.42Å; T56-R123 HydrophobicContact CG2-CG 4.48Å; T56-R123 VanDerWaalsContact OG1-CD 3.24Å; T56-R123 WeakPolarHBondContact OG1-CD 3.4Å; T56-R123 VanDerWaalsContact OG1-CG 3.25Å; T56-R123 WeakPolarHBondContact OG1-CG 3.35Å; T56-R123 PolarHBondContact OG1-NE 3.21Å; T56-R123 PolarHBondContact OG1-NH2 3.47Å
57L87.5Confident83.2Confident12 Ų1248.8 Ų48.86%0.06323%0.227CC..Hα-helixtrans-75.1-24.5-177.8-54.5-177.4000112.2L46 L51 S54 S55 L60 T61L46-L57 HydrophobicContact CD2-CD2 4.16Å; L51-L57 HydrophobicContact CB-CD1 3.69Å; L51-L57 WeakPolarHBondContact O-CD1 3.41Å; S54-L57 WeakPolarHBondContact O-CB 3.21Å; S54-L57 PolarHBondContact O-N 3.42Å; S55-L57 PolarHBondContact O-N 3.4Å; L57-L60 HydrophobicContact CD2-CD1 4.29Å; L57-T61 VanDerWaalsContact O-CB 3.31Å; L57-T61 WeakPolarHBondContact O-CB 3.32Å; L57-T61 PolarHBondContact O-N 3.13Å; L57-T61 PolarHBondContact O-OG1 3.19Å
58I91.6Very high84.2Confident24 Ų2445.3 Ų45.312%0.12321%0.211CC..Hα-helixtrans-67.9-51.4170.7-55.7173.3000108.4S55 T56 L60 T61 V62 T139 A142 W143 I146S55-I58 WeakPolarHBondContact O-CB 3.45Å; S55-I58 PolarHBondContact O-N 2.98Å; T56-I58 VanDerWaalsContact C-N 3.31Å; T56-I58 PolarHBondContact O-N 2.94Å; I58-L60 PolarHBondContact O-N 3.33Å; I58-T61 PolarHBondContact O-N 2.9Å; I58-T61 VanDerWaalsContact O-N 3.11Å; I58-V62 WeakPolarHBondContact O-CG2 3.28Å; I58-V62 PolarHBondContact O-N 3.05Å; I58-T139 HydrophobicContact CD1-CG2 3.78Å; I58-A142 HydrophobicContact CD1-CB 4.27Å; I58-W143 HydrophobicContact CG2-CD2 3.98Å; I58-W143 HydrophobicContact CG2-CE3 4.45Å; I58-W143 HydrophobicContact CG2-CG 4.46Å; I58-W143 HydrophobicContact CG2-CH2 4.26Å; I58-W143 HydrophobicContact CG2-CZ2 3.77Å; I58-I146 HydrophobicContact CG2-CD1 3.69Å
59Y93.8Very high85.3Confident16 Ų1649.1 Ų49.16%0.06322%0.224CC..Hα-helixtrans-54.3-48.8174.7-66.7-70.5000112.3S55 T56 T61 V62 L63 L115 D122 A142 T145 I146S55-Y59 PolarHBondContact O-N 3.41Å; T56-Y59 PolarHBondContact O-N 3.24Å; Y59-T61 VanDerWaalsContact C-N 3.32Å; Y59-T61 PolarHBondContact O-N 3.35Å; Y59-V62 PolarHBondContact O-N 3.38Å; Y59-L63 VanDerWaalsContact O-CB 3.22Å; Y59-L63 WeakPolarHBondContact O-CB 3.25Å; Y59-L63 PolarHBondContact O-N 2.8Å; Y59-L115 HydrophobicContact CD1-CD2 4.09Å; Y59-D122 HydrophobicContact CD2-CB 4.47Å; Y59-D122 HydrophobicContact CE2-CB 4.11Å; Y59-A142 HydrophobicContact CD2-CB 4.32Å; Y59-A142 HydrophobicContact CE2-CB 3.77Å; Y59-T145 HydrophobicContact CE1-CG2 4.05Å; Y59-T145 WeakPolarHBondContact OH-CB 3.5Å; Y59-T145 WeakPolarHBondContact OH-CG2 3.46Å; Y59-I146 HydrophobicContact CD1-CD1 3.77Å; Y59-I146 HydrophobicContact CD1-CG1 3.63Å; Y59-I146 HydrophobicContact CE1-CD1 4.09Å; Y59-I146 HydrophobicContact CE1-CG1 3.65Å; Y59-I146 HydrophobicContact CG-CD1 4.4Å
60L92.1Very high87Confident4 Ų440.5 Ų40.52%0.02119%0.186CC..Hα-helixtrans-66.8-28.3178.6-66.3173.1000113.7L46 T56 L57 I58 L63 A64 V119 M321 Y385L46-L60 HydrophobicContact CD1-CB 3.61Å; T56-L60 HydrophobicContact CG2-CD1 3.67Å; T56-L60 HydrophobicContact CG2-CG 4.19Å; T56-L60 VanDerWaalsContact O-CG 3.29Å; T56-L60 WeakPolarHBondContact O-CG 3.2Å; T56-L60 PolarHBondContact O-N 2.88Å; L57-L60 HydrophobicContact CD2-CD1 4.29Å; I58-L60 PolarHBondContact O-N 3.33Å; L60-L63 HydrophobicContact CD2-CD2 4.38Å; L60-A64 PolarHBondContact O-N 2.97Å; L60-V119 HydrophobicContact CD2-CG1 4.25Å; L60-V119 HydrophobicContact CD2-CG2 4.1Å; L60-V119 HydrophobicContact CG-CG2 4.1Å; L60-M321 HydrophobicContact CD1-CE 3.76Å; L60-Y385 HydrophobicContact CD2-CE1 4.05Å
61T93.1Very high88.8Confident21 Ų2130.3 Ų30.313%0.12915%0.148CC..Hα-helixtrans-75.9-41.6175.4-55.60000110.8V43 L46 L57 I58 Y59 I65V43-T61 HydrophobicContact CG1-CG2 4.14Å; V43-T61 HydrophobicContact CG2-CG2 4.36Å; L46-T61 WeakPolarHBondContact CB-OG1 3.32Å; L57-T61 VanDerWaalsContact O-CB 3.31Å; L57-T61 WeakPolarHBondContact O-CB 3.32Å; L57-T61 PolarHBondContact O-N 3.13Å; L57-T61 PolarHBondContact O-OG1 3.19Å; I58-T61 PolarHBondContact O-N 2.9Å; I58-T61 VanDerWaalsContact O-N 3.11Å; Y59-T61 VanDerWaalsContact C-N 3.32Å; Y59-T61 PolarHBondContact O-N 3.35Å; T61-I65 HydrophobicContact CG2-CD1 4.24Å; T61-I65 WeakPolarHBondContact O-CD1 3.38Å; T61-I65 VanDerWaalsContact O-CG1 3.31Å; T61-I65 WeakPolarHBondContact O-CG1 3.3Å; T61-I65 PolarHBondContact O-N 3.06Å
62V95.9Very high90.5Very high20 Ų2032.8 Ų32.812%0.12116%0.161CC..Hα-helixtrans-70.3-38.2176.9178.40000111I58 Y59 I65 V66 L115 W143 I146I58-V62 WeakPolarHBondContact O-CG2 3.28Å; I58-V62 PolarHBondContact O-N 3.05Å; Y59-V62 PolarHBondContact O-N 3.38Å; V62-I65 WeakPolarHBondContact O-CB 3.22Å; V62-I65 PolarHBondContact O-N 3.48Å; V62-I65 VanDerWaalsContact O-N 3.11Å; V62-V66 HydrophobicContact CG1-CG2 4.22Å; V62-V66 WeakPolarHBondContact O-CG2 3.32Å; V62-V66 PolarHBondContact O-N 2.99Å; V62-L115 HydrophobicContact CB-CD1 4.48Å; V62-L115 HydrophobicContact CG1-CD1 3.86Å; V62-L115 HydrophobicContact CG1-CD2 4.42Å; V62-W143 HydrophobicContact CG2-CH2 4.03Å; V62-W143 HydrophobicContact CG2-CZ3 4.08Å; V62-I146 HydrophobicContact CB-CD1 4.43Å; V62-I146 HydrophobicContact CG1-CG2 4Å; V62-I146 HydrophobicContact CG2-CD1 4.11Å
63L95.9Very high92.1Very high1 Ų129.5 Ų29.51%0.00515%0.147CC..Hα-helixtrans-53-56.6171.617858.6000110.6Y59 L60 I65 V66 D67 S112 L115Y59-L63 VanDerWaalsContact O-CB 3.22Å; Y59-L63 WeakPolarHBondContact O-CB 3.25Å; Y59-L63 PolarHBondContact O-N 2.8Å; L60-L63 HydrophobicContact CD2-CD2 4.38Å; L63-I65 PolarHBondContact O-N 2.81Å; L63-I65 VanDerWaalsContact O-N 3.12Å; L63-V66 PolarHBondContact O-N 3.06Å; L63-D67 PolarHBondContact O-N 3.35Å; L63-D67 VanDerWaalsContact O-OD2 3.12Å; L63-S112 WeakPolarHBondContact CD1-O 3.49Å; L63-S112 VanDerWaalsContact CD1-OG 3.24Å; L63-S112 WeakPolarHBondContact CD1-OG 3.39Å; L63-L115 HydrophobicContact CB-CB 4.36Å; L63-L115 HydrophobicContact CD1-CB 4.15Å
64A96Very high93.5Very high0 Ų020.8 Ų20.80%011%0.107CC..Hα-helixtrans-59.2-28.2177.700000114.1N39 T42 V43 L60 I68N39-A64 HydrophobicContact CB-CB 4.05Å; N39-A64 WeakPolarHBondContact CB-O 3.49Å; T42-A64 HydrophobicContact CG2-CB 3.94Å; V43-A64 HydrophobicContact CG2-CB 3.9Å; L60-A64 PolarHBondContact O-N 2.97Å; A64-I68 WeakPolarHBondContact O-CD1 3.49Å; A64-I68 VanDerWaalsContact O-CG1 3.25Å; A64-I68 WeakPolarHBondContact O-CG1 3.38Å; A64-I68 PolarHBondContact O-N 3Å
65I97Very high94.3Very high62 Ų6220.2 Ų20.232%0.31810%0.103SC..Hα-helixtrans-73.9-43.6173.5-69.5165.4000111V43 T61 V62 L63 I68 F69V43-I65 HydrophobicContact CG2-CD1 4.41Å; V43-I65 HydrophobicContact CG2-CG1 3.73Å; T61-I65 HydrophobicContact CG2-CD1 4.24Å; T61-I65 WeakPolarHBondContact O-CD1 3.38Å; T61-I65 VanDerWaalsContact O-CG1 3.31Å; T61-I65 WeakPolarHBondContact O-CG1 3.3Å; T61-I65 PolarHBondContact O-N 3.06Å; V62-I65 WeakPolarHBondContact O-CB 3.22Å; V62-I65 PolarHBondContact O-N 3.48Å; V62-I65 VanDerWaalsContact O-N 3.11Å; L63-I65 PolarHBondContact O-N 2.81Å; L63-I65 VanDerWaalsContact O-N 3.12Å; I65-I68 WeakPolarHBondContact O-CB 3.44Å; I65-I68 PolarHBondContact O-N 3.45Å; I65-F69 HydrophobicContact CG2-CD2 3.88Å; I65-F69 HydrophobicContact CG2-CE2 3.6Å; I65-F69 WeakPolarHBondContact O-CD2 3.42Å; I65-F69 PolarHBondContact O-N 3.32Å; I65-F69 VanDerWaalsContact O-N 3.07Å
66V97.8Very high94.6Very high8 Ų823 Ų235%0.04812%0.117CC..Hα-helixtrans-65.2-40.1177.1171.50000110.9V62 L63 I68 F69 Y70 L108 L111 L115V62-V66 HydrophobicContact CG1-CG2 4.22Å; V62-V66 WeakPolarHBondContact O-CG2 3.32Å; V62-V66 PolarHBondContact O-N 2.99Å; L63-V66 PolarHBondContact O-N 3.06Å; V66-I68 VanDerWaalsContact C-N 3.34Å; V66-I68 PolarHBondContact O-N 3.37Å; V66-F69 PolarHBondContact O-N 3.04Å; V66-F69 VanDerWaalsContact O-N 3.13Å; V66-Y70 PolarHBondContact O-N 2.98Å; V66-L108 HydrophobicContact CG1-CB 4.45Å; V66-L108 HydrophobicContact CG1-CD2 4.14Å; V66-L108 WeakPolarHBondContact CG1-O 3.26Å; V66-L111 HydrophobicContact CG1-CB 4.05Å; V66-L111 HydrophobicContact CG1-CD2 4.21Å; V66-L111 HydrophobicContact CG1-CG 4.06Å; V66-L111 HydrophobicContact CG2-CD2 3.61Å; V66-L111 HydrophobicContact CG2-CG 3.94Å; V66-L115 HydrophobicContact CB-CD1 4.36Å; V66-L115 HydrophobicContact CG2-CD1 3.92Å
67D97.2Very high94.8Very high0 Ų023.9 Ų23.90%012%0.123CC..Hα-helixtrans-62.1-40.3175.2-58.3-29.9000111.3N39 L63 Y70 L71 S112 F378 H381N39-D67 VanDerWaalsContact ND2-CB 3.33Å; N39-D67 WeakPolarHBondContact ND2-CB 3.5Å; L63-D67 PolarHBondContact O-N 3.35Å; L63-D67 VanDerWaalsContact O-OD2 3.12Å; D67-Y70 PolarHBondContact O-N 3.04Å; D67-L71 WeakPolarHBondContact O-CB 3.36Å; D67-L71 WeakPolarHBondContact O-CD1 3.35Å; D67-L71 WeakPolarHBondContact O-CG 3.09Å; D67-L71 PolarHBondContact O-N 3.05Å; D67-S112 WeakPolarHBondContact OD1-CB 3.5Å; D67-S112 PolarHBondContact OD1-OG 2.85Å; D67-F378 HydrophobicContact CB-CB 4.29Å; D67-F378 HydrophobicContact CB-CD1 4.4Å; D67-H381 IonicContact OD2-CD2 3.13Å
68I97.7Very high95Very high38 Ų3823.4 Ų23.420%0.19512%0.12CC..Hα-helixtrans-60.4-45.6171.7-73163.5000110.9L36 N39 A64 I65 V66 L71 L72L36-I68 HydrophobicContact CD2-CB 4.45Å; L36-I68 HydrophobicContact CD2-CG1 4.45Å; L36-I68 HydrophobicContact CD2-CG2 3.95Å; N39-I68 HydrophobicContact CB-CD1 3.84Å; N39-I68 HydrophobicContact CB-CG1 3.63Å; A64-I68 WeakPolarHBondContact O-CD1 3.49Å; A64-I68 VanDerWaalsContact O-CG1 3.25Å; A64-I68 WeakPolarHBondContact O-CG1 3.38Å; A64-I68 PolarHBondContact O-N 3Å; I65-I68 WeakPolarHBondContact O-CB 3.44Å; I65-I68 PolarHBondContact O-N 3.45Å; V66-I68 VanDerWaalsContact C-N 3.34Å; V66-I68 PolarHBondContact O-N 3.37Å; I68-L71 PolarHBondContact O-N 3.36Å; I68-L72 HydrophobicContact CG2-CD1 3.97Å; I68-L72 VanDerWaalsContact O-CG 3.31Å; I68-L72 WeakPolarHBondContact O-CG 3.19Å; I68-L72 PolarHBondContact O-N 3.12Å; I68-L72 VanDerWaalsContact O-N 3.1Å
69F97.5Very high95.1Very high112 Ų11222.8 Ų22.849%0.49112%0.117SC..Hα-helixtrans-63.2-46.2177.6-76.7-64.6000111.9I65 V66 L71 L72 T73 L108I65-F69 HydrophobicContact CG2-CD2 3.88Å; I65-F69 HydrophobicContact CG2-CE2 3.6Å; I65-F69 WeakPolarHBondContact O-CD2 3.42Å; I65-F69 PolarHBondContact O-N 3.32Å; I65-F69 VanDerWaalsContact O-N 3.07Å; V66-F69 PolarHBondContact O-N 3.04Å; V66-F69 VanDerWaalsContact O-N 3.13Å; F69-L71 VanDerWaalsContact C-N 3.33Å; F69-L71 PolarHBondContact O-N 3.4Å; F69-L72 CarbonylContact O-C 3.56Å; F69-L72 PolarHBondContact O-N 3.48Å; F69-T73 WeakPolarHBondContact O-CG2 3.34Å; F69-T73 PolarHBondContact O-N 2.94Å; F69-T73 PolarHBondContact O-OG1 3.41Å; F69-T73 VanDerWaalsContact O-OG1 3.12Å; F69-L108 HydrophobicContact CB-CD1 3.87Å; F69-L108 HydrophobicContact CB-CD2 4.1Å
70Y97.2Very high95.1Very high2 Ų224.7 Ų24.71%0.00813%0.128CC..Hα-helixtrans-62.6-37.2177.9-176.3-108.9000112.7V66 D67 L72 T73 G74 L75 S105 L108 A109 W374 Y375 F378 I497V66-Y70 PolarHBondContact O-N 2.98Å; D67-Y70 PolarHBondContact O-N 3.04Å; Y70-L72 VanDerWaalsContact C-N 3.28Å; Y70-L72 PolarHBondContact O-N 2.94Å; Y70-T73 PolarHBondContact O-N 3.03Å; Y70-G74 WeakPolarHBondContact O-CA 3.46Å; Y70-G74 PolarHBondContact O-N 3.4Å; Y70-L75 PolarHBondContact O-N 2.96Å; Y70-S105 VanDerWaalsContact CE2-O 3.3Å; Y70-S105 WeakPolarHBondContact CE2-O 3.3Å; Y70-L108 HydrophobicContact CD2-CB 4.13Å; Y70-A109 HydrophobicContact CD2-CB 4.36Å; Y70-A109 HydrophobicContact CE2-CB 4.04Å; Y70-W374 AromaticContact CE1-NE1 3.85Å; Y70-W374 AromaticContact CZ-NE1 3.72Å; Y70-W374 PolarHBondContact OH-NE1 2.82Å; Y70-Y375 HydrophobicContact CD1-CE1 4.47Å; Y70-Y375 AromaticContact CE1-CD1 3.7Å; Y70-Y375 HydrophobicContact CE1-CD1 3.7Å; Y70-Y375 AromaticContact CE1-CE1 3.49Å; Y70-Y375 HydrophobicContact CE1-CE1 3.49Å; Y70-Y375 VanDerWaalsContact CE1-CE1 3.49Å; Y70-Y375 AromaticContact CZ-CE1 3.65Å; Y70-Y375 WeakPolarHBondContact OH-CE1 3.14Å; Y70-F378 AromaticContact CD1-CD1 3.61Å; Y70-F378 HydrophobicContact CD1-CD1 3.61Å; Y70-F378 AromaticContact CD1-CD2 3.73Å; Y70-F378 HydrophobicContact CD1-CD2 3.73Å; Y70-F378 AromaticContact CD1-CE1 3.53Å; Y70-F378 HydrophobicContact CD1-CE1 3.53Å; Y70-F378 AromaticContact CD1-CE2 3.68Å; Y70-F378 HydrophobicContact CD1-CE2 3.68Å; Y70-F378 AromaticContact CD1-CG 3.71Å; Y70-F378 HydrophobicContact CD1-CG 3.71Å; Y70-F378 AromaticContact CD1-CZ 3.57Å; Y70-F378 HydrophobicContact CD1-CZ 3.57Å; Y70-F378 HydrophobicContact CE1-CD1 4.34Å; Y70-F378 AromaticContact CE1-CD2 3.75Å; Y70-F378 HydrophobicContact CE1-CD2 3.75Å; Y70-F378 AromaticContact CE1-CE1 4Å; Y70-F378 HydrophobicContact CE1-CE1 4Å; Y70-F378 AromaticContact CE1-CE2 3.38Å; Y70-F378 HydrophobicContact CE1-CE2 3.38Å; Y70-F378 HydrophobicContact CE1-CG 4.23Å; Y70-F378 AromaticContact CE1-CZ 3.51Å; Y70-F378 HydrophobicContact CE1-CZ 3.51Å; Y70-F378 HydrophobicContact CG-CD1 4.32Å; Y70-F378 HydrophobicContact CG-CE1 4.13Å; Y70-F378 HydrophobicContact CG-CZ 4.42Å; Y70-I497 PolarHBondContact OH-O 3.29Å; Y70-I497 VanDerWaalsContact OH-O 3.09Å
71L97.1Very high94.9Very high0 Ų024.6 Ų24.60%013%0.128CC..Iπ-helixtrans-63.8-32.5172.9-70.7166.3000112.3I31 L32 L36 D67 I68 F69 L75 L76 F378I31-L71 HydrophobicContact CG2-CD2 4.32Å; L32-L71 HydrophobicContact CD1-CB 4.06Å; L32-L71 WeakPolarHBondContact CD1-O 3.18Å; L36-L71 HydrophobicContact CD2-CB 4.14Å; L36-L71 HydrophobicContact CD2-CD1 4.49Å; D67-L71 WeakPolarHBondContact O-CB 3.36Å; D67-L71 WeakPolarHBondContact O-CD1 3.35Å; D67-L71 WeakPolarHBondContact O-CG 3.09Å; D67-L71 PolarHBondContact O-N 3.05Å; I68-L71 PolarHBondContact O-N 3.36Å; F69-L71 VanDerWaalsContact C-N 3.33Å; F69-L71 PolarHBondContact O-N 3.4Å; L71-L75 HydrophobicContact CD2-CB 4.23Å; L71-L75 HydrophobicContact CD2-CD2 3.48Å; L71-L75 VanDerWaalsContact CD2-CD2 3.48Å; L71-L76 PolarHBondContact O-N 3.33Å; L71-F378 HydrophobicContact CD1-CB 4.42Å; L71-F378 HydrophobicContact CD2-CB 4.12Å; L71-F378 HydrophobicContact CG-CB 4.13Å
72L96.1Very high94.6Very high74 Ų7423.8 Ų23.839%0.38712%0.122SC..Iπ-helixtrans-85.3-27.2178.3-67.6173.3000114.3L36 I68 F69 Y70 L76L36-L72 HydrophobicContact CD1-CD2 4.06Å; L36-L72 HydrophobicContact CD2-CD1 4.41Å; L36-L72 HydrophobicContact CD2-CD2 3.99Å; L36-L72 HydrophobicContact CD2-CG 3.92Å; I68-L72 HydrophobicContact CG2-CD1 3.97Å; I68-L72 VanDerWaalsContact O-CG 3.31Å; I68-L72 WeakPolarHBondContact O-CG 3.19Å; I68-L72 PolarHBondContact O-N 3.12Å; I68-L72 VanDerWaalsContact O-N 3.1Å; F69-L72 CarbonylContact O-C 3.56Å; F69-L72 PolarHBondContact O-N 3.48Å; Y70-L72 VanDerWaalsContact C-N 3.28Å; Y70-L72 PolarHBondContact O-N 2.94Å; L72-L76 HydrophobicContact CD2-CD2 4.37Å; L72-L76 WeakPolarHBondContact O-CB 3.42Å
73T93.1Very high94.3Very high30 Ų3025.1 Ų25.118%0.18413%0.13CC..Iπ-helixtrans-100.7-34.4-178.561.30000113.7F69 Y70 V77 L104 L108F69-T73 WeakPolarHBondContact O-CG2 3.34Å; F69-T73 PolarHBondContact O-N 2.94Å; F69-T73 PolarHBondContact O-OG1 3.41Å; F69-T73 VanDerWaalsContact O-OG1 3.12Å; Y70-T73 PolarHBondContact O-N 3.03Å; T73-V77 WeakPolarHBondContact O-CB 3.45Å; T73-V77 WeakPolarHBondContact O-CG2 3.3Å; T73-L104 HydrophobicContact CG2-CB 4.47Å; T73-L104 HydrophobicContact CG2-CD1 4.03Å; T73-L108 HydrophobicContact CG2-CD1 4.23Å; T73-L108 WeakPolarHBondContact OG1-CD1 3.34Å
74G92.4Very high94Very high0 Ų032.7 Ų32.70%016%0.163CC..Iπ-helixtrans-94.3-72.7177.300000111.3Y70 L76 V77 T78Y70-G74 WeakPolarHBondContact O-CA 3.46Å; Y70-G74 PolarHBondContact O-N 3.4Å; G74-L76 PolarHBondContact O-N 3.3Å; G74-V77 WeakPolarHBondContact O-CB 3.23Å; G74-V77 PolarHBondContact O-N 3.4Å; G74-T78 PolarHBondContact O-N 2.9Å; G74-T78 PolarHBondContact O-OG1 3.38Å
75L94.8Very high93.6Very high0 Ų034.4 Ų34.40%017%0.172CC..Iπ-helixtrans-58.9-42.3-171.8-179.659.9000113.4Y28 I31 L32 Y70 L71 T78 I79 Y375Y28-L75 HydrophobicContact CD1-CD1 3.52Å; Y28-L75 HydrophobicContact CE1-CD1 4.32Å; Y28-L75 HydrophobicContact CG-CD1 3.94Å; I31-L75 HydrophobicContact CB-CD2 4.06Å; I31-L75 HydrophobicContact CG2-CD2 3.62Å; L32-L75 HydrophobicContact CB-CD2 3.86Å; L32-L75 HydrophobicContact CB-CG 4.48Å; L32-L75 HydrophobicContact CD1-CD2 4.34Å; Y70-L75 PolarHBondContact O-N 2.96Å; L71-L75 HydrophobicContact CD2-CB 4.23Å; L71-L75 HydrophobicContact CD2-CD2 3.48Å; L71-L75 VanDerWaalsContact CD2-CD2 3.48Å; L75-T78 WeakPolarHBondContact O-CB 3.49Å; L75-T78 PolarHBondContact O-N 3.44Å; L75-I79 HydrophobicContact CD1-CD1 4.29Å; L75-I79 HydrophobicContact CD1-CG1 4.45Å; L75-I79 HydrophobicContact CG-CD1 4.02Å; L75-I79 WeakPolarHBondContact O-CG1 3.1Å; L75-I79 PolarHBondContact O-N 3.3Å; L75-Y375 HydrophobicContact CB-CD1 3.76Å; L75-Y375 HydrophobicContact CB-CE1 3.77Å; L75-Y375 HydrophobicContact CB-CG 4.49Å; L75-Y375 HydrophobicContact CD1-CD1 3.95Å; L75-Y375 HydrophobicContact CD1-CD2 4.02Å; L75-Y375 HydrophobicContact CD1-CE1 4.28Å; L75-Y375 HydrophobicContact CD1-CE2 4.4Å; L75-Y375 HydrophobicContact CD1-CG 3.82Å; L75-Y375 HydrophobicContact CG-CD1 4.29Å
76L94.8Very high93Very high59 Ų5933 Ų3331%0.30916%0.164SC..Hα-helixtrans-64.1-38.3176.3178.860.2000112.4L32 L71 L72 G74 I79 I80L32-L76 HydrophobicContact CD2-CD1 4.08Å; L71-L76 PolarHBondContact O-N 3.33Å; L72-L76 HydrophobicContact CD2-CD2 4.37Å; L72-L76 WeakPolarHBondContact O-CB 3.42Å; G74-L76 PolarHBondContact O-N 3.3Å; L76-I79 PolarHBondContact O-N 3.49Å; L76-I80 HydrophobicContact CD1-CD1 4.31Å; L76-I80 HydrophobicContact CG-CD1 4.13Å; L76-I80 VanDerWaalsContact O-CG1 3.3Å; L76-I80 WeakPolarHBondContact O-CG1 3.37Å; L76-I80 PolarHBondContact O-N 3.37Å
77V92.8Very high91.8Very high19 Ų1934.4 Ų34.412%0.11517%0.173CC..Hα-helixtrans-66-43173.8165.90000110.8T73 G74 I79 I80 N81 I90 T101T73-V77 WeakPolarHBondContact O-CB 3.45Å; T73-V77 WeakPolarHBondContact O-CG2 3.3Å; G74-V77 WeakPolarHBondContact O-CB 3.23Å; G74-V77 PolarHBondContact O-N 3.4Å; V77-I79 VanDerWaalsContact C-N 3.32Å; V77-I79 PolarHBondContact O-N 2.89Å; V77-I80 PolarHBondContact O-N 2.98Å; V77-I80 VanDerWaalsContact O-N 3.16Å; V77-N81 WeakPolarHBondContact O-CB 3.25Å; V77-N81 PolarHBondContact O-N 2.86Å; V77-I90 HydrophobicContact CG1-CG2 3.61Å; V77-T101 HydrophobicContact CG1-CG2 3.94Å
78T91.3Very high91Very high2 Ų236.5 Ų36.51%0.01219%0.188CC..Hα-helixtrans-56.7-44.2172.4-66.70000111.2Y28 G74 L75 N81 Y82 Y375Y28-T78 HydrophobicContact CE2-CG2 4.22Å; G74-T78 PolarHBondContact O-N 2.9Å; G74-T78 PolarHBondContact O-OG1 3.38Å; L75-T78 WeakPolarHBondContact O-CB 3.49Å; L75-T78 PolarHBondContact O-N 3.44Å; T78-N81 PolarHBondContact O-N 2.89Å; T78-Y82 HydrophobicContact CG2-CD2 3.83Å; T78-Y82 HydrophobicContact CG2-CE2 4.09Å; T78-Y82 VanDerWaalsContact O-CD2 3.29Å; T78-Y82 WeakPolarHBondContact O-CD2 3.24Å; T78-Y82 PolarHBondContact O-N 3.5Å; T78-Y375 HydrophobicContact CG2-CE2 4.32Å; T78-Y375 PolarHBondContact OG1-OH 2.96Å; T78-Y375 VanDerWaalsContact OG1-OH 3.12Å
79I93.3Very high90.4Very high11 Ų1134.8 Ų34.86%0.05618%0.179CC..Hα-helixtrans-62.7-43.5175.2-69.4159.4000111.7Y28 L29 L32 L75 L76 V77 T83Y28-I79 HydrophobicContact CG-CG1 4.48Å; L29-I79 HydrophobicContact CD2-CD1 4.28Å; L29-I79 HydrophobicContact CD2-CG2 4.05Å; L32-I79 HydrophobicContact CB-CD1 4.14Å; L32-I79 HydrophobicContact CD2-CD1 3.78Å; L75-I79 HydrophobicContact CD1-CD1 4.29Å; L75-I79 HydrophobicContact CD1-CG1 4.45Å; L75-I79 HydrophobicContact CG-CD1 4.02Å; L75-I79 WeakPolarHBondContact O-CG1 3.1Å; L75-I79 PolarHBondContact O-N 3.3Å; L76-I79 PolarHBondContact O-N 3.49Å; V77-I79 VanDerWaalsContact C-N 3.32Å; V77-I79 PolarHBondContact O-N 2.89Å; I79-T83 WeakPolarHBondContact O-CB 3.39Å; I79-T83 PolarHBondContact O-N 2.88Å; I79-T83 PolarHBondContact O-OG1 3.13Å
80I93.1Very high90Very high56 Ų5631.5 Ų31.529%0.28717%0.166SC..Hα-helixtrans-63.3-47.5178.3-70.4163.8000110.7L76 V77 F84 L85L76-I80 HydrophobicContact CD1-CD1 4.31Å; L76-I80 HydrophobicContact CG-CD1 4.13Å; L76-I80 VanDerWaalsContact O-CG1 3.3Å; L76-I80 WeakPolarHBondContact O-CG1 3.37Å; L76-I80 PolarHBondContact O-N 3.37Å; V77-I80 PolarHBondContact O-N 2.98Å; V77-I80 VanDerWaalsContact O-N 3.16Å; I80-F84 PolarHBondContact O-N 3.47Å; I80-L85 HydrophobicContact CG2-CD1 4.24Å; I80-L85 HydrophobicContact CG2-CG 4.46Å; I80-L85 PolarHBondContact O-N 2.99Å
81N90Very high89.7Confident2 Ų231.7 Ų31.71%0.01117%0.167CC..Iπ-helixtrans-56.7-54.8176.4-75.4-10.6000110.8V77 T78 T83 L85 F86 D89 I90V77-N81 WeakPolarHBondContact O-CB 3.25Å; V77-N81 PolarHBondContact O-N 2.86Å; T78-N81 PolarHBondContact O-N 2.89Å; N81-T83 PolarHBondContact O-N 3.14Å; N81-L85 PolarHBondContact O-N 2.89Å; N81-F86 PolarHBondContact O-N 2.76Å; N81-D89 PolarHBondContact ND2-OD1 3.3Å; N81-D89 PolarHBondContact ND2-OD2 2.92Å; N81-I90 WeakPolarHBondContact OD1-CB 3.22Å; N81-I90 PolarHBondContact OD1-N 3.13Å
82Y86.6Confident89.4Confident4 Ų432.9 Ų32.92%0.01617%0.172CC..Iπ-helixtrans-70.4-31.9-177-82.3-73.1000114.5K21 T78 F86 F364 R368 T494K21-Y82 VanDerWaalsContact CD-O 3.25Å; K21-Y82 WeakPolarHBondContact CD-O 3.46Å; K21-Y82 VanDerWaalsContact CE-O 3.29Å; K21-Y82 WeakPolarHBondContact CE-O 3.43Å; K21-Y82 HydrophobicContact CG-CD1 4.19Å; K21-Y82 PolarHBondContact NZ-O 3.44Å; T78-Y82 HydrophobicContact CG2-CD2 3.83Å; T78-Y82 HydrophobicContact CG2-CE2 4.09Å; T78-Y82 VanDerWaalsContact O-CD2 3.29Å; T78-Y82 WeakPolarHBondContact O-CD2 3.24Å; T78-Y82 PolarHBondContact O-N 3.5Å; Y82-F86 AromaticContact CD1-CD2 3.63Å; Y82-F86 HydrophobicContact CD1-CD2 3.63Å; Y82-F86 AromaticContact CD1-CE2 3.99Å; Y82-F86 HydrophobicContact CD1-CE2 3.99Å; Y82-F86 AromaticContact CE1-CD2 3.62Å; Y82-F86 HydrophobicContact CE1-CD2 3.62Å; Y82-F86 AromaticContact CE1-CE2 3.54Å; Y82-F86 HydrophobicContact CE1-CE2 3.54Å; Y82-F364 HydrophobicContact CE1-CE2 4.05Å; Y82-F364 AromaticContact CE1-CZ 3.92Å; Y82-F364 HydrophobicContact CE1-CZ 3.92Å; Y82-R368 VanDerWaalsContact OH-CD 3.29Å; Y82-R368 WeakPolarHBondContact OH-CD 3.49Å; Y82-R368 PolarHBondContact OH-NE 3.01Å; Y82-R368 PolarHBondContact OH-NH1 2.88Å; Y82-R368 PolarHBondContact OH-NH2 3.19Å; Y82-T494 PolarHBondContact OH-OG1 3.31Å
83T89.3Confident89.1Confident47 Ų4736 Ų3629%0.28818%0.18SC..Iπ-helixtrans-80-49.9-179.3-53.10000111.5I79 N81I79-T83 WeakPolarHBondContact O-CB 3.39Å; I79-T83 PolarHBondContact O-N 2.88Å; I79-T83 PolarHBondContact O-OG1 3.13Å; N81-T83 PolarHBondContact O-N 3.14Å
84F89.4Confident89.1Confident160 Ų16036.3 Ų36.370%0.70218%0.184SC*.Iπ-helixtrans-112.9-32.2-164.5-58.6-71.2000115.5I80I80-F84 PolarHBondContact O-N 3.47Å
85L86.9Confident89.1Confident37 Ų3741 Ų4119%0.19421%0.208CC..Iπ-helixtrans-100.4-22.2-172.3-53.6-179.1000113.4I80 N81 S88 I90 Y93I80-L85 HydrophobicContact CG2-CD1 4.24Å; I80-L85 HydrophobicContact CG2-CG 4.46Å; I80-L85 PolarHBondContact O-N 2.99Å; N81-L85 PolarHBondContact O-N 2.89Å; L85-S88 CarbonylContact C-O 3.59Å; L85-S88 WeakPolarHBondContact CB-O 3.44Å; L85-S88 WeakPolarHBondContact O-CA 3.45Å; L85-S88 VanDerWaalsContact O-CB 3.32Å; L85-S88 WeakPolarHBondContact O-CB 3.37Å; L85-S88 PolarHBondContact O-N 3.3Å; L85-I90 HydrophobicContact CD1-CB 3.83Å; L85-I90 HydrophobicContact CD1-CG1 4.4Å; L85-Y93 HydrophobicContact CD1-CD2 4.35Å; L85-Y93 HydrophobicContact CD1-CE2 4Å; L85-Y93 HydrophobicContact CD2-CE2 4.12Å; L85-Y93 HydrophobicContact CG-CE2 4.46Å
86F84Confident89.2Confident32 Ų3246.7 Ų46.714%0.1424%0.237CC..THydrogen-bonded Turntrans-49.7127.9-174.9-166.1-84.5000113.2L13 V17 K21 N81 Y82 F364 L487L13-F86 HydrophobicContact CD1-CE1 4.08Å; L13-F86 HydrophobicContact CD2-CD1 4.1Å; L13-F86 HydrophobicContact CD2-CE1 3.61Å; V17-F86 HydrophobicContact CG1-CE1 4.36Å; V17-F86 HydrophobicContact CG1-CZ 4.15Å; K21-F86 HydrophobicContact CD-CB 4.25Å; K21-F86 HydrophobicContact CD-CD1 4.11Å; K21-F86 HydrophobicContact CD-CG 4.04Å; N81-F86 PolarHBondContact O-N 2.76Å; Y82-F86 AromaticContact CD1-CD2 3.63Å; Y82-F86 HydrophobicContact CD1-CD2 3.63Å; Y82-F86 AromaticContact CD1-CE2 3.99Å; Y82-F86 HydrophobicContact CD1-CE2 3.99Å; Y82-F86 AromaticContact CE1-CD2 3.62Å; Y82-F86 HydrophobicContact CE1-CD2 3.62Å; Y82-F86 AromaticContact CE1-CE2 3.54Å; Y82-F86 HydrophobicContact CE1-CE2 3.54Å; F86-F364 HydrophobicContact CE2-CE2 4.01Å; F86-F364 HydrophobicContact CE2-CZ 4.21Å; F86-F364 HydrophobicContact CZ-CE2 4.06Å; F86-F364 HydrophobicContact CZ-CZ 4.19Å; F86-L487 HydrophobicContact CE1-CD2 3.93Å; F86-L487 HydrophobicContact CZ-CD2 3.71Å
87P73.5Confident89.1Confident37 Ų3745 Ų4524%0.2423%0.23CC..THydrogen-bonded Turncis-82.6-5.413.933-37000115.8M11 N490M11-P87 HydrophobicContact CE-CG 4.03Å; P87-N490 VanDerWaalsContact O-CB 3.28Å; P87-N490 WeakPolarHBondContact O-CB 3.47Å; P87-N490 PolarHBondContact O-ND2 3.47Å
88S81.1Confident89.2Confident44 Ų4444.1 Ų44.131%0.30823%0.225SC..SBendtrans-78.8168.1179.6-59.60000113.3L85L85-S88 CarbonylContact C-O 3.59Å; L85-S88 WeakPolarHBondContact CB-O 3.44Å; L85-S88 WeakPolarHBondContact O-CA 3.45Å; L85-S88 VanDerWaalsContact O-CB 3.32Å; L85-S88 WeakPolarHBondContact O-CB 3.37Å; L85-S88 PolarHBondContact O-N 3.3Å
89D84.2Confident89.4Confident2 Ų245.2 Ų45.21%0.01123%0.23CC..  trans-126.9144-177.1-173-63.5000111.1N81 R91 H92 Y93 T494N81-D89 PolarHBondContact ND2-OD1 3.3Å; N81-D89 PolarHBondContact ND2-OD2 2.92Å; D89-R91 VanDerWaalsContact CG-NE 3.3Å; D89-R91 VanDerWaalsContact CG-NH2 3.28Å; D89-R91 PolarHBondContact O-N 3.39Å; D89-R91 VanDerWaalsContact OD1-CB 3.26Å; D89-R91 WeakPolarHBondContact OD1-CB 3.45Å; D89-R91 VanDerWaalsContact OD1-CG 3.29Å; D89-R91 WeakPolarHBondContact OD1-CG 3.26Å; D89-R91 IonicContact OD1-CZ 2.76Å; D89-R91 PolarHBondContact OD1-N 3.48Å; D89-R91 IonicContact OD1-NE 3.75Å; D89-R91 PolarHBondContact OD1-NE 2.89Å; D89-R91 IonicContact OD1-NH2 3.82Å; D89-R91 IonicContact OD2-CZ 3.52Å; D89-R91 IonicContact OD2-NE 2.68Å; D89-R91 PolarHBondContact OD2-NE 3.22Å; D89-R91 IonicContact OD2-NH2 3.37Å; D89-R91 PolarHBondContact OD2-NH2 2.78Å; D89-H92 WeakPolarHBondContact O-CB 3.45Å; D89-H92 PolarHBondContact O-N 3.4Å; D89-Y93 WeakPolarHBondContact O-CD2 3.45Å; D89-T494 HydrophobicContact CB-CG2 4.44Å; D89-T494 WeakPolarHBondContact OD2-CG2 3.26Å
90I90.2Very high89.5Confident43 Ų4347.9 Ų47.922%0.22125%0.245CC..G310 helixtrans-51.3-30.9177-162.2168.7000113.6V77 N81 L85 H92 Y93 S97V77-I90 HydrophobicContact CG1-CG2 3.61Å; N81-I90 WeakPolarHBondContact OD1-CB 3.22Å; N81-I90 PolarHBondContact OD1-N 3.13Å; L85-I90 HydrophobicContact CD1-CB 3.83Å; L85-I90 HydrophobicContact CD1-CG1 4.4Å; I90-H92 PolarHBondContact O-N 3.48Å; I90-H92 VanDerWaalsContact O-N 3.17Å; I90-Y93 PolarHBondContact O-N 2.96Å; I90-S97 VanDerWaalsContact O-CB 3.25Å; I90-S97 WeakPolarHBondContact O-CB 3.37Å
91R90.2Very high89.5Confident6 Ų646 Ų462%0.02324%0.236CC..G310 helixtrans-60.6-22176.3-70.3174.1-61.9158.97.2113.5D89 C98 T101 C182 Q493 I497D89-R91 VanDerWaalsContact CG-NE 3.3Å; D89-R91 VanDerWaalsContact CG-NH2 3.28Å; D89-R91 PolarHBondContact O-N 3.39Å; D89-R91 VanDerWaalsContact OD1-CB 3.26Å; D89-R91 WeakPolarHBondContact OD1-CB 3.45Å; D89-R91 VanDerWaalsContact OD1-CG 3.29Å; D89-R91 WeakPolarHBondContact OD1-CG 3.26Å; D89-R91 IonicContact OD1-CZ 2.76Å; D89-R91 PolarHBondContact OD1-N 3.48Å; D89-R91 IonicContact OD1-NE 3.75Å; D89-R91 PolarHBondContact OD1-NE 2.89Å; D89-R91 IonicContact OD1-NH2 3.82Å; D89-R91 IonicContact OD2-CZ 3.52Å; D89-R91 IonicContact OD2-NE 2.68Å; D89-R91 PolarHBondContact OD2-NE 3.22Å; D89-R91 IonicContact OD2-NH2 3.37Å; D89-R91 PolarHBondContact OD2-NH2 2.78Å; R91-C98 WeakPolarHBondContact O-CB 3.48Å; R91-T101 HydrophobicContact CG-CG2 4.1Å; R91-C182 HydrophobicContact CB-CB 3.92Å; R91-C182 WeakPolarHBondContact O-CB 3.38Å; R91-Q493 PolarHBondContact NH1-O 2.93Å; R91-Q493 VanDerWaalsContact NH1-O 3.15Å; R91-Q493 PolarHBondContact NH2-O 3.49Å; R91-I497 VanDerWaalsContact CZ-CD1 3.49Å
92H90.2Very high89.7Confident25 Ų2546 Ų4612%0.11624%0.236CC..G310 helixtrans-85.1-9.2177.1-61.1-1.1000113.3D89 I90 Y166 C182 Q493D89-H92 WeakPolarHBondContact O-CB 3.45Å; D89-H92 PolarHBondContact O-N 3.4Å; I90-H92 PolarHBondContact O-N 3.48Å; I90-H92 VanDerWaalsContact O-N 3.17Å; H92-Y166 PolarHBondContact O-OH 3.1Å; H92-C182 PolarHBondContact ND1-N 3.39Å; H92-Q493 PolarHBondContact CE1-OE1 3.4Å
93Y89.6Confident90.1Very high140 Ų14047.1 Ų47.155%0.54924%0.24SC..THydrogen-bonded Turntrans-92.9-18-178-68.9-99000113.9L85 D89 I90 Y166L85-Y93 HydrophobicContact CD1-CD2 4.35Å; L85-Y93 HydrophobicContact CD1-CE2 4Å; L85-Y93 HydrophobicContact CD2-CE2 4.12Å; L85-Y93 HydrophobicContact CG-CE2 4.46Å; D89-Y93 WeakPolarHBondContact O-CD2 3.45Å; I90-Y93 PolarHBondContact O-N 2.96Å; Y93-Y166 PolarHBondContact O-OH 3.44Å
94S92.7Very high90.4Very high37 Ų3746.9 Ų46.926%0.25924%0.237SC..  trans-157.9152.6172.280.80000113.7I96 S97 C98 Y166S94-I96 PolarHBondContact O-N 3.23Å; S94-I96 PolarHBondContact OG-N 3.08Å; S94-S97 PolarHBondContact O-N 2.64Å; S94-S97 WeakPolarHBondContact OG-CB 3.43Å; S94-S97 PolarHBondContact OG-N 3.09Å; S94-S97 PolarHBondContact OG-OG 3.38Å; S94-C98 WeakPolarHBondContact O-CB 3.49Å; S94-C98 PolarHBondContact O-N 3.16Å; S94-Y166 PolarHBondContact N-OH 3.06Å
95L94.1Very high90.6Very high97 Ų9739.4 Ų39.451%0.50820%0.204SC..Hα-helixtrans-53.5-39.5168.6174.765.7000112.2C98 I99 Y166L95-C98 PolarHBondContact O-N 2.94Å; L95-I99 HydrophobicContact CD1-CD1 3.73Å; L95-I99 HydrophobicContact CD1-CG1 4.42Å; L95-I99 HydrophobicContact CG-CD1 4.29Å; L95-I99 PolarHBondContact O-N 2.89Å; L95-Y166 HydrophobicContact CB-CD1 4.1Å; L95-Y166 HydrophobicContact CB-CG 4.16Å; L95-Y166 HydrophobicContact CD1-CG 4.43Å
96I95.5Very high91Very high121 Ų12139 Ų3962%0.62120%0.2SC*.Hα-helixtrans-63.2-49.7179.2-60.4175.7000109.6S94 C98 I99 L100S94-I96 PolarHBondContact O-N 3.23Å; S94-I96 PolarHBondContact OG-N 3.08Å; I96-C98 PolarHBondContact O-N 2.55Å; I96-I99 PolarHBondContact O-N 3.2Å; I96-L100 HydrophobicContact CG2-CB 4.42Å; I96-L100 HydrophobicContact CG2-CD2 4.16Å; I96-L100 WeakPolarHBondContact O-CB 3.24Å; I96-L100 PolarHBondContact O-N 2.86Å
97S93.1Very high91.6Very high23 Ų2337.4 Ų37.416%0.16119%0.194CC..Hα-helixtrans-60.2-46.2176.6-54.60000111.2I90 S94 I99 L100 T101I90-S97 VanDerWaalsContact O-CB 3.25Å; I90-S97 WeakPolarHBondContact O-CB 3.37Å; S94-S97 PolarHBondContact O-N 2.64Å; S94-S97 WeakPolarHBondContact OG-CB 3.43Å; S94-S97 PolarHBondContact OG-N 3.09Å; S94-S97 PolarHBondContact OG-OG 3.38Å; S97-I99 VanDerWaalsContact C-N 3.29Å; S97-I99 PolarHBondContact O-N 3.41Å; S97-L100 PolarHBondContact O-N 3.17Å; S97-T101 VanDerWaalsContact O-CB 3.25Å; S97-T101 WeakPolarHBondContact O-CB 3.3Å; S97-T101 PolarHBondContact O-N 3.28Å; S97-T101 VanDerWaalsContact O-N 3.08Å; S97-T101 PolarHBondContact O-OG1 3.04Å
98C95Very high92.7Very high0 Ų036.3 Ų36.30%019%0.186CC..Hα-helixtrans-53.5-41.8-179.6-179.90000113.7R91 S94 L95 I96 P102 Y166 C182R91-C98 WeakPolarHBondContact O-CB 3.48Å; S94-C98 WeakPolarHBondContact O-CB 3.49Å; S94-C98 PolarHBondContact O-N 3.16Å; L95-C98 PolarHBondContact O-N 2.94Å; I96-C98 PolarHBondContact O-N 2.55Å; C98-P102 WeakPolarHBondContact O-CD 3.39Å; C98-P102 WeakPolarHBondContact O-CG 3.42Å; C98-Y166 HydrophobicContact CB-CD2 3.91Å; C98-C182 WeakPolarHBondContact CA-SG 3.48Å; C98-C182 HydrophobicContact CB-CB 3.72Å; C98-C182 WeakPolarHBondContact CB-SG 3.25Å; C98-C182 PolarHBondContact O-SG 2.94Å; C98-C182 VanDerWaalsContact O-SG 3.41Å; C98-C182 VanDerWaalsContact SG-CA 3.51Å; C98-C182 WeakPolarHBondContact SG-CB 3.48Å; C98-C182 CovalentContact SG-SG 2.04Å; C98-C182 PolarHBondContact SG-SG 2.98Å
99I95.5Very high93.3Very high25 Ų2534.5 Ų34.513%0.12817%0.173CC..Hα-helixtrans-88.4-48179.7-64.5169.5000111.6L95 I96 S97 P102 Y103 F161 M164L95-I99 HydrophobicContact CD1-CD1 3.73Å; L95-I99 HydrophobicContact CD1-CG1 4.42Å; L95-I99 HydrophobicContact CG-CD1 4.29Å; L95-I99 PolarHBondContact O-N 2.89Å; I96-I99 PolarHBondContact O-N 3.2Å; S97-I99 VanDerWaalsContact C-N 3.29Å; S97-I99 PolarHBondContact O-N 3.41Å; I99-P102 WeakPolarHBondContact O-CD 3.31Å; I99-P102 WeakPolarHBondContact O-CG 3.36Å; I99-Y103 VanDerWaalsContact O-CB 3.29Å; I99-Y103 WeakPolarHBondContact O-CB 3.36Å; I99-Y103 PolarHBondContact O-N 3.23Å; I99-F161 HydrophobicContact CG2-CB 4.37Å; I99-F161 HydrophobicContact CG2-CD1 3.67Å; I99-F161 HydrophobicContact CG2-CD2 4.22Å; I99-F161 HydrophobicContact CG2-CE1 3.92Å; I99-F161 HydrophobicContact CG2-CE2 4.44Å; I99-F161 HydrophobicContact CG2-CG 3.83Å; I99-F161 HydrophobicContact CG2-CZ 4.31Å; I99-M164 HydrophobicContact CG1-CB 4.24Å
100L95.2Very high93.9Very high68 Ų6834.4 Ų34.436%0.35617%0.172SC..Hα-helixtrans-76.9-33.1-166.4-169.165.8000113.3I96 S97 Y103 L104I96-L100 HydrophobicContact CG2-CB 4.42Å; I96-L100 HydrophobicContact CG2-CD2 4.16Å; I96-L100 WeakPolarHBondContact O-CB 3.24Å; I96-L100 PolarHBondContact O-N 2.86Å; S97-L100 PolarHBondContact O-N 3.17Å; L100-Y103 HydrophobicContact CD1-CD1 4.23Å; L100-L104 HydrophobicContact CD1-CD1 3.86Å; L100-L104 HydrophobicContact CD1-CD2 4.3Å; L100-L104 HydrophobicContact CD1-CG 3.81Å; L100-L104 HydrophobicContact CD2-CD1 4.23Å; L100-L104 HydrophobicContact CG-CD1 3.72Å; L100-L104 HydrophobicContact CG-CG 4.03Å; L100-L104 WeakPolarHBondContact O-CB 3.38Å; L100-L104 WeakPolarHBondContact O-CG 3.29Å; L100-L104 PolarHBondContact O-N 3.32Å
101T93.9Very high94.2Very high16 Ų1632.6 Ų32.610%0.09816%0.163CC..Hα-helixtrans-61.5-54.4178.3-65.70000112.7V77 R91 S97 S105 I497V77-T101 HydrophobicContact CG1-CG2 3.94Å; R91-T101 HydrophobicContact CG-CG2 4.1Å; S97-T101 VanDerWaalsContact O-CB 3.25Å; S97-T101 WeakPolarHBondContact O-CB 3.3Å; S97-T101 PolarHBondContact O-N 3.28Å; S97-T101 VanDerWaalsContact O-N 3.08Å; S97-T101 PolarHBondContact O-OG1 3.04Å; T101-S105 WeakPolarHBondContact O-CB 3.37Å; T101-S105 PolarHBondContact O-N 2.87Å; T101-S105 VanDerWaalsContact O-N 3.13Å; T101-S105 PolarHBondContact O-OG 2.85Å; T101-I497 HydrophobicContact CG2-CD1 4.16Å; T101-I497 HydrophobicContact CG2-CG2 4.13Å
102P93.1Very high94.5Very high3 Ų332.8 Ų32.82%0.01917%0.165CC..Hα-helixtrans-66-42.8176.225.5-32.7000111.5C98 I99 L104 S105 Y106 F160 M164C98-P102 WeakPolarHBondContact O-CD 3.39Å; C98-P102 WeakPolarHBondContact O-CG 3.42Å; I99-P102 WeakPolarHBondContact O-CD 3.31Å; I99-P102 WeakPolarHBondContact O-CG 3.36Å; P102-L104 PolarHBondContact O-N 3.47Å; P102-S105 PolarHBondContact O-N 3.08Å; P102-Y106 HydrophobicContact CB-CD2 4.38Å; P102-Y106 WeakPolarHBondContact O-CD2 3.32Å; P102-Y106 PolarHBondContact O-N 3.29Å; P102-F160 HydrophobicContact CB-CD1 3.91Å; P102-F160 HydrophobicContact CB-CE1 3.86Å; P102-F160 HydrophobicContact CB-CG 4.46Å; P102-F160 HydrophobicContact CB-CZ 4.39Å; P102-F160 HydrophobicContact CG-CD1 4.09Å; P102-M164 HydrophobicContact CG-CE 4.48Å; P102-M164 HydrophobicContact CG-CG 4.09Å; P102-M164 HydrophobicContact CG-SD 4.46Å
103Y96.1Very high94.7Very high27 Ų2731.6 Ų31.611%0.10616%0.16CC..Hα-helixtrans-53.7-52.5179.3178.7-114.8000112.6I99 L100 T107 F154 D157 F160 F161I99-Y103 VanDerWaalsContact O-CB 3.29Å; I99-Y103 WeakPolarHBondContact O-CB 3.36Å; I99-Y103 PolarHBondContact O-N 3.23Å; L100-Y103 HydrophobicContact CD1-CD1 4.23Å; Y103-T107 VanDerWaalsContact O-CB 3.25Å; Y103-T107 WeakPolarHBondContact O-CB 3.49Å; Y103-T107 PolarHBondContact O-N 3.39Å; Y103-T107 VanDerWaalsContact O-N 3.07Å; Y103-T107 PolarHBondContact O-OG1 3.19Å; Y103-F154 HydrophobicContact CE1-CD1 4.41Å; Y103-F154 WeakPolarHBondContact OH-CD1 3.48Å; Y103-F154 PolarHBondContact OH-O 3.27Å; Y103-D157 HydrophobicContact CD2-CB 3.87Å; Y103-D157 VanDerWaalsContact CD2-O 3.27Å; Y103-D157 WeakPolarHBondContact CD2-O 3.35Å; Y103-D157 HydrophobicContact CE2-CB 3.8Å; Y103-F160 HydrophobicContact CD2-CB 4.48Å; Y103-F160 HydrophobicContact CD2-CD2 4.38Å; Y103-F161 AromaticContact CD1-CE2 3.82Å; Y103-F161 HydrophobicContact CD1-CE2 3.82Å; Y103-F161 HydrophobicContact CD1-CZ 4.2Å; Y103-F161 HydrophobicContact CD2-CD2 4.44Å; Y103-F161 AromaticContact CD2-CE2 3.95Å; Y103-F161 HydrophobicContact CD2-CE2 3.95Å; Y103-F161 AromaticContact CE1-CE2 3.84Å; Y103-F161 HydrophobicContact CE1-CE2 3.84Å; Y103-F161 HydrophobicContact CE1-CZ 4.25Å; Y103-F161 AromaticContact CE2-CE2 3.98Å; Y103-F161 HydrophobicContact CE2-CE2 3.98Å; Y103-F161 AromaticContact CG-CE2 3.86Å; Y103-F161 HydrophobicContact CG-CE2 3.86Å; Y103-F161 AromaticContact CZ-CE2 3.92Å
104L95.8Very high95.1Very high42 Ų4227.3 Ų27.322%0.2214%0.143CC..Hα-helixtrans-69.3-37.3180-67.6-179.3000112.5T73 L100 P102 L108T73-L104 HydrophobicContact CG2-CB 4.47Å; T73-L104 HydrophobicContact CG2-CD1 4.03Å; L100-L104 HydrophobicContact CD1-CD1 3.86Å; L100-L104 HydrophobicContact CD1-CD2 4.3Å; L100-L104 HydrophobicContact CD1-CG 3.81Å; L100-L104 HydrophobicContact CD2-CD1 4.23Å; L100-L104 HydrophobicContact CG-CD1 3.72Å; L100-L104 HydrophobicContact CG-CG 4.03Å; L100-L104 WeakPolarHBondContact O-CB 3.38Å; L100-L104 WeakPolarHBondContact O-CG 3.29Å; L100-L104 PolarHBondContact O-N 3.32Å; P102-L104 PolarHBondContact O-N 3.47Å; L104-L108 HydrophobicContact CB-CD1 4.35Å; L104-L108 WeakPolarHBondContact O-CB 3.42Å; L104-L108 WeakPolarHBondContact O-CD1 3.41Å; L104-L108 WeakPolarHBondContact O-CG 3.22Å; L104-L108 PolarHBondContact O-N 2.91Å
105S93.2Very high95.3Very high2 Ų225.5 Ų25.51%0.01413%0.131CC..Hα-helixtrans-65-51.6-178.8-58.50000111.4Y70 T101 P102 A109 I497Y70-S105 VanDerWaalsContact CE2-O 3.3Å; Y70-S105 WeakPolarHBondContact CE2-O 3.3Å; T101-S105 WeakPolarHBondContact O-CB 3.37Å; T101-S105 PolarHBondContact O-N 2.87Å; T101-S105 VanDerWaalsContact O-N 3.13Å; T101-S105 PolarHBondContact O-OG 2.85Å; P102-S105 PolarHBondContact O-N 3.08Å; S105-A109 WeakPolarHBondContact O-CB 3.34Å; S105-A109 PolarHBondContact O-N 3.37Å; S105-I497 VanDerWaalsContact OG-CG2 3.31Å; S105-I497 WeakPolarHBondContact OG-CG2 3.19Å
106Y94.1Very high95.3Very high28 Ų2821.1 Ų21.111%0.1111%0.107CC..Hα-helixtrans-62.8-50.4176.6-80-72.2000112P102 L108 A109 Y110 F160 F192 D196P102-Y106 HydrophobicContact CB-CD2 4.38Å; P102-Y106 WeakPolarHBondContact O-CD2 3.32Å; P102-Y106 PolarHBondContact O-N 3.29Å; Y106-L108 VanDerWaalsContact C-N 3.34Å; Y106-L108 PolarHBondContact O-N 3.23Å; Y106-A109 PolarHBondContact O-N 2.9Å; Y106-Y110 AromaticContact CD1-CE1 3.93Å; Y106-Y110 HydrophobicContact CD1-CE1 3.93Å; Y106-Y110 AromaticContact CD1-CZ 3.8Å; Y106-Y110 WeakPolarHBondContact CD1-OH 3.31Å; Y106-Y110 WeakPolarHBondContact O-CB 3.43Å; Y106-Y110 PolarHBondContact O-N 3.42Å; Y106-F160 HydrophobicContact CD2-CE1 4.17Å; Y106-F160 AromaticContact CD2-CE2 3.74Å; Y106-F160 HydrophobicContact CD2-CE2 3.74Å; Y106-F160 AromaticContact CD2-CZ 3.3Å; Y106-F160 HydrophobicContact CD2-CZ 3.3Å; Y106-F160 HydrophobicContact CE2-CE1 4.35Å; Y106-F160 AromaticContact CE2-CZ 3.75Å; Y106-F160 HydrophobicContact CE2-CZ 3.75Å; Y106-F160 HydrophobicContact CG-CE2 4.04Å; Y106-F160 AromaticContact CG-CZ 3.95Å; Y106-F160 HydrophobicContact CG-CZ 3.95Å; Y106-F192 AromaticContact CD1-CE1 3.92Å; Y106-F192 HydrophobicContact CD1-CE1 3.92Å; Y106-F192 HydrophobicContact CD1-CZ 4.47Å; Y106-F192 HydrophobicContact CD2-CE1 4.33Å; Y106-F192 AromaticContact CE1-CE1 3.94Å; Y106-F192 HydrophobicContact CE1-CE1 3.94Å; Y106-F192 HydrophobicContact CE2-CE1 4.34Å; Y106-F192 HydrophobicContact CG-CE1 4.12Å; Y106-D196 HydrophobicContact CE1-CB 4.42Å; Y106-D196 WeakPolarHBondContact CE1-OD2 3.49Å
107T96.5Very high95.3Very high0 Ų015.7 Ų15.70%08%0.08CC..Hα-helixtrans-60.4-41.3-177.1-49.70000112.5Y103 L111 L153 F154 D157Y103-T107 VanDerWaalsContact O-CB 3.25Å; Y103-T107 WeakPolarHBondContact O-CB 3.49Å; Y103-T107 PolarHBondContact O-N 3.39Å; Y103-T107 VanDerWaalsContact O-N 3.07Å; Y103-T107 PolarHBondContact O-OG1 3.19Å; T107-L111 VanDerWaalsContact O-CB 3.23Å; T107-L111 WeakPolarHBondContact O-CB 3.19Å; T107-L111 PolarHBondContact O-N 3.34Å; T107-L153 HydrophobicContact CG2-CB 4.35Å; T107-F154 HydrophobicContact CG2-CB 4.35Å; T107-F154 HydrophobicContact CG2-CD1 4.25Å; T107-F154 HydrophobicContact CG2-CD2 3.24Å; T107-F154 HydrophobicContact CG2-CE1 4.38Å; T107-F154 HydrophobicContact CG2-CE2 3.42Å; T107-F154 VanDerWaalsContact CG2-CE2 3.42Å; T107-F154 HydrophobicContact CG2-CG 3.7Å; T107-F154 HydrophobicContact CG2-CZ 4Å; T107-D157 WeakPolarHBondContact CA-OD2 3.5Å; T107-D157 VanDerWaalsContact OG1-CB 3.28Å; T107-D157 WeakPolarHBondContact OG1-CB 3.18Å; T107-D157 PolarHBondContact OG1-OD2 2.94Å
108L97.3Very high95.4Very high14 Ų1415.1 Ų15.17%0.0738%0.076CC..Hα-helixtrans-76.9-36.1-179.5-67.1167.7000112.3V66 F69 Y70 T73 L104 Y106 L111 S112V66-L108 HydrophobicContact CG1-CB 4.45Å; V66-L108 HydrophobicContact CG1-CD2 4.14Å; V66-L108 WeakPolarHBondContact CG1-O 3.26Å; F69-L108 HydrophobicContact CB-CD1 3.87Å; F69-L108 HydrophobicContact CB-CD2 4.1Å; Y70-L108 HydrophobicContact CD2-CB 4.13Å; T73-L108 HydrophobicContact CG2-CD1 4.23Å; T73-L108 WeakPolarHBondContact OG1-CD1 3.34Å; L104-L108 HydrophobicContact CB-CD1 4.35Å; L104-L108 WeakPolarHBondContact O-CB 3.42Å; L104-L108 WeakPolarHBondContact O-CD1 3.41Å; L104-L108 WeakPolarHBondContact O-CG 3.22Å; L104-L108 PolarHBondContact O-N 2.91Å; Y106-L108 VanDerWaalsContact C-N 3.34Å; Y106-L108 PolarHBondContact O-N 3.23Å; L108-L111 PolarHBondContact O-N 2.98Å; L108-S112 PolarHBondContact O-N 2.83Å
109A94.6Very high95.3Very high5 Ų515.1 Ų15.14%0.0418%0.076CC..Hα-helixtrans-58.2-54170.100000110.9Y70 S105 Y106 L111 S112 V113 W374Y70-A109 HydrophobicContact CD2-CB 4.36Å; Y70-A109 HydrophobicContact CE2-CB 4.04Å; S105-A109 WeakPolarHBondContact O-CB 3.34Å; S105-A109 PolarHBondContact O-N 3.37Å; Y106-A109 PolarHBondContact O-N 2.9Å; A109-L111 VanDerWaalsContact C-N 3.31Å; A109-L111 PolarHBondContact O-N 2.97Å; A109-S112 PolarHBondContact O-N 3.5Å; A109-V113 WeakPolarHBondContact O-CG2 3.5Å; A109-V113 PolarHBondContact O-N 2.92Å; A109-W374 HydrophobicContact CB-CZ2 3.88Å
110Y96Very high95.1Very high0 Ų014 Ų140%07%0.07CC..Hα-helixtrans-57.5-44.3176.6-63.8-10.8000111.4Y106 S112 V113 W114 L153 F156 D157 F192 D196 L199 V200Y106-Y110 AromaticContact CD1-CE1 3.93Å; Y106-Y110 HydrophobicContact CD1-CE1 3.93Å; Y106-Y110 AromaticContact CD1-CZ 3.8Å; Y106-Y110 WeakPolarHBondContact CD1-OH 3.31Å; Y106-Y110 WeakPolarHBondContact O-CB 3.43Å; Y106-Y110 PolarHBondContact O-N 3.42Å; Y110-S112 VanDerWaalsContact C-N 3.33Å; Y110-S112 PolarHBondContact O-N 2.95Å; Y110-V113 PolarHBondContact O-N 3.46Å; Y110-W114 WeakPolarHBondContact O-CB 3.33Å; Y110-W114 PolarHBondContact O-N 3.38Å; Y110-L153 HydrophobicContact CD2-CD2 4.18Å; Y110-F156 HydrophobicContact CD2-CD1 4.47Å; Y110-F156 HydrophobicContact CE2-CD1 4.03Å; Y110-F156 AromaticContact CE2-CE1 3.81Å; Y110-F156 HydrophobicContact CE2-CE1 3.81Å; Y110-D157 VanDerWaalsContact CD2-OD2 3.26Å; Y110-D157 WeakPolarHBondContact CD2-OD2 3.34Å; Y110-D157 WeakPolarHBondContact CE2-OD1 3.43Å; Y110-F192 HydrophobicContact CE2-CZ 4.28Å; Y110-F192 WeakPolarHBondContact OH-CE1 3.35Å; Y110-F192 WeakPolarHBondContact OH-CZ 3.22Å; Y110-D196 WeakPolarHBondContact CE1-OD1 3.36Å; Y110-L199 HydrophobicContact CE2-CD1 4.4Å; Y110-V200 HydrophobicContact CD1-CG2 3.61Å; Y110-V200 HydrophobicContact CE1-CG2 3.45Å; Y110-V200 VanDerWaalsContact CE1-CG2 3.45Å
111L97.3Very high95Very high6 Ų613.4 Ų13.43%0.0317%0.07CC..Hα-helixtrans-63.6-38.8-179.1-176.958.3000111.8V66 T107 L108 A109 L115 I149 T150 L153V66-L111 HydrophobicContact CG1-CB 4.05Å; V66-L111 HydrophobicContact CG1-CD2 4.21Å; V66-L111 HydrophobicContact CG1-CG 4.06Å; V66-L111 HydrophobicContact CG2-CD2 3.61Å; V66-L111 HydrophobicContact CG2-CG 3.94Å; T107-L111 VanDerWaalsContact O-CB 3.23Å; T107-L111 WeakPolarHBondContact O-CB 3.19Å; T107-L111 PolarHBondContact O-N 3.34Å; L108-L111 PolarHBondContact O-N 2.98Å; A109-L111 VanDerWaalsContact C-N 3.31Å; A109-L111 PolarHBondContact O-N 2.97Å; L111-L115 HydrophobicContact CD1-CD1 4.06Å; L111-L115 HydrophobicContact CD1-CG 4.09Å; L111-L115 HydrophobicContact CG-CD1 3.93Å; L111-L115 HydrophobicContact CG-CG 4.43Å; L111-L115 VanDerWaalsContact O-CB 3.23Å; L111-L115 WeakPolarHBondContact O-CB 3.38Å; L111-L115 WeakPolarHBondContact O-CD1 3.23Å; L111-L115 WeakPolarHBondContact O-CG 3.42Å; L111-L115 PolarHBondContact O-N 2.95Å; L111-I149 HydrophobicContact CD1-CG2 3.93Å; L111-T150 WeakPolarHBondContact CD1-OG1 3.36Å; L111-T150 HydrophobicContact CD2-CG2 4.22Å; L111-L153 HydrophobicContact CB-CD1 4.06Å; L111-L153 HydrophobicContact CD1-CD1 4.24Å
112S96.1Very high94.9Very high9 Ų913 Ų136%0.0637%0.067CC..Hα-helixtrans-60.9-49.4172.2-178.50000111.4L63 D67 L108 A109 Y110 W114 L115 L116L63-S112 WeakPolarHBondContact CD1-O 3.49Å; L63-S112 VanDerWaalsContact CD1-OG 3.24Å; L63-S112 WeakPolarHBondContact CD1-OG 3.39Å; D67-S112 WeakPolarHBondContact OD1-CB 3.5Å; D67-S112 PolarHBondContact OD1-OG 2.85Å; L108-S112 PolarHBondContact O-N 2.83Å; A109-S112 PolarHBondContact O-N 3.5Å; Y110-S112 VanDerWaalsContact C-N 3.33Å; Y110-S112 PolarHBondContact O-N 2.95Å; S112-W114 PolarHBondContact O-N 2.99Å; S112-L115 PolarHBondContact O-N 2.99Å; S112-L116 PolarHBondContact O-N 3.35Å
113V95.1Very high94.7Very high1 Ų113.6 Ų13.61%0.0067%0.069CC..Hα-helixtrans-58.7-48.2177.9175.80000112.3A109 Y110 L115 L116 V117 V200 P204 F329 W374A109-V113 WeakPolarHBondContact O-CG2 3.5Å; A109-V113 PolarHBondContact O-N 2.92Å; Y110-V113 PolarHBondContact O-N 3.46Å; V113-L115 PolarHBondContact O-N 2.95Å; V113-L116 WeakPolarHBondContact O-CB 3.37Å; V113-L116 PolarHBondContact O-N 2.88Å; V113-V117 WeakPolarHBondContact O-CG2 3.41Å; V113-V117 PolarHBondContact O-N 3.25Å; V113-V200 WeakPolarHBondContact CG1-O 3.38Å; V113-P204 HydrophobicContact CG1-CB 3.6Å; V113-P204 HydrophobicContact CG1-CG 3.44Å; V113-P204 VanDerWaalsContact CG1-CG 3.44Å; V113-F329 HydrophobicContact CB-CZ 4.46Å; V113-F329 HydrophobicContact CG1-CZ 4.01Å; V113-F329 HydrophobicContact CG2-CE2 3.79Å; V113-F329 HydrophobicContact CG2-CZ 3.74Å; V113-W374 HydrophobicContact CG2-CH2 4.5Å
114W97Very high94.5Very high49 Ų4912.9 Ų12.919%0.1867%0.068CC..Hα-helixtrans-75.4-23.6-177.9-7594.9000113.1Y110 S112 V117 S118 I149 L153 L199 I203 P204Y110-W114 WeakPolarHBondContact O-CB 3.33Å; Y110-W114 PolarHBondContact O-N 3.38Å; S112-W114 PolarHBondContact O-N 2.99Å; W114-V117 HydrophobicContact CE3-CB 4.46Å; W114-V117 HydrophobicContact CE3-CG1 4.42Å; W114-S118 VanDerWaalsContact O-CB 3.32Å; W114-S118 WeakPolarHBondContact O-CB 3.45Å; W114-S118 PolarHBondContact O-N 3.4Å; W114-S118 PolarHBondContact O-OG 2.83Å; W114-I149 HydrophobicContact CB-CG2 3.82Å; W114-L153 HydrophobicContact CB-CD1 4.38Å; W114-L199 HydrophobicContact CZ2-CD2 4.17Å; W114-L199 PolarHBondContact NE1-O 3.44Å; W114-L199 VanDerWaalsContact NE1-O 3.1Å; W114-I203 HydrophobicContact CH2-CG2 3.66Å; W114-I203 HydrophobicContact CZ2-CG2 4.14Å; W114-P204 HydrophobicContact CZ2-CG 4.2Å
115L96.3Very high94.3Very high0 Ų013 Ų130%07%0.069CC..Hα-helixtrans-69.9-38.3165.3-74.4168.5000111.9Y59 V62 L63 V66 L111 S112 V113 S118 V119 I146Y59-L115 HydrophobicContact CD1-CD2 4.09Å; V62-L115 HydrophobicContact CB-CD1 4.48Å; V62-L115 HydrophobicContact CG1-CD1 3.86Å; V62-L115 HydrophobicContact CG1-CD2 4.42Å; L63-L115 HydrophobicContact CB-CB 4.36Å; L63-L115 HydrophobicContact CD1-CB 4.15Å; V66-L115 HydrophobicContact CB-CD1 4.36Å; V66-L115 HydrophobicContact CG2-CD1 3.92Å; L111-L115 HydrophobicContact CD1-CD1 4.06Å; L111-L115 HydrophobicContact CD1-CG 4.09Å; L111-L115 HydrophobicContact CG-CD1 3.93Å; L111-L115 HydrophobicContact CG-CG 4.43Å; L111-L115 VanDerWaalsContact O-CB 3.23Å; L111-L115 WeakPolarHBondContact O-CB 3.38Å; L111-L115 WeakPolarHBondContact O-CD1 3.23Å; L111-L115 WeakPolarHBondContact O-CG 3.42Å; L111-L115 PolarHBondContact O-N 2.95Å; S112-L115 PolarHBondContact O-N 2.99Å; V113-L115 PolarHBondContact O-N 2.95Å; L115-S118 WeakPolarHBondContact O-CB 3.44Å; L115-S118 PolarHBondContact O-N 2.79Å; L115-V119 PolarHBondContact O-N 2.9Å; L115-I146 HydrophobicContact CD2-CG1 3.86Å
116L94.5Very high94.1Very high4 Ų416.4 Ų16.42%0.0218%0.081CC..Hα-helixtrans-61.6-49.8172.7-177.260.4000110.7S112 V113 S118 V119 T120 M208 I325 F329S112-L116 PolarHBondContact O-N 3.35Å; V113-L116 WeakPolarHBondContact O-CB 3.37Å; V113-L116 PolarHBondContact O-N 2.88Å; L116-S118 VanDerWaalsContact C-N 3.31Å; L116-S118 PolarHBondContact O-N 3.36Å; L116-V119 HydrophobicContact CD1-CG1 4.2Å; L116-V119 WeakPolarHBondContact O-CG1 3.19Å; L116-V119 PolarHBondContact O-N 2.94Å; L116-T120 WeakPolarHBondContact O-CG2 3.24Å; L116-T120 PolarHBondContact O-N 3.11Å; L116-T120 VanDerWaalsContact O-N 3.08Å; L116-M208 HydrophobicContact CD2-CE 4.47Å; L116-M208 HydrophobicContact CD2-SD 3.91Å; L116-M208 HydrophobicContact CG-SD 3.92Å; L116-I325 HydrophobicContact CD1-CG2 3.7Å; L116-I325 HydrophobicContact CD2-CG2 4.31Å; L116-F329 HydrophobicContact CD2-CB 4.11Å; L116-F329 HydrophobicContact CD2-CD2 3.99Å; L116-F329 HydrophobicContact CD2-CG 3.99Å
117V95.1Very high93.8Very high7 Ų715.2 Ų15.24%0.0428%0.077CC..Hα-helixtrans-53.5-49.2172.2175.10000110.6V113 W114 V119 T120 V121 P204 F207 M208V113-V117 WeakPolarHBondContact O-CG2 3.41Å; V113-V117 PolarHBondContact O-N 3.25Å; W114-V117 HydrophobicContact CE3-CB 4.46Å; W114-V117 HydrophobicContact CE3-CG1 4.42Å; V117-V119 PolarHBondContact O-N 2.91Å; V117-T120 PolarHBondContact O-N 3.39Å; V117-T120 VanDerWaalsContact O-N 3.1Å; V117-T120 PolarHBondContact O-OG1 3.48Å; V117-V121 HydrophobicContact CG1-CG2 4.31Å; V117-V121 WeakPolarHBondContact O-CG2 3.32Å; V117-V121 PolarHBondContact O-N 2.92Å; V117-P204 HydrophobicContact CG2-CB 3.64Å; V117-P204 HydrophobicContact CG2-CG 4.37Å; V117-F207 HydrophobicContact CG1-CB 4Å; V117-F207 HydrophobicContact CG1-CG 4.42Å; V117-M208 HydrophobicContact CG2-CE 4.49Å; V117-M208 HydrophobicContact CG2-CG 4.26Å
118S95.2Very high93.4Very high12 Ų1217.7 Ų17.78%0.0849%0.092CC..Hα-helixtrans-58.8-40.7-179-63.80000113.5W114 L115 L116 V121 D122 I149W114-S118 VanDerWaalsContact O-CB 3.32Å; W114-S118 WeakPolarHBondContact O-CB 3.45Å; W114-S118 PolarHBondContact O-N 3.4Å; W114-S118 PolarHBondContact O-OG 2.83Å; L115-S118 WeakPolarHBondContact O-CB 3.44Å; L115-S118 PolarHBondContact O-N 2.79Å; L116-S118 VanDerWaalsContact C-N 3.31Å; L116-S118 PolarHBondContact O-N 3.36Å; S118-V121 PolarHBondContact O-N 3.18Å; S118-D122 PolarHBondContact O-N 2.99Å; S118-I149 WeakPolarHBondContact OG-CD1 3.24Å
119V92.6Very high93Very high0 Ų021.5 Ų21.50%011%0.109CC..Hα-helixtrans-71.3-33.1176.569.80000112.1T56 L60 L115 L116 V117 R123 L322T56-V119 HydrophobicContact CG2-CG2 3.69Å; T56-V119 WeakPolarHBondContact OG1-CG2 3.41Å; L60-V119 HydrophobicContact CD2-CG1 4.25Å; L60-V119 HydrophobicContact CD2-CG2 4.1Å; L60-V119 HydrophobicContact CG-CG2 4.1Å; L115-V119 PolarHBondContact O-N 2.9Å; L116-V119 HydrophobicContact CD1-CG1 4.2Å; L116-V119 WeakPolarHBondContact O-CG1 3.19Å; L116-V119 PolarHBondContact O-N 2.94Å; V117-V119 PolarHBondContact O-N 2.91Å; V119-R123 HydrophobicContact CG2-CG 4.41Å; V119-R123 WeakPolarHBondContact O-CB 3.41Å; V119-R123 WeakPolarHBondContact O-CG 3.26Å; V119-R123 PolarHBondContact O-N 3.45Å; V119-L322 HydrophobicContact CB-CD2 4.49Å; V119-L322 HydrophobicContact CG1-CD2 3.84Å; V119-L322 HydrophobicContact CG2-CD2 3.91Å
120T92.8Very high92.5Very high1 Ų123.8 Ų23.81%0.00612%0.124CC..Hα-helixtrans-65.2-40.7171.970.90000112.3L116 V117 R123 A124 M208 N326L116-T120 WeakPolarHBondContact O-CG2 3.24Å; L116-T120 PolarHBondContact O-N 3.11Å; L116-T120 VanDerWaalsContact O-N 3.08Å; V117-T120 PolarHBondContact O-N 3.39Å; V117-T120 VanDerWaalsContact O-N 3.1Å; V117-T120 PolarHBondContact O-OG1 3.48Å; T120-R123 PolarHBondContact O-N 3.31Å; T120-A124 WeakPolarHBondContact O-CB 3.43Å; T120-A124 PolarHBondContact O-N 3.46Å; T120-M208 HydrophobicContact CG2-CG 4.07Å; T120-M208 HydrophobicContact CG2-SD 4.42Å; T120-N326 WeakPolarHBondContact CG2-ND2 3.29Å; T120-N326 VanDerWaalsContact CG2-OD1 3.31Å; T120-N326 WeakPolarHBondContact CG2-OD1 3.38Å
121V92.7Very high92Very high56 Ų5632.5 Ų32.534%0.33916%0.162SC..Hα-helixtrans-67.4-45.9179.1172.60000111.4V117 S118 R123 A124 I125V117-V121 HydrophobicContact CG1-CG2 4.31Å; V117-V121 WeakPolarHBondContact O-CG2 3.32Å; V117-V121 PolarHBondContact O-N 2.92Å; S118-V121 PolarHBondContact O-N 3.18Å; V121-R123 PolarHBondContact O-N 2.97Å; V121-A124 PolarHBondContact O-N 2.63Å; V121-I125 HydrophobicContact CG1-CD1 3.99Å; V121-I125 VanDerWaalsContact O-CG1 3.32Å; V121-I125 WeakPolarHBondContact O-CG1 3.34Å; V121-I125 PolarHBondContact O-N 3.25Å
122D91.9Very high91.5Very high7 Ų736.4 Ų36.44%0.03718%0.183CC..Hα-helixtrans-52.9-42.5172.8178.186000111.2S55 T56 Y59 S118 I125 W126 C137S55-D122 VanDerWaalsContact CB-OD1 3.23Å; S55-D122 WeakPolarHBondContact CB-OD1 3.15Å; S55-D122 PolarHBondContact OG-OD1 3.38Å; S55-D122 PolarHBondContact OG-OD2 2.98Å; S55-D122 VanDerWaalsContact OG-OD2 3.09Å; T56-D122 PolarHBondContact OG1-OD2 3.44Å; Y59-D122 HydrophobicContact CD2-CB 4.47Å; Y59-D122 HydrophobicContact CE2-CB 4.11Å; S118-D122 PolarHBondContact O-N 2.99Å; D122-I125 PolarHBondContact O-N 3.5Å; D122-W126 PolarHBondContact O-N 2.91Å; D122-C137 WeakPolarHBondContact OD1-CB 3.29Å; D122-C137 PolarHBondContact OD1-SG 2.98Å
123R89.3Confident91.1Very high16 Ų1636 Ų366%0.0618%0.18CC..Hα-helixtrans-78.3-31.9-176.5-65.7-75.8100.1149.120.1112.9S54 T56 V119 T120 V121 W126 V127 L322S54-R123 PolarHBondContact OG-NH2 3.07Å; S54-R123 VanDerWaalsContact OG-NH2 3.08Å; T56-R123 VanDerWaalsContact CB-CZ 3.42Å; T56-R123 HydrophobicContact CG2-CG 4.48Å; T56-R123 VanDerWaalsContact OG1-CD 3.24Å; T56-R123 WeakPolarHBondContact OG1-CD 3.4Å; T56-R123 VanDerWaalsContact OG1-CG 3.25Å; T56-R123 WeakPolarHBondContact OG1-CG 3.35Å; T56-R123 PolarHBondContact OG1-NE 3.21Å; T56-R123 PolarHBondContact OG1-NH2 3.47Å; V119-R123 HydrophobicContact CG2-CG 4.41Å; V119-R123 WeakPolarHBondContact O-CB 3.41Å; V119-R123 WeakPolarHBondContact O-CG 3.26Å; V119-R123 PolarHBondContact O-N 3.45Å; T120-R123 PolarHBondContact O-N 3.31Å; V121-R123 PolarHBondContact O-N 2.97Å; R123-W126 VanDerWaalsContact NH2-NE1 3.12Å; R123-W126 PolarHBondContact O-N 2.89Å; R123-V127 WeakPolarHBondContact O-CG2 3.5Å; R123-V127 PolarHBondContact O-N 2.95Å; R123-L322 HydrophobicContact CB-CD1 3.8Å; R123-L322 HydrophobicContact CG-CD1 3.45Å; R123-L322 VanDerWaalsContact CG-CD1 3.45Å
124A90.8Very high90.6Very high12 Ų1243.4 Ų43.410%0.09921%0.212CC..Hα-helixtrans-61.5-44.2167.800000110.8T120 V121 W126 V127 V128 A211 I215T120-A124 WeakPolarHBondContact O-CB 3.43Å; T120-A124 PolarHBondContact O-N 3.46Å; V121-A124 PolarHBondContact O-N 2.63Å; A124-W126 PolarHBondContact O-N 2.71Å; A124-V127 PolarHBondContact O-N 3.1Å; A124-V128 VanDerWaalsContact O-CB 3.28Å; A124-V128 WeakPolarHBondContact O-CB 3.31Å; A124-V128 VanDerWaalsContact O-CG2 3.3Å; A124-V128 WeakPolarHBondContact O-CG2 3.27Å; A124-V128 PolarHBondContact O-N 2.91Å; A124-A211 HydrophobicContact CB-CB 4.22Å; A124-I215 HydrophobicContact CB-CD1 4Å; A124-I215 HydrophobicContact CB-CG1 4.02Å
125I91.7Very high90.2Very high45 Ų4551.4 Ų51.423%0.23124%0.242CC..Hα-helixtrans-61.3-45.2176-64.6160.9000111V121 D122 V127 Q129 A133 V136 C137V121-I125 HydrophobicContact CG1-CD1 3.99Å; V121-I125 VanDerWaalsContact O-CG1 3.32Å; V121-I125 WeakPolarHBondContact O-CG1 3.34Å; V121-I125 PolarHBondContact O-N 3.25Å; D122-I125 PolarHBondContact O-N 3.5Å; I125-V127 VanDerWaalsContact C-N 3.34Å; I125-V127 PolarHBondContact O-N 3.38Å; I125-Q129 CarbonylContact O-C 3.53Å; I125-Q129 WeakPolarHBondContact O-CA 3.42Å; I125-Q129 PolarHBondContact O-N 3.08Å; I125-A133 HydrophobicContact CG2-CB 3.98Å; I125-V136 HydrophobicContact CD1-CG1 4.15Å; I125-V136 HydrophobicContact CG2-CB 4.41Å; I125-V136 HydrophobicContact CG2-CG1 4.46Å; I125-C137 VanDerWaalsContact CG2-SG 3.57Å
126W89.2Confident89.9Confident73 Ų7354.7 Ų54.728%0.27726%0.262SS..Hα-helixtrans-61.8-35.5176.8-86.7102.5000114.4D122 R123 A124 A133 K134 C137D122-W126 PolarHBondContact O-N 2.91Å; R123-W126 VanDerWaalsContact NH2-NE1 3.12Å; R123-W126 PolarHBondContact O-N 2.89Å; A124-W126 PolarHBondContact O-N 2.71Å; W126-A133 HydrophobicContact CB-CB 4.46Å; W126-A133 HydrophobicContact CD2-CB 3.65Å; W126-A133 HydrophobicContact CE3-CB 3.68Å; W126-A133 HydrophobicContact CG-CB 4.01Å; W126-A133 HydrophobicContact CZ2-CB 4.49Å; W126-A133 HydrophobicContact CZ3-CB 4.13Å; W126-K134 HydrophobicContact CH2-CG 4.02Å; W126-K134 HydrophobicContact CZ3-CG 4.25Å; W126-C137 HydrophobicContact CZ2-CB 4.23Å
127V87.2Confident89.7Confident2 Ų255.1 Ų55.11%0.01227%0.265CS..Hα-helixtrans-83.8-44.8-179.2171.90000111.9R123 A124 I125 I215 Q218 L219 M222R123-V127 WeakPolarHBondContact O-CG2 3.5Å; R123-V127 PolarHBondContact O-N 2.95Å; A124-V127 PolarHBondContact O-N 3.1Å; I125-V127 VanDerWaalsContact C-N 3.34Å; I125-V127 PolarHBondContact O-N 3.38Å; V127-I215 HydrophobicContact CB-CG1 4.41Å; V127-I215 HydrophobicContact CG1-CG2 4.41Å; V127-Q218 HydrophobicContact CG1-CB 3.88Å; V127-Q218 HydrophobicContact CG1-CG 3.73Å; V127-Q218 VanDerWaalsContact O-CG 3.32Å; V127-Q218 WeakPolarHBondContact O-CG 3.49Å; V127-L219 HydrophobicContact CG1-CD2 4.24Å; V127-L219 HydrophobicContact CG1-CG 4.27Å; V127-M222 WeakPolarHBondContact O-CE 3.36Å
128V89.3Confident89.5Confident52 Ų5256.8 Ų56.832%0.31528%0.276SS..Hα-helixtrans-79.5-41.3-175.9-1790000112A124 P130 L214 Q218A124-V128 VanDerWaalsContact O-CB 3.28Å; A124-V128 WeakPolarHBondContact O-CB 3.31Å; A124-V128 VanDerWaalsContact O-CG2 3.3Å; A124-V128 WeakPolarHBondContact O-CG2 3.27Å; A124-V128 PolarHBondContact O-N 2.91Å; V128-P130 VanDerWaalsContact C-CD 3.44Å; V128-P130 WeakPolarHBondContact O-CD 3.37Å; V128-L214 HydrophobicContact CG2-CB 4.2Å; V128-Q218 HydrophobicContact CG2-CB 4.37Å; V128-Q218 HydrophobicContact CG2-CG 4.49Å
129Q87.4Confident89.3Confident95 Ų9559.7 Ų59.744%0.44429%0.293SS..  trans-124.161.8-175.7-57.2-166.38.500113.1I125 F131 N132 A133I125-Q129 CarbonylContact O-C 3.53Å; I125-Q129 WeakPolarHBondContact O-CA 3.42Å; I125-Q129 PolarHBondContact O-N 3.08Å; Q129-F131 PolarHBondContact O-N 3.1Å; Q129-N132 HydrophobicContact CB-CB 4.13Å; Q129-N132 PolarHBondContact O-N 3.25Å; Q129-N132 PolarHBondContact OE1-ND2 2.96Å; Q129-A133 WeakPolarHBondContact O-CB 3.27Å; Q129-A133 PolarHBondContact O-N 3.34Å
130P84.2Confident89.3Confident53 Ų5368.7 Ų68.734%0.34433%0.327SS..THydrogen-bonded Turntrans-61.9-14.9-172.425.5-36.5000115.5V128V128-P130 VanDerWaalsContact C-CD 3.44Å; V128-P130 WeakPolarHBondContact O-CD 3.37Å
131F85.7Confident89.3Confident182 Ų18271.4 Ų71.480%0.79834%0.341SS*.THydrogen-bonded Turntrans-81.9-50.1171.6-60.9-72.2000111.8Q129Q129-F131 PolarHBondContact O-N 3.1Å
132N87.6Confident89.4Confident88 Ų8868.8 Ų68.847%0.47133%0.326SS..THydrogen-bonded Turntrans-72.7-29.6-179.4-64.7-14.5000112.6Q129 K134 R135 V136Q129-N132 HydrophobicContact CB-CB 4.13Å; Q129-N132 PolarHBondContact O-N 3.25Å; Q129-N132 PolarHBondContact OE1-ND2 2.96Å; N132-K134 PolarHBondContact O-N 3.35Å; N132-K134 VanDerWaalsContact O-N 3.08Å; N132-R135 WeakPolarHBondContact O-CA 3.43Å; N132-R135 WeakPolarHBondContact O-CB 3.39Å; N132-R135 PolarHBondContact O-N 3.29Å; N132-V136 PolarHBondContact O-N 3.4Å
133A87.3Confident89.6Confident0 Ų073.9 Ų73.90%034%0.344CS..Hα-helixtrans-53-33.8-179.100000113.3I125 W126 Q129 R135 V136 C137I125-A133 HydrophobicContact CG2-CB 3.98Å; W126-A133 HydrophobicContact CB-CB 4.46Å; W126-A133 HydrophobicContact CD2-CB 3.65Å; W126-A133 HydrophobicContact CE3-CB 3.68Å; W126-A133 HydrophobicContact CG-CB 4.01Å; W126-A133 HydrophobicContact CZ2-CB 4.49Å; W126-A133 HydrophobicContact CZ3-CB 4.13Å; Q129-A133 WeakPolarHBondContact O-CB 3.27Å; Q129-A133 PolarHBondContact O-N 3.34Å; A133-R135 VanDerWaalsContact C-N 3.26Å; A133-R135 PolarHBondContact O-N 3.06Å; A133-V136 PolarHBondContact O-N 3.06Å; A133-C137 WeakPolarHBondContact O-CA 3.26Å; A133-C137 WeakPolarHBondContact O-CB 3.24Å; A133-C137 PolarHBondContact O-N 3.21Å
134K84.2Confident89.9Confident157 Ų15777.4 Ų77.468%0.68336%0.364SS*.Hα-helixtrans-65.9-24.8175.7-64.6178.4-176.2171.80114.3W126 N132W126-K134 HydrophobicContact CH2-CG 4.02Å; W126-K134 HydrophobicContact CZ3-CG 4.25Å; N132-K134 PolarHBondContact O-N 3.35Å; N132-K134 VanDerWaalsContact O-N 3.08Å
135R89.2Confident90.2Very high218 Ų21879.4 Ų79.482%0.82338%0.375SS*.Hα-helixtrans-93.6-33.4177.9-176.7-179.5176.9-169.4-1.1111.9N132 A133 T138N132-R135 WeakPolarHBondContact O-CA 3.43Å; N132-R135 WeakPolarHBondContact O-CB 3.39Å; N132-R135 PolarHBondContact O-N 3.29Å; A133-R135 VanDerWaalsContact C-N 3.26Å; A133-R135 PolarHBondContact O-N 3.06Å; R135-T138 WeakPolarHBondContact O-CG2 3.42Å
136V90.2Very high90.5Very high69 Ų6977.4 Ų77.442%0.41837%0.365SS..Hα-helixtrans-88.2-52-177.2-179.60000111.6I125 N132 A133 T138 N141I125-V136 HydrophobicContact CD1-CG1 4.15Å; I125-V136 HydrophobicContact CG2-CB 4.41Å; I125-V136 HydrophobicContact CG2-CG1 4.46Å; N132-V136 PolarHBondContact O-N 3.4Å; A133-V136 PolarHBondContact O-N 3.06Å; V136-T138 PolarHBondContact O-N 2.76Å; V136-N141 WeakPolarHBondContact O-CB 3.23Å; V136-N141 PolarHBondContact O-ND2 3.04Å
137C89.5Confident90.9Very high12 Ų1279.5 Ų79.58%0.08138%0.376CS..SBendtrans-85.956-175-61.40000112.2S55 D122 I125 W126 A133S55-C137 PolarHBondContact OG-O 3.05Å; D122-C137 WeakPolarHBondContact OD1-CB 3.29Å; D122-C137 PolarHBondContact OD1-SG 2.98Å; I125-C137 VanDerWaalsContact CG2-SG 3.57Å; W126-C137 HydrophobicContact CZ2-CB 4.23Å; A133-C137 WeakPolarHBondContact O-CA 3.26Å; A133-C137 WeakPolarHBondContact O-CB 3.24Å; A133-C137 PolarHBondContact O-N 3.21Å
138T91.2Very high91.4Very high43 Ų4382.6 Ų82.626%0.26440%0.398SS..  trans-85.3162.6174.774.80000111.4R135 V136 R140 N141 A142R135-T138 WeakPolarHBondContact O-CG2 3.42Å; V136-T138 PolarHBondContact O-N 2.76Å; T138-R140 VanDerWaalsContact C-N 3.34Å; T138-N141 PolarHBondContact O-N 2.94Å; T138-N141 WeakPolarHBondContact OG1-CB 3.48Å; T138-N141 PolarHBondContact OG1-N 3.31Å; T138-N141 PolarHBondContact OG1-ND2 3.18Å; T138-N141 PolarHBondContact OG1-OD1 3.26Å; T138-A142 PolarHBondContact O-N 2.88Å
139T90.4Very high91.8Very high72 Ų7281.6 Ų81.644%0.44239%0.39SS..Hα-helixtrans-65.6-36.5174.451.30000112.4I58 A142 W143I58-T139 HydrophobicContact CD1-CG2 3.78Å; T139-A142 PolarHBondContact O-N 3.27Å; T139-W143 PolarHBondContact O-N 3.43Å; T139-W143 VanDerWaalsContact O-N 3.13Å
140R92.6Very high92.4Very high189 Ų18978.8 Ų78.871%0.71338%0.379SS*.Hα-helixtrans-60.5-47.9172.5178177.7175.8173.5-0.4111.1T138 A142 W143 L144T138-R140 VanDerWaalsContact C-N 3.34Å; R140-A142 VanDerWaalsContact C-N 3.35Å; R140-W143 PolarHBondContact O-N 3.33Å; R140-L144 HydrophobicContact CG-CD1 4Å; R140-L144 HydrophobicContact CG-CG 4.49Å; R140-L144 WeakPolarHBondContact O-CG 3.48Å; R140-L144 PolarHBondContact O-N 3.31Å
141N94.1Very high93Very high58 Ų5881.5 Ų81.531%0.3139%0.39SS..Hα-helixtrans-67.6-37.5-178.1-64.72000111.2V136 T138 L144 T145V136-N141 WeakPolarHBondContact O-CB 3.23Å; V136-N141 PolarHBondContact O-ND2 3.04Å; T138-N141 PolarHBondContact O-N 2.94Å; T138-N141 WeakPolarHBondContact OG1-CB 3.48Å; T138-N141 PolarHBondContact OG1-N 3.31Å; T138-N141 PolarHBondContact OG1-ND2 3.18Å; T138-N141 PolarHBondContact OG1-OD1 3.26Å; N141-L144 PolarHBondContact O-N 2.78Å; N141-T145 PolarHBondContact O-N 3.46Å; N141-T145 PolarHBondContact O-OG1 3.04Å
142A94.6Very high93.6Very high2 Ų278.2 Ų78.22%0.01738%0.379CS..Hα-helixtrans-59-47.8173.400000112.1I58 Y59 T138 T139 R140 T145 I146I58-A142 HydrophobicContact CD1-CB 4.27Å; Y59-A142 HydrophobicContact CD2-CB 4.32Å; Y59-A142 HydrophobicContact CE2-CB 3.77Å; T138-A142 PolarHBondContact O-N 2.88Å; T139-A142 PolarHBondContact O-N 3.27Å; R140-A142 VanDerWaalsContact C-N 3.35Å; A142-T145 PolarHBondContact O-N 2.83Å; A142-I146 WeakPolarHBondContact O-CB 3.36Å; A142-I146 WeakPolarHBondContact O-CD1 3.23Å; A142-I146 WeakPolarHBondContact O-CG1 3.1Å; A142-I146 PolarHBondContact O-N 3.27Å
143W95.6Very high94.1Very high114 Ų11474.6 Ų74.643%0.43236%0.36SS..Hα-helixtrans-62.3-42.4175-81.9117.3000113.1I58 V62 T139 R140 I146 F147I58-W143 HydrophobicContact CG2-CD2 3.98Å; I58-W143 HydrophobicContact CG2-CE3 4.45Å; I58-W143 HydrophobicContact CG2-CG 4.46Å; I58-W143 HydrophobicContact CG2-CH2 4.26Å; I58-W143 HydrophobicContact CG2-CZ2 3.77Å; V62-W143 HydrophobicContact CG2-CH2 4.03Å; V62-W143 HydrophobicContact CG2-CZ3 4.08Å; T139-W143 PolarHBondContact O-N 3.43Å; T139-W143 VanDerWaalsContact O-N 3.13Å; R140-W143 PolarHBondContact O-N 3.33Å; W143-I146 HydrophobicContact CE3-CD1 4.47Å; W143-I146 PolarHBondContact O-N 2.84Å; W143-F147 HydrophobicContact CB-CD2 4.38Å; W143-F147 HydrophobicContact CB-CE2 4.25Å; W143-F147 HydrophobicContact CD2-CE2 4.3Å; W143-F147 HydrophobicContact CE3-CD2 4.34Å; W143-F147 AromaticContact CE3-CE2 3.67Å; W143-F147 HydrophobicContact CE3-CE2 3.67Å; W143-F147 AromaticContact CE3-CZ 3.88Å; W143-F147 HydrophobicContact CE3-CZ 3.88Å; W143-F147 HydrophobicContact CZ3-CE2 4.41Å; W143-F147 HydrophobicContact CZ3-CZ 4.16Å; W143-F147 WeakPolarHBondContact O-CD2 3.46Å; W143-F147 PolarHBondContact O-N 3.48Å
144L96.8Very high94.5Very high90 Ų9077.8 Ų77.847%0.47137%0.374SS..Hα-helixtrans-59.9-47.1175.9-71.6170.4000111.6R140 N141 I146 F147 S148R140-L144 HydrophobicContact CG-CD1 4Å; R140-L144 HydrophobicContact CG-CG 4.49Å; R140-L144 WeakPolarHBondContact O-CG 3.48Å; R140-L144 PolarHBondContact O-N 3.31Å; N141-L144 PolarHBondContact O-N 2.78Å; L144-I146 PolarHBondContact O-N 2.85Å; L144-F147 PolarHBondContact O-N 3.47Å; L144-S148 WeakPolarHBondContact O-CB 3.22Å; L144-S148 PolarHBondContact O-N 3.43Å; L144-S148 PolarHBondContact O-OG 3.03Å; L144-S148 VanDerWaalsContact O-OG 3.14Å
145T96.7Very high95.2Very high53 Ų5374.9 Ų74.933%0.32537%0.369SS..Hα-helixtrans-60.2-43.5175.7-64.10000112Y59 N141 A142 S148 I149Y59-T145 HydrophobicContact CE1-CG2 4.05Å; Y59-T145 WeakPolarHBondContact OH-CB 3.5Å; Y59-T145 WeakPolarHBondContact OH-CG2 3.46Å; N141-T145 PolarHBondContact O-N 3.46Å; N141-T145 PolarHBondContact O-OG1 3.04Å; A142-T145 PolarHBondContact O-N 2.83Å; T145-S148 PolarHBondContact O-N 3.24Å; T145-I149 HydrophobicContact CG2-CD1 3.7Å; T145-I149 HydrophobicContact CG2-CG1 4.42Å; T145-I149 WeakPolarHBondContact O-CB 3.49Å; T145-I149 VanDerWaalsContact O-CG1 3.3Å; T145-I149 WeakPolarHBondContact O-CG1 3.26Å; T145-I149 PolarHBondContact O-N 3.44Å
146I97.9Very high95.5Very high4 Ų468 Ų682%0.02135%0.345CS..Hα-helixtrans-60.4-54.4177.3-69.4164.2000110.5I58 Y59 V62 L115 A142 W143 L144 S148 I149 T150I58-I146 HydrophobicContact CG2-CD1 3.69Å; Y59-I146 HydrophobicContact CD1-CD1 3.77Å; Y59-I146 HydrophobicContact CD1-CG1 3.63Å; Y59-I146 HydrophobicContact CE1-CD1 4.09Å; Y59-I146 HydrophobicContact CE1-CG1 3.65Å; Y59-I146 HydrophobicContact CG-CD1 4.4Å; V62-I146 HydrophobicContact CB-CD1 4.43Å; V62-I146 HydrophobicContact CG1-CG2 4Å; V62-I146 HydrophobicContact CG2-CD1 4.11Å; L115-I146 HydrophobicContact CD2-CG1 3.86Å; A142-I146 WeakPolarHBondContact O-CB 3.36Å; A142-I146 WeakPolarHBondContact O-CD1 3.23Å; A142-I146 WeakPolarHBondContact O-CG1 3.1Å; A142-I146 PolarHBondContact O-N 3.27Å; W143-I146 HydrophobicContact CE3-CD1 4.47Å; W143-I146 PolarHBondContact O-N 2.84Å; L144-I146 PolarHBondContact O-N 2.85Å; I146-S148 VanDerWaalsContact C-N 3.35Å; I146-S148 PolarHBondContact O-N 3.11Å; I146-I149 PolarHBondContact O-N 2.87Å; I146-T150 PolarHBondContact O-N 3.35Å; I146-T150 PolarHBondContact O-OG1 3.18Å; I146-T150 VanDerWaalsContact O-OG1 3.1Å
147F97.9Very high95.8Very high117 Ų11764.7 Ų64.751%0.51333%0.326SS..Hα-helixtrans-61.8-40.2179.8-71.5-58.7000112.5W143 L144 I151W143-F147 HydrophobicContact CB-CD2 4.38Å; W143-F147 HydrophobicContact CB-CE2 4.25Å; W143-F147 HydrophobicContact CD2-CE2 4.3Å; W143-F147 HydrophobicContact CE3-CD2 4.34Å; W143-F147 AromaticContact CE3-CE2 3.67Å; W143-F147 HydrophobicContact CE3-CE2 3.67Å; W143-F147 AromaticContact CE3-CZ 3.88Å; W143-F147 HydrophobicContact CE3-CZ 3.88Å; W143-F147 HydrophobicContact CZ3-CE2 4.41Å; W143-F147 HydrophobicContact CZ3-CZ 4.16Å; W143-F147 WeakPolarHBondContact O-CD2 3.46Å; W143-F147 PolarHBondContact O-N 3.48Å; L144-F147 PolarHBondContact O-N 3.47Å; F147-I151 WeakPolarHBondContact O-CB 3.26Å; F147-I151 WeakPolarHBondContact O-CD1 3.39Å; F147-I151 VanDerWaalsContact O-CG1 3.25Å; F147-I151 WeakPolarHBondContact O-CG1 3.1Å; F147-I151 PolarHBondContact O-N 3.18Å
148S97.9Very high96.2Very high67 Ų6765.8 Ų65.847%0.46933%0.333SS..Hα-helixtrans-60.5-47.7174.4-71.90000112.2L144 T145 I146 I151 I152L144-S148 WeakPolarHBondContact O-CB 3.22Å; L144-S148 PolarHBondContact O-N 3.43Å; L144-S148 PolarHBondContact O-OG 3.03Å; L144-S148 VanDerWaalsContact O-OG 3.14Å; T145-S148 PolarHBondContact O-N 3.24Å; I146-S148 VanDerWaalsContact C-N 3.35Å; I146-S148 PolarHBondContact O-N 3.11Å; S148-I151 PolarHBondContact O-N 3.39Å; S148-I152 WeakPolarHBondContact O-CB 3.49Å; S148-I152 WeakPolarHBondContact O-CD1 3.38Å; S148-I152 WeakPolarHBondContact O-CG1 3.1Å; S148-I152 PolarHBondContact O-N 3.36Å
149I97.7Very high96.4Very high30 Ų3064.2 Ų64.215%0.15432%0.323CS..Hα-helixtrans-64.8-45.9179.7-70.4171.7000110.5L111 W114 S118 T145 I146 I151 I152 L153L111-I149 HydrophobicContact CD1-CG2 3.93Å; W114-I149 HydrophobicContact CB-CG2 3.82Å; S118-I149 WeakPolarHBondContact OG-CD1 3.24Å; T145-I149 HydrophobicContact CG2-CD1 3.7Å; T145-I149 HydrophobicContact CG2-CG1 4.42Å; T145-I149 WeakPolarHBondContact O-CB 3.49Å; T145-I149 VanDerWaalsContact O-CG1 3.3Å; T145-I149 WeakPolarHBondContact O-CG1 3.26Å; T145-I149 PolarHBondContact O-N 3.44Å; I146-I149 PolarHBondContact O-N 2.87Å; I149-I151 PolarHBondContact O-N 2.91Å; I149-I152 PolarHBondContact O-N 2.64Å; I149-L153 HydrophobicContact CG2-CD1 3.75Å; I149-L153 HydrophobicContact CG2-CG 4.35Å; I149-L153 WeakPolarHBondContact O-CG 3.45Å; I149-L153 PolarHBondContact O-N 3.16Å
150T98.1Very high96.6Very high36 Ų3660.9 Ų60.922%0.22130%0.302CS..Hα-helixtrans-57.8-49.1176.3-60.30000111.6L111 I146 I152 L153 F154L111-T150 WeakPolarHBondContact CD1-OG1 3.36Å; L111-T150 HydrophobicContact CD2-CG2 4.22Å; I146-T150 PolarHBondContact O-N 3.35Å; I146-T150 PolarHBondContact O-OG1 3.18Å; I146-T150 VanDerWaalsContact O-OG1 3.1Å; T150-I152 PolarHBondContact O-N 3.29Å; T150-L153 PolarHBondContact O-N 2.87Å; T150-F154 HydrophobicContact CG2-CD2 3.68Å; T150-F154 HydrophobicContact CG2-CE2 3.73Å; T150-F154 WeakPolarHBondContact O-CB 3.41Å; T150-F154 VanDerWaalsContact O-CD2 3.24Å; T150-F154 WeakPolarHBondContact O-CD2 3.43Å; T150-F154 PolarHBondContact O-N 2.83Å
151I98.1Very high96.8Very high110 Ų11057.2 Ų57.256%0.56429%0.292SS*.Hα-helixtrans-62.9-42.4179.4-68.6165.6000111.2F147 S148 I149 L153 V155F147-I151 WeakPolarHBondContact O-CB 3.26Å; F147-I151 WeakPolarHBondContact O-CD1 3.39Å; F147-I151 VanDerWaalsContact O-CG1 3.25Å; F147-I151 WeakPolarHBondContact O-CG1 3.1Å; F147-I151 PolarHBondContact O-N 3.18Å; S148-I151 PolarHBondContact O-N 3.39Å; I149-I151 PolarHBondContact O-N 2.91Å; I151-L153 PolarHBondContact O-N 2.96Å; I151-V155 HydrophobicContact CG2-CG2 4.44Å; I151-V155 WeakPolarHBondContact O-CB 3.48Å; I151-V155 VanDerWaalsContact O-CG2 3.24Å; I151-V155 WeakPolarHBondContact O-CG2 3.28Å; I151-V155 PolarHBondContact O-N 3.01Å; I151-V155 VanDerWaalsContact O-N 3.07Å
152I98Very high96.8Very high113 Ų11362.8 Ų62.858%0.57931%0.309SS*.Hα-helixtrans-62-44.7179.2-71.8164.8000111.3S148 I149 T150 F156S148-I152 WeakPolarHBondContact O-CB 3.49Å; S148-I152 WeakPolarHBondContact O-CD1 3.38Å; S148-I152 WeakPolarHBondContact O-CG1 3.1Å; S148-I152 PolarHBondContact O-N 3.36Å; I149-I152 PolarHBondContact O-N 2.64Å; T150-I152 PolarHBondContact O-N 3.29Å; I152-F156 VanDerWaalsContact O-CB 3.3Å; I152-F156 WeakPolarHBondContact O-CB 3.49Å; I152-F156 PolarHBondContact O-N 3.19Å
153L97.5Very high96.8Very high12 Ų1263 Ų636%0.06331%0.309CS..Hα-helixtrans-70.2-47.6-179.6-65.4173.5000111.9T107 Y110 L111 W114 I149 T150 I151 V155 F156 D157T107-L153 HydrophobicContact CG2-CB 4.35Å; Y110-L153 HydrophobicContact CD2-CD2 4.18Å; L111-L153 HydrophobicContact CB-CD1 4.06Å; L111-L153 HydrophobicContact CD1-CD1 4.24Å; W114-L153 HydrophobicContact CB-CD1 4.38Å; I149-L153 HydrophobicContact CG2-CD1 3.75Å; I149-L153 HydrophobicContact CG2-CG 4.35Å; I149-L153 WeakPolarHBondContact O-CG 3.45Å; I149-L153 PolarHBondContact O-N 3.16Å; T150-L153 PolarHBondContact O-N 2.87Å; I151-L153 PolarHBondContact O-N 2.96Å; L153-V155 PolarHBondContact O-N 2.95Å; L153-V155 VanDerWaalsContact O-N 3.16Å; L153-F156 WeakPolarHBondContact O-CB 3.48Å; L153-F156 PolarHBondContact O-N 2.92Å; L153-D157 PolarHBondContact O-N 3.02Å
154F97.2Very high96.8Very high68 Ų6858 Ų5830%0.29829%0.291SS..Hα-helixtrans-59-30.2176.8-88.2-106.9000113.2Y103 T107 T150Y103-F154 HydrophobicContact CE1-CD1 4.41Å; Y103-F154 WeakPolarHBondContact OH-CD1 3.48Å; Y103-F154 PolarHBondContact OH-O 3.27Å; T107-F154 HydrophobicContact CG2-CB 4.35Å; T107-F154 HydrophobicContact CG2-CD1 4.25Å; T107-F154 HydrophobicContact CG2-CD2 3.24Å; T107-F154 HydrophobicContact CG2-CE1 4.38Å; T107-F154 HydrophobicContact CG2-CE2 3.42Å; T107-F154 VanDerWaalsContact CG2-CE2 3.42Å; T107-F154 HydrophobicContact CG2-CG 3.7Å; T107-F154 HydrophobicContact CG2-CZ 4Å; T150-F154 HydrophobicContact CG2-CD2 3.68Å; T150-F154 HydrophobicContact CG2-CE2 3.73Å; T150-F154 WeakPolarHBondContact O-CB 3.41Å; T150-F154 VanDerWaalsContact O-CD2 3.24Å; T150-F154 WeakPolarHBondContact O-CD2 3.43Å; T150-F154 PolarHBondContact O-N 2.83Å
155V97.9Very high96.7Very high95 Ų9557 Ų5758%0.57629%0.286SS*.Hα-helixtrans-79.8-39.2173170.70000111.8I151 L153 S158I151-V155 HydrophobicContact CG2-CG2 4.44Å; I151-V155 WeakPolarHBondContact O-CB 3.48Å; I151-V155 VanDerWaalsContact O-CG2 3.24Å; I151-V155 WeakPolarHBondContact O-CG2 3.28Å; I151-V155 PolarHBondContact O-N 3.01Å; I151-V155 VanDerWaalsContact O-N 3.07Å; L153-V155 PolarHBondContact O-N 2.95Å; L153-V155 VanDerWaalsContact O-N 3.16Å; V155-S158 VanDerWaalsContact O-CB 3.29Å; V155-S158 WeakPolarHBondContact O-CB 3.4Å; V155-S158 PolarHBondContact O-N 3.07Å; V155-S158 PolarHBondContact O-OG 3.36Å
156F96.5Very high96.6Very high74 Ų7457.1 Ų57.133%0.32528%0.281SS..Hα-helixtrans-59.9-51.7176.4173.4-96.8000111.5Y110 I152 L153 S158 H159 F192 I195 L199Y110-F156 HydrophobicContact CD2-CD1 4.47Å; Y110-F156 HydrophobicContact CE2-CD1 4.03Å; Y110-F156 AromaticContact CE2-CE1 3.81Å; Y110-F156 HydrophobicContact CE2-CE1 3.81Å; I152-F156 VanDerWaalsContact O-CB 3.3Å; I152-F156 WeakPolarHBondContact O-CB 3.49Å; I152-F156 PolarHBondContact O-N 3.19Å; L153-F156 WeakPolarHBondContact O-CB 3.48Å; L153-F156 PolarHBondContact O-N 2.92Å; F156-S158 PolarHBondContact O-N 3.08Å; F156-H159 PolarHBondContact O-CD2 2.84Å; F156-F192 AromaticContact CE1-CE2 3.67Å; F156-F192 HydrophobicContact CE1-CE2 3.67Å; F156-F192 HydrophobicContact CE1-CZ 4.17Å; F156-F192 AromaticContact CZ-CE2 3.9Å; F156-F192 HydrophobicContact CZ-CE2 3.9Å; F156-I195 HydrophobicContact CE2-CG2 4.29Å; F156-I195 HydrophobicContact CZ-CG2 3.71Å; F156-L199 HydrophobicContact CD1-CD1 4.15Å; F156-L199 HydrophobicContact CE1-CD1 3.47Å; F156-L199 VanDerWaalsContact CE1-CD1 3.47Å; F156-L199 HydrophobicContact CE2-CD1 4.14Å; F156-L199 HydrophobicContact CZ-CD1 3.48Å; F156-L199 VanDerWaalsContact CZ-CD1 3.48Å
157D95.9Very high96.2Very high0 Ų060.9 Ų60.90%030%0.301CS..G310 helixtrans-72.7-5.9-179.9-68-58.3000113.4Y103 T107 Y110 L153 H159 F160Y103-D157 HydrophobicContact CD2-CB 3.87Å; Y103-D157 VanDerWaalsContact CD2-O 3.27Å; Y103-D157 WeakPolarHBondContact CD2-O 3.35Å; Y103-D157 HydrophobicContact CE2-CB 3.8Å; T107-D157 WeakPolarHBondContact CA-OD2 3.5Å; T107-D157 VanDerWaalsContact OG1-CB 3.28Å; T107-D157 WeakPolarHBondContact OG1-CB 3.18Å; T107-D157 PolarHBondContact OG1-OD2 2.94Å; Y110-D157 VanDerWaalsContact CD2-OD2 3.26Å; Y110-D157 WeakPolarHBondContact CD2-OD2 3.34Å; Y110-D157 WeakPolarHBondContact CE2-OD1 3.43Å; L153-D157 PolarHBondContact O-N 3.02Å; D157-H159 PolarHBondContact O-N 2.84Å; D157-F160 HydrophobicContact CB-CD2 4.27Å; D157-F160 HydrophobicContact CB-CE2 4.45Å; D157-F160 VanDerWaalsContact O-CD2 3.26Å; D157-F160 WeakPolarHBondContact O-CD2 3.44Å; D157-F160 PolarHBondContact O-N 3.3Å; D157-F160 VanDerWaalsContact O-N 3.1Å
158S96.7Very high95.8Very high35 Ų3559 Ų5925%0.24530%0.296CS..G310 helixtrans-58.6-16.1-179.470.40000113.7V155 F156 F160 F161 W162V155-S158 VanDerWaalsContact O-CB 3.29Å; V155-S158 WeakPolarHBondContact O-CB 3.4Å; V155-S158 PolarHBondContact O-N 3.07Å; V155-S158 PolarHBondContact O-OG 3.36Å; F156-S158 PolarHBondContact O-N 3.08Å; S158-F160 PolarHBondContact O-N 3.42Å; S158-F161 WeakPolarHBondContact O-CB 3.19Å; S158-F161 WeakPolarHBondContact O-CD2 3.48Å; S158-F161 PolarHBondContact O-N 3.45Å; S158-W162 VanDerWaalsContact O-CZ3 3.26Å; S158-W162 WeakPolarHBondContact O-CZ3 3.35Å
159H95.5Very high95Very high10 Ų1060.1 Ų60.15%0.04630%0.296CS..G310 helixtrans-58.7-27174.576.771.7000113.8F156 D157 F161 W162 T163 F187 F192F156-H159 PolarHBondContact O-CD2 2.84Å; D157-H159 PolarHBondContact O-N 2.84Å; H159-F161 PolarHBondContact O-N 2.94Å; H159-W162 VanDerWaalsContact CA-CZ2 3.46Å; H159-W162 HydrophobicContact CB-CD2 4.34Å; H159-W162 HydrophobicContact CB-CH2 4Å; H159-W162 HydrophobicContact CB-CZ2 3.5Å; H159-W162 CarbonylContact O-C 3.33Å; H159-W162 PolarHBondContact O-N 3.17Å; H159-T163 HydrophobicContact CB-CG2 4.1Å; H159-T163 PolarHBondContact ND1-OG1 3.5Å; H159-T163 WeakPolarHBondContact O-CG2 3.43Å; H159-T163 PolarHBondContact O-N 3.21Å; H159-T163 PolarHBondContact O-OG1 3.4Å; H159-T163 VanDerWaalsContact O-OG1 3.09Å; H159-F187 AromaticContact CE1-CE1 3.96Å; H159-F187 AromaticContact CG-CE1 3.9Å; H159-F187 AromaticContact ND1-CE1 3.84Å; H159-F192 AromaticContact CD2-CE2 3.92Å; H159-F192 AromaticContact CE1-CD2 3.85Å; H159-F192 AromaticContact CE1-CE2 3.8Å; H159-F192 AromaticContact NE2-CD2 3.35Å; H159-F192 VanDerWaalsContact NE2-CD2 3.35Å; H159-F192 WeakPolarHBondContact NE2-CD2 3.25Å; H159-F192 AromaticContact NE2-CE2 2.97Å; H159-F192 WeakPolarHBondContact NE2-CE2 3.21Å; H159-F192 AromaticContact NE2-CZ 3.49Å; H159-F192 WeakPolarHBondContact NE2-CZ 3.31Å
160F95.4Very high94.1Very high1 Ų161.8 Ų61.80%0.00431%0.308CS..Hα-helixtrans-57.8-23.7179.1-75.5-70.3000112.7P102 Y103 Y106 D157 S158 W162 M164 T188 F192P102-F160 HydrophobicContact CB-CD1 3.91Å; P102-F160 HydrophobicContact CB-CE1 3.86Å; P102-F160 HydrophobicContact CB-CG 4.46Å; P102-F160 HydrophobicContact CB-CZ 4.39Å; P102-F160 HydrophobicContact CG-CD1 4.09Å; Y103-F160 HydrophobicContact CD2-CB 4.48Å; Y103-F160 HydrophobicContact CD2-CD2 4.38Å; Y106-F160 HydrophobicContact CD2-CE1 4.17Å; Y106-F160 AromaticContact CD2-CE2 3.74Å; Y106-F160 HydrophobicContact CD2-CE2 3.74Å; Y106-F160 AromaticContact CD2-CZ 3.3Å; Y106-F160 HydrophobicContact CD2-CZ 3.3Å; Y106-F160 HydrophobicContact CE2-CE1 4.35Å; Y106-F160 AromaticContact CE2-CZ 3.75Å; Y106-F160 HydrophobicContact CE2-CZ 3.75Å; Y106-F160 HydrophobicContact CG-CE2 4.04Å; Y106-F160 AromaticContact CG-CZ 3.95Å; Y106-F160 HydrophobicContact CG-CZ 3.95Å; D157-F160 HydrophobicContact CB-CD2 4.27Å; D157-F160 HydrophobicContact CB-CE2 4.45Å; D157-F160 VanDerWaalsContact O-CD2 3.26Å; D157-F160 WeakPolarHBondContact O-CD2 3.44Å; D157-F160 PolarHBondContact O-N 3.3Å; D157-F160 VanDerWaalsContact O-N 3.1Å; S158-F160 PolarHBondContact O-N 3.42Å; F160-W162 VanDerWaalsContact C-N 3.3Å; F160-W162 PolarHBondContact O-N 3.04Å; F160-M164 HydrophobicContact CB-CG 4.32Å; F160-M164 HydrophobicContact CD1-CG 3.81Å; F160-M164 HydrophobicContact CD1-SD 3.99Å; F160-M164 HydrophobicContact CE1-SD 4.42Å; F160-M164 WeakPolarHBondContact O-CB 3.11Å; F160-M164 WeakPolarHBondContact O-CG 3.29Å; F160-M164 PolarHBondContact O-N 2.94Å; F160-T188 HydrophobicContact CD1-CG2 4.45Å; F160-T188 HydrophobicContact CE1-CG2 3.81Å; F160-F192 HydrophobicContact CE2-CE1 4.06Å; F160-F192 AromaticContact CE2-CZ 3.89Å; F160-F192 HydrophobicContact CE2-CZ 3.89Å; F160-F192 HydrophobicContact CZ-CD1 4.15Å; F160-F192 AromaticContact CZ-CE1 3.57Å; F160-F192 HydrophobicContact CZ-CE1 3.57Å; F160-F192 AromaticContact CZ-CZ 3.87Å; F160-F192 HydrophobicContact CZ-CZ 3.87Å
161F96.3Very high92.9Very high113 Ų11365.7 Ų65.750%0.49633%0.325SS..Hα-helixtrans-70-18.7173.9-72.2-96.1000114.6I99 Y103 S158 H159I99-F161 HydrophobicContact CG2-CB 4.37Å; I99-F161 HydrophobicContact CG2-CD1 3.67Å; I99-F161 HydrophobicContact CG2-CD2 4.22Å; I99-F161 HydrophobicContact CG2-CE1 3.92Å; I99-F161 HydrophobicContact CG2-CE2 4.44Å; I99-F161 HydrophobicContact CG2-CG 3.83Å; I99-F161 HydrophobicContact CG2-CZ 4.31Å; Y103-F161 AromaticContact CD1-CE2 3.82Å; Y103-F161 HydrophobicContact CD1-CE2 3.82Å; Y103-F161 HydrophobicContact CD1-CZ 4.2Å; Y103-F161 HydrophobicContact CD2-CD2 4.44Å; Y103-F161 AromaticContact CD2-CE2 3.95Å; Y103-F161 HydrophobicContact CD2-CE2 3.95Å; Y103-F161 AromaticContact CE1-CE2 3.84Å; Y103-F161 HydrophobicContact CE1-CE2 3.84Å; Y103-F161 HydrophobicContact CE1-CZ 4.25Å; Y103-F161 AromaticContact CE2-CE2 3.98Å; Y103-F161 HydrophobicContact CE2-CE2 3.98Å; Y103-F161 AromaticContact CG-CE2 3.86Å; Y103-F161 HydrophobicContact CG-CE2 3.86Å; Y103-F161 AromaticContact CZ-CE2 3.92Å; S158-F161 WeakPolarHBondContact O-CB 3.19Å; S158-F161 WeakPolarHBondContact O-CD2 3.48Å; S158-F161 PolarHBondContact O-N 3.45Å; H159-F161 PolarHBondContact O-N 2.94Å
162W95Very high91.4Very high175 Ų17563 Ų6366%0.66331%0.312SS*.Hα-helixtrans-125-5.9176.16980.4000114.1S158 H159 F160S158-W162 VanDerWaalsContact O-CZ3 3.26Å; S158-W162 WeakPolarHBondContact O-CZ3 3.35Å; H159-W162 VanDerWaalsContact CA-CZ2 3.46Å; H159-W162 HydrophobicContact CB-CD2 4.34Å; H159-W162 HydrophobicContact CB-CH2 4Å; H159-W162 HydrophobicContact CB-CZ2 3.5Å; H159-W162 CarbonylContact O-C 3.33Å; H159-W162 PolarHBondContact O-N 3.17Å; F160-W162 VanDerWaalsContact C-N 3.3Å; F160-W162 PolarHBondContact O-N 3.04Å
163T95Very high90Very high5 Ų562.5 Ų62.53%0.03132%0.318CS..Hα-helixtrans-104.5-9.1175.568.40000113.9H159 P184 S185 F187 T188H159-T163 HydrophobicContact CB-CG2 4.1Å; H159-T163 PolarHBondContact ND1-OG1 3.5Å; H159-T163 WeakPolarHBondContact O-CG2 3.43Å; H159-T163 PolarHBondContact O-N 3.21Å; H159-T163 PolarHBondContact O-OG1 3.4Å; H159-T163 VanDerWaalsContact O-OG1 3.09Å; T163-P184 CarbonylContact O-C 3.6Å; T163-S185 VanDerWaalsContact O-CB 3.3Å; T163-S185 WeakPolarHBondContact O-CB 3.47Å; T163-S185 PolarHBondContact O-N 2.91Å; T163-F187 HydrophobicContact CG2-CB 4.48Å; T163-F187 HydrophobicContact CG2-CD1 3.95Å; T163-T188 VanDerWaalsContact CB-OG1 3.25Å; T163-T188 WeakPolarHBondContact CB-OG1 3.25Å; T163-T188 PolarHBondContact OG1-OG1 3.22Å
164M94.9Very high88.9Confident11 Ų1168.1 Ų68.15%0.05435%0.354CS..EExtended strand (participates in β ladder)trans-103126.9169.1-57.9-55.1-60.900110.3I99 P102 F160 C182 P184 T188I99-M164 HydrophobicContact CG1-CB 4.24Å; P102-M164 HydrophobicContact CG-CE 4.48Å; P102-M164 HydrophobicContact CG-CG 4.09Å; P102-M164 HydrophobicContact CG-SD 4.46Å; F160-M164 HydrophobicContact CB-CG 4.32Å; F160-M164 HydrophobicContact CD1-CG 3.81Å; F160-M164 HydrophobicContact CD1-SD 3.99Å; F160-M164 HydrophobicContact CE1-SD 4.42Å; F160-M164 WeakPolarHBondContact O-CB 3.11Å; F160-M164 WeakPolarHBondContact O-CG 3.29Å; F160-M164 PolarHBondContact O-N 2.94Å; M164-C182 WeakPolarHBondContact CE-SG 3.41Å; M164-P184 HydrophobicContact CE-CB 4.25Å; M164-P184 HydrophobicContact SD-CB 4.09Å; M164-T188 HydrophobicContact SD-CG2 3.98Å
165N94.4Very high87.8Confident68 Ų6870 Ų7036%0.36437%0.365SS..EExtended strand (participates in β ladder)trans-116.5134.1-177.9-60.7-91.4000110.4C182 T183N165-C182 CarbonylContact O-C 3.6Å; N165-C182 WeakPolarHBondContact O-CA 3.34Å; N165-T183 PolarHBondContact N-O 2.99Å; N165-T183 PolarHBondContact O-N 2.8Å; N165-T183 PolarHBondContact O-OG1 3.25Å
166Y94.1Very high86.7Confident56 Ų5672.6 Ų72.622%0.2238%0.376CS..EExtended strand (participates in β ladder)trans-107.296178.1-172.8-102.1000109.5H92 Y93 S94 L95 C98 Y180H92-Y166 PolarHBondContact O-OH 3.1Å; Y93-Y166 PolarHBondContact O-OH 3.44Å; S94-Y166 PolarHBondContact N-OH 3.06Å; L95-Y166 HydrophobicContact CB-CD1 4.1Å; L95-Y166 HydrophobicContact CB-CG 4.16Å; L95-Y166 HydrophobicContact CD1-CG 4.43Å; C98-Y166 HydrophobicContact CB-CD2 3.91Å; Y166-Y180 AromaticContact CD1-CD1 3.88Å; Y166-Y180 HydrophobicContact CD1-CD1 3.88Å; Y166-Y180 AromaticContact CE1-CD1 3.34Å; Y166-Y180 HydrophobicContact CE1-CD1 3.34Å; Y166-Y180 HydrophobicContact CE1-CE1 4.07Å; Y166-Y180 AromaticContact CE1-CG 3.67Å; Y166-Y180 HydrophobicContact CE1-CG 3.67Å; Y166-Y180 AromaticContact CZ-CD1 3.94Å; Y166-Y180 AromaticContact CZ-CG 3.77Å; Y166-Y180 WeakPolarHBondContact OH-CB 3.48Å
167N91.2Very high85.8Confident83 Ų8371.3 Ų71.344%0.44438%0.375SS..EExtended strand (participates in β ladder)trans-114.4164.3-169.3-67.5-34000111.2Y180 K181 T183N167-Y180 CarbonylContact O-C 3.56Å; N167-Y180 VanDerWaalsContact O-CA 3.3Å; N167-Y180 WeakPolarHBondContact O-CA 3.48Å; N167-K181 PolarHBondContact N-O 2.95Å; N167-K181 PolarHBondContact O-N 2.95Å; N167-T183 PolarHBondContact ND2-OG1 2.95Å
168I88.6Confident85.1Confident78 Ų7874.4 Ų74.440%0.439%0.394SS..EExtended strand (participates in β ladder)trans-80128.1168.8-56.1175.9000107.8M171 Y179 Y180I168-M171 HydrophobicContact CD1-CE 3.69Å; I168-M171 HydrophobicContact CG2-CE 4.18Å; I168-M171 HydrophobicContact CG2-CG 4.05Å; I168-Y179 WeakPolarHBondContact CA-O 3.18Å; I168-Y180 HydrophobicContact CD1-CE1 4.42Å; I168-Y180 HydrophobicContact CG1-CD1 4.08Å; I168-Y180 HydrophobicContact CG1-CE1 3.72Å
169D82Confident84.4Confident89 Ų8978 Ų7848%0.47640%0.403SS..EExtended strand (participates in β ladder)trans-91.7-53.5178.9-160.546.2000110.4Y179 K181D169-Y179 PolarHBondContact N-O 2.94Å; D169-K181 HydrophobicContact CB-CB 3.88Å; D169-K181 HydrophobicContact CB-CD 3.86Å; D169-K181 WeakPolarHBondContact OD1-CD 3.42Å; D169-K181 IonicContact OD1-NZ 2.8Å; D169-K181 PolarHBondContact OD1-NZ 2.87Å; D169-K181 VanDerWaalsContact OD2-CD 3.26Å; D169-K181 WeakPolarHBondContact OD2-CD 3.33Å; D169-K181 IonicContact OD2-NZ 2.66Å; D169-K181 PolarHBondContact OD2-NZ 3.17Å
170T78.8Confident84.1Confident66 Ų6682.3 Ų82.341%0.40542%0.419SS..EExtended strand (participates in β ladder)trans-140.6138.7-177.6-55.40000110.7Y179T170-Y179 PolarHBondContact O-N 2.92Å
171M71.4Confident83.8Confident117 Ų11784.2 Ų84.258%0.57643%0.428SS*.EExtended strand (participates in β ladder)trans-104110.7165.3-62.1-165.1173.900109.2I168 S173 T178I168-M171 HydrophobicContact CD1-CE 3.69Å; I168-M171 HydrophobicContact CG2-CE 4.18Å; I168-M171 HydrophobicContact CG2-CG 4.05Å; M171-S173 PolarHBondContact O-N 3.4Å; M171-S173 VanDerWaalsContact O-N 3.09Å; M171-T178 HydrophobicContact CE-CG2 4.23Å; M171-T178 HydrophobicContact CG-CG2 4.17Å; M171-T178 HydrophobicContact SD-CG2 4.46Å
172N68Low83.7Confident53 Ų5378.9 Ų78.928%0.28340%0.404SS..EExtended strand (participates in β ladder)trans-82.686.3172.3-83.1-4.7000109.2T174 I175 N176 T177 Y179N172-T174 PolarHBondContact O-N 3.08Å; N172-I175 HydrophobicContact CB-CB 4.39Å; N172-I175 HydrophobicContact CB-CD1 4.48Å; N172-I175 HydrophobicContact CB-CG1 4.31Å; N172-I175 CarbonylContact O-C 3.57Å; N172-I175 PolarHBondContact O-N 3.36Å; N172-N176 PolarHBondContact O-N 3.13Å; N172-T177 PolarHBondContact N-O 3.11Å; N172-Y179 HydrophobicContact CB-CE2 4.1Å; N172-Y179 WeakPolarHBondContact ND2-CE2 3.34Å
173S68.4Low83.5Confident103 Ų10372 Ų7272%0.7238%0.382SS*.THydrogen-bonded Turntrans-57.6-16.3178-50.30000114.1M171M171-S173 PolarHBondContact O-N 3.4Å; M171-S173 VanDerWaalsContact O-N 3.09Å
174T73.9Confident83.4Confident131 Ų13173 Ų7380%0.80439%0.388SS*.THydrogen-bonded Turntrans-79.3-17.9173.146.50000114.1N172N172-T174 PolarHBondContact O-N 3.08Å
175I74.3Confident83.3Confident106 Ų10674.6 Ų74.654%0.54440%0.4SS..THydrogen-bonded Turntrans-125.6-6.1-175.8-41.3-178.9000111.1N172 T177N172-I175 HydrophobicContact CB-CB 4.39Å; N172-I175 HydrophobicContact CB-CD1 4.48Å; N172-I175 HydrophobicContact CB-CG1 4.31Å; N172-I175 CarbonylContact O-C 3.57Å; N172-I175 PolarHBondContact O-N 3.36Å; I175-T177 HydrophobicContact CB-CG2 4.4Å; I175-T177 HydrophobicContact CG2-CG2 3.96Å; I175-T177 PolarHBondContact O-N 3.19Å
176N75.5Confident83.2Confident150 Ų15079 Ų7980%0.80241%0.413SS*.THydrogen-bonded Turntrans54.326.5-169.9-74-21.3000114N172N172-N176 PolarHBondContact O-N 3.13Å
177T75.8Confident83.1Confident47 Ų4779.4 Ų79.429%0.28842%0.416SS..EExtended strand (participates in β ladder)trans-96.7132.1176.848.90000111.8N172 I175 Y179N172-T177 PolarHBondContact N-O 3.11Å; I175-T177 HydrophobicContact CB-CG2 4.4Å; I175-T177 HydrophobicContact CG2-CG2 3.96Å; I175-T177 PolarHBondContact O-N 3.19Å; T177-Y179 VanDerWaalsContact OG1-CE2 3.26Å; T177-Y179 WeakPolarHBondContact OG1-CE2 3.45Å; T177-Y179 PolarHBondContact OG1-OH 3.05Å
178T81.4Confident83.1Confident66 Ų6676.3 Ų76.341%0.40540%0.4SS..EExtended strand (participates in β ladder)trans-100120.5171.348.10000108.8M171M171-T178 HydrophobicContact CE-CG2 4.23Å; M171-T178 HydrophobicContact CG-CG2 4.17Å; M171-T178 HydrophobicContact SD-CG2 4.46Å
179Y83.5Confident83Confident110 Ų11077.2 Ų77.243%0.43140%0.403SS..EExtended strand (participates in β ladder)trans-95.2128.4176-65.2-87.5000109.4I168 D169 T170 N172 T177I168-Y179 WeakPolarHBondContact CA-O 3.18Å; D169-Y179 PolarHBondContact N-O 2.94Å; T170-Y179 PolarHBondContact O-N 2.92Å; N172-Y179 HydrophobicContact CB-CE2 4.1Å; N172-Y179 WeakPolarHBondContact ND2-CE2 3.34Å; T177-Y179 VanDerWaalsContact OG1-CE2 3.26Å; T177-Y179 WeakPolarHBondContact OG1-CE2 3.45Å; T177-Y179 PolarHBondContact OG1-OH 3.05Å
180Y87.9Confident83.1Confident100 Ų10075.5 Ų75.539%0.39240%0.395SS..EExtended strand (participates in β ladder)trans-103.1153.2178.2-67.4-96.4000110.9Y166 N167 I168Y166-Y180 AromaticContact CD1-CD1 3.88Å; Y166-Y180 HydrophobicContact CD1-CD1 3.88Å; Y166-Y180 AromaticContact CE1-CD1 3.34Å; Y166-Y180 HydrophobicContact CE1-CD1 3.34Å; Y166-Y180 HydrophobicContact CE1-CE1 4.07Å; Y166-Y180 AromaticContact CE1-CG 3.67Å; Y166-Y180 HydrophobicContact CE1-CG 3.67Å; Y166-Y180 AromaticContact CZ-CD1 3.94Å; Y166-Y180 AromaticContact CZ-CG 3.77Å; Y166-Y180 WeakPolarHBondContact OH-CB 3.48Å; N167-Y180 CarbonylContact O-C 3.56Å; N167-Y180 VanDerWaalsContact O-CA 3.3Å; N167-Y180 WeakPolarHBondContact O-CA 3.48Å; I168-Y180 HydrophobicContact CD1-CE1 4.42Å; I168-Y180 HydrophobicContact CG1-CD1 4.08Å; I168-Y180 HydrophobicContact CG1-CE1 3.72Å
181K89.8Confident83.6Confident42 Ų4275.8 Ų75.818%0.18339%0.394CS..EExtended strand (participates in β ladder)trans-145.7140.4-177.5-172.5170.6-175.81720110.9N167 D169 T183N167-K181 PolarHBondContact N-O 2.95Å; N167-K181 PolarHBondContact O-N 2.95Å; D169-K181 HydrophobicContact CB-CB 3.88Å; D169-K181 HydrophobicContact CB-CD 3.86Å; D169-K181 WeakPolarHBondContact OD1-CD 3.42Å; D169-K181 IonicContact OD1-NZ 2.8Å; D169-K181 PolarHBondContact OD1-NZ 2.87Å; D169-K181 VanDerWaalsContact OD2-CD 3.26Å; D169-K181 WeakPolarHBondContact OD2-CD 3.33Å; D169-K181 IonicContact OD2-NZ 2.66Å; D169-K181 PolarHBondContact OD2-NZ 3.17Å; K181-T183 HydrophobicContact CD-CG2 4.4Å; K181-T183 HydrophobicContact CG-CG2 4.1Å
182C93.6Very high84.5Confident0 Ų070.3 Ų70.30%037%0.367CS..EExtended strand (participates in β ladder)trans-87.1122.4171.5-168.10000108.7R91 H92 C98 M164 N165 Q493R91-C182 HydrophobicContact CB-CB 3.92Å; R91-C182 WeakPolarHBondContact O-CB 3.38Å; H92-C182 PolarHBondContact ND1-N 3.39Å; C98-C182 WeakPolarHBondContact CA-SG 3.48Å; C98-C182 HydrophobicContact CB-CB 3.72Å; C98-C182 WeakPolarHBondContact CB-SG 3.25Å; C98-C182 PolarHBondContact O-SG 2.94Å; C98-C182 VanDerWaalsContact O-SG 3.41Å; C98-C182 VanDerWaalsContact SG-CA 3.51Å; C98-C182 WeakPolarHBondContact SG-CB 3.48Å; C98-C182 CovalentContact SG-SG 2.04Å; C98-C182 PolarHBondContact SG-SG 2.98Å; M164-C182 WeakPolarHBondContact CE-SG 3.41Å; N165-C182 CarbonylContact O-C 3.6Å; N165-C182 WeakPolarHBondContact O-CA 3.34Å; C182-Q493 PolarHBondContact O-NE2 3.12Å
183T92.1Very high85.4Confident31 Ų3168.3 Ų68.319%0.1936%0.357CS..EExtended strand (participates in β ladder)trans-124.2122.2-176.551.20000110.2N165 N167 K181N165-T183 PolarHBondContact N-O 2.99Å; N165-T183 PolarHBondContact O-N 2.8Å; N165-T183 PolarHBondContact O-OG1 3.25Å; N167-T183 PolarHBondContact ND2-OG1 2.95Å; K181-T183 HydrophobicContact CD-CG2 4.4Å; K181-T183 HydrophobicContact CG-CG2 4.1Å
184P92.7Very high86.4Confident27 Ų2768.5 Ų68.518%0.17534%0.342CS..EExtended strand (participates in β ladder)trans-72.6145.917430.6-34.2000110.8T163 M164 T188 Q189T163-P184 CarbonylContact O-C 3.6Å; M164-P184 HydrophobicContact CE-CB 4.25Å; M164-P184 HydrophobicContact SD-CB 4.09Å; P184-T188 HydrophobicContact CB-CG2 3.85Å; P184-Q189 HydrophobicContact CB-CB 4.37Å; P184-Q189 HydrophobicContact CG-CB 4.12Å; P184-Q189 HydrophobicContact CG-CG 4.48Å
185S92.8Very high87.2Confident44 Ų4464.6 Ų64.631%0.30832%0.316SS..  trans-66.3156.3165.3174.10000110.7T163 F187 T188 Q189T163-S185 VanDerWaalsContact O-CB 3.3Å; T163-S185 WeakPolarHBondContact O-CB 3.47Å; T163-S185 PolarHBondContact O-N 2.91Å; S185-F187 PolarHBondContact O-N 3.35Å; S185-F187 VanDerWaalsContact O-N 3.07Å; S185-T188 PolarHBondContact O-N 3.41Å; S185-Q189 PolarHBondContact O-N 2.76Å
186Y91.2Very high88Confident159 Ų15960.7 Ų60.762%0.62430%0.296SS*.Hα-helixtrans-47.2-36.7172.6178.7-99.5000113.1T190 I191Y186-T190 HydrophobicContact CE2-CG2 3.85Å; Y186-T190 WeakPolarHBondContact O-CB 3.27Å; Y186-T190 PolarHBondContact O-N 2.97Å; Y186-I191 HydrophobicContact CD1-CD1 4.31Å; Y186-I191 HydrophobicContact CE1-CD1 4.02Å; Y186-I191 HydrophobicContact CE1-CG1 4.26Å
187F92.8Very high88.6Confident66 Ų6655 Ų5529%0.28927%0.266SS..Iπ-helixtrans-58.6-53.5173.5176.4-94.6000111.8H159 T163 S185 I191 F192 I195H159-F187 AromaticContact CE1-CE1 3.96Å; H159-F187 AromaticContact CG-CE1 3.9Å; H159-F187 AromaticContact ND1-CE1 3.84Å; T163-F187 HydrophobicContact CG2-CB 4.48Å; T163-F187 HydrophobicContact CG2-CD1 3.95Å; S185-F187 PolarHBondContact O-N 3.35Å; S185-F187 VanDerWaalsContact O-N 3.07Å; F187-I191 HydrophobicContact CD2-CB 3.98Å; F187-I191 HydrophobicContact CD2-CD1 4.19Å; F187-I191 HydrophobicContact CD2-CG2 4.06Å; F187-I191 HydrophobicContact CE2-CB 4.3Å; F187-I191 HydrophobicContact CE2-CG2 3.94Å; F187-I191 CarbonylContact O-C 3.35Å; F187-I191 WeakPolarHBondContact O-CA 3.42Å; F187-I191 WeakPolarHBondContact O-CB 3.22Å; F187-I191 PolarHBondContact O-N 3.41Å; F187-F192 HydrophobicContact CD1-CB 4.37Å; F187-F192 HydrophobicContact CE1-CB 4.04Å; F187-F192 AromaticContact CE1-CD2 3.81Å; F187-F192 HydrophobicContact CE1-CD2 3.81Å; F187-F192 HydrophobicContact CE1-CG 4.33Å; F187-F192 HydrophobicContact CZ-CB 4.49Å; F187-F192 HydrophobicContact CZ-CD2 4.14Å; F187-F192 PolarHBondContact O-N 3.42Å; F187-I195 HydrophobicContact CE2-CD1 4.22Å; F187-I195 HydrophobicContact CZ-CD1 4.02Å
188T90.7Very high89.3Confident18 Ų1856.6 Ų56.611%0.1127%0.272CS..Iπ-helixtrans-70-32.6-178.9-67.60000112.6F160 T163 M164 P184 S185 P193F160-T188 HydrophobicContact CD1-CG2 4.45Å; F160-T188 HydrophobicContact CE1-CG2 3.81Å; T163-T188 VanDerWaalsContact CB-OG1 3.25Å; T163-T188 WeakPolarHBondContact CB-OG1 3.25Å; T163-T188 PolarHBondContact OG1-OG1 3.22Å; M164-T188 HydrophobicContact SD-CG2 3.98Å; P184-T188 HydrophobicContact CB-CG2 3.85Å; S185-T188 PolarHBondContact O-N 3.41Å; T188-P193 WeakPolarHBondContact O-CD 3.49Å
189Q85.9Confident89.9Confident96 Ų9654.8 Ų54.845%0.44926%0.26SS..Iπ-helixtrans-81-30.5-178.7-168.8176.5-300113.8P184 S185P184-Q189 HydrophobicContact CB-CB 4.37Å; P184-Q189 HydrophobicContact CG-CB 4.12Å; P184-Q189 HydrophobicContact CG-CG 4.48Å; S185-Q189 PolarHBondContact O-N 2.76Å
190T84.4Confident90.2Very high53 Ų5349.9 Ų49.933%0.32524%0.241SC..Iπ-helixtrans-125.7-27.9-167.8-53.40000114.3Y186 Y194Y186-T190 HydrophobicContact CE2-CG2 3.85Å; Y186-T190 WeakPolarHBondContact O-CB 3.27Å; Y186-T190 PolarHBondContact O-N 2.97Å; T190-Y194 WeakPolarHBondContact O-CD2 3.28Å; T190-Y194 VanDerWaalsContact O-CE2 3.29Å; T190-Y194 WeakPolarHBondContact O-CE2 3.25Å
191I89.5Confident90.1Very high72 Ų7245.8 Ų45.837%0.36923%0.227SC..Iπ-helixtrans-102.7-49.2-176.8-58178000110.9Y186 F187 P193 Y194 I195Y186-I191 HydrophobicContact CD1-CD1 4.31Å; Y186-I191 HydrophobicContact CE1-CD1 4.02Å; Y186-I191 HydrophobicContact CE1-CG1 4.26Å; F187-I191 HydrophobicContact CD2-CB 3.98Å; F187-I191 HydrophobicContact CD2-CD1 4.19Å; F187-I191 HydrophobicContact CD2-CG2 4.06Å; F187-I191 HydrophobicContact CE2-CB 4.3Å; F187-I191 HydrophobicContact CE2-CG2 3.94Å; F187-I191 CarbonylContact O-C 3.35Å; F187-I191 WeakPolarHBondContact O-CA 3.42Å; F187-I191 WeakPolarHBondContact O-CB 3.22Å; F187-I191 PolarHBondContact O-N 3.41Å; I191-P193 VanDerWaalsContact C-CD 3.43Å; I191-Y194 PolarHBondContact O-N 2.91Å; I191-I195 HydrophobicContact CG2-CD1 4.2Å
192F90.4Very high90.1Very high2 Ų246.6 Ų46.61%0.00924%0.235CC..Hα-helixtrans-56.7-38.5-175.1-170.5-104000114.9Y106 Y110 F156 H159 F160 F187 Y194 I195 D196Y106-F192 AromaticContact CD1-CE1 3.92Å; Y106-F192 HydrophobicContact CD1-CE1 3.92Å; Y106-F192 HydrophobicContact CD1-CZ 4.47Å; Y106-F192 HydrophobicContact CD2-CE1 4.33Å; Y106-F192 AromaticContact CE1-CE1 3.94Å; Y106-F192 HydrophobicContact CE1-CE1 3.94Å; Y106-F192 HydrophobicContact CE2-CE1 4.34Å; Y106-F192 HydrophobicContact CG-CE1 4.12Å; Y110-F192 HydrophobicContact CE2-CZ 4.28Å; Y110-F192 WeakPolarHBondContact OH-CE1 3.35Å; Y110-F192 WeakPolarHBondContact OH-CZ 3.22Å; F156-F192 AromaticContact CE1-CE2 3.67Å; F156-F192 HydrophobicContact CE1-CE2 3.67Å; F156-F192 HydrophobicContact CE1-CZ 4.17Å; F156-F192 AromaticContact CZ-CE2 3.9Å; F156-F192 HydrophobicContact CZ-CE2 3.9Å; H159-F192 AromaticContact CD2-CE2 3.92Å; H159-F192 AromaticContact CE1-CD2 3.85Å; H159-F192 AromaticContact CE1-CE2 3.8Å; H159-F192 AromaticContact NE2-CD2 3.35Å; H159-F192 VanDerWaalsContact NE2-CD2 3.35Å; H159-F192 WeakPolarHBondContact NE2-CD2 3.25Å; H159-F192 AromaticContact NE2-CE2 2.97Å; H159-F192 WeakPolarHBondContact NE2-CE2 3.21Å; H159-F192 AromaticContact NE2-CZ 3.49Å; H159-F192 WeakPolarHBondContact NE2-CZ 3.31Å; F160-F192 HydrophobicContact CE2-CE1 4.06Å; F160-F192 AromaticContact CE2-CZ 3.89Å; F160-F192 HydrophobicContact CE2-CZ 3.89Å; F160-F192 HydrophobicContact CZ-CD1 4.15Å; F160-F192 AromaticContact CZ-CE1 3.57Å; F160-F192 HydrophobicContact CZ-CE1 3.57Å; F160-F192 AromaticContact CZ-CZ 3.87Å; F160-F192 HydrophobicContact CZ-CZ 3.87Å; F187-F192 HydrophobicContact CD1-CB 4.37Å; F187-F192 HydrophobicContact CE1-CB 4.04Å; F187-F192 AromaticContact CE1-CD2 3.81Å; F187-F192 HydrophobicContact CE1-CD2 3.81Å; F187-F192 HydrophobicContact CE1-CG 4.33Å; F187-F192 HydrophobicContact CZ-CB 4.49Å; F187-F192 HydrophobicContact CZ-CD2 4.14Å; F187-F192 PolarHBondContact O-N 3.42Å; F192-Y194 PolarHBondContact O-N 3.37Å; F192-Y194 VanDerWaalsContact O-N 3.17Å; F192-I195 CarbonylContact O-C 3.54Å; F192-I195 WeakPolarHBondContact O-CA 3.41Å; F192-I195 WeakPolarHBondContact O-CB 3.33Å; F192-I195 PolarHBondContact O-N 2.96Å; F192-D196 HydrophobicContact CD1-CB 4.43Å; F192-D196 HydrophobicContact CE1-CB 4.32Å; F192-D196 WeakPolarHBondContact O-CB 3.16Å; F192-D196 PolarHBondContact O-N 3.06Å
193P87.8Confident90.1Very high11 Ų1149.5 Ų49.57%0.07125%0.25CS..Hα-helixtrans-61.4-27.7179.9-24.635.9000113.8T188 I191 I195 L197 F344T188-P193 WeakPolarHBondContact O-CD 3.49Å; I191-P193 VanDerWaalsContact C-CD 3.43Å; P193-I195 VanDerWaalsContact C-N 3.35Å; P193-L197 VanDerWaalsContact O-CB 3.27Å; P193-L197 WeakPolarHBondContact O-CB 3.41Å; P193-L197 PolarHBondContact O-N 3.15Å; P193-F344 HydrophobicContact CB-CD1 4.26Å; P193-F344 HydrophobicContact CB-CD2 3.76Å; P193-F344 HydrophobicContact CB-CE1 3.87Å; P193-F344 HydrophobicContact CB-CE2 3.35Å; P193-F344 HydrophobicContact CB-CG 4.23Å; P193-F344 HydrophobicContact CB-CZ 3.42Å; P193-F344 VanDerWaalsContact CB-CZ 3.42Å; P193-F344 HydrophobicContact CG-CD1 4.32Å; P193-F344 HydrophobicContact CG-CE1 3.65Å; P193-F344 HydrophobicContact CG-CE2 4Å; P193-F344 HydrophobicContact CG-CZ 3.49Å; P193-F344 VanDerWaalsContact CG-CZ 3.49Å
194Y88.5Confident90.1Very high107 Ų10748 Ų4842%0.4224%0.241SC..Hα-helixtrans-73.9-25.9172.1-64.3-76.8000112.8T190 I191 F192 L198 F344T190-Y194 WeakPolarHBondContact O-CD2 3.28Å; T190-Y194 VanDerWaalsContact O-CE2 3.29Å; T190-Y194 WeakPolarHBondContact O-CE2 3.25Å; I191-Y194 PolarHBondContact O-N 2.91Å; F192-Y194 PolarHBondContact O-N 3.37Å; F192-Y194 VanDerWaalsContact O-N 3.17Å; Y194-L198 WeakPolarHBondContact O-CD1 2.97Å; Y194-L198 VanDerWaalsContact O-CG 3.28Å; Y194-L198 WeakPolarHBondContact O-CG 3.49Å; Y194-F344 HydrophobicContact CE1-CB 4.44Å
195I91.7Very high89.9Confident49 Ų4947 Ų4725%0.25124%0.235SC..Hα-helixtrans-81.3-43.6176.6-48.7174000109.9F156 F187 I191 F192 P193 L198 L199F156-I195 HydrophobicContact CE2-CG2 4.29Å; F156-I195 HydrophobicContact CZ-CG2 3.71Å; F187-I195 HydrophobicContact CE2-CD1 4.22Å; F187-I195 HydrophobicContact CZ-CD1 4.02Å; I191-I195 HydrophobicContact CG2-CD1 4.2Å; F192-I195 CarbonylContact O-C 3.54Å; F192-I195 WeakPolarHBondContact O-CA 3.41Å; F192-I195 WeakPolarHBondContact O-CB 3.33Å; F192-I195 PolarHBondContact O-N 2.96Å; P193-I195 VanDerWaalsContact C-N 3.35Å; I195-L198 WeakPolarHBondContact O-CB 3.26Å; I195-L198 PolarHBondContact O-N 3.44Å; I195-L198 VanDerWaalsContact O-N 3.13Å; I195-L199 HydrophobicContact CG2-CD1 3.93Å; I195-L199 HydrophobicContact CG2-CG 4.31Å; I195-L199 WeakPolarHBondContact O-CB 3.35Å; I195-L199 WeakPolarHBondContact O-CG 3.37Å; I195-L199 PolarHBondContact O-N 2.68Å
196D90.2Very high89.9Confident25 Ų2549.7 Ų49.713%0.13425%0.245CC..Hα-helixtrans-51.2-54.6169.5174.526000111.5Y106 Y110 F192 L198 L199 V200Y106-D196 HydrophobicContact CE1-CB 4.42Å; Y106-D196 WeakPolarHBondContact CE1-OD2 3.49Å; Y110-D196 WeakPolarHBondContact CE1-OD1 3.36Å; F192-D196 HydrophobicContact CD1-CB 4.43Å; F192-D196 HydrophobicContact CE1-CB 4.32Å; F192-D196 WeakPolarHBondContact O-CB 3.16Å; F192-D196 PolarHBondContact O-N 3.06Å; D196-L198 PolarHBondContact O-N 3.39Å; D196-L198 VanDerWaalsContact O-N 3.11Å; D196-L199 CarbonylContact O-C 3.47Å; D196-L199 PolarHBondContact O-N 3.36Å; D196-V200 WeakPolarHBondContact O-CB 3.32Å; D196-V200 PolarHBondContact O-N 3.32Å; D196-V200 WeakPolarHBondContact OD1-CG2 3.36Å
197L87.9Confident89.9Confident31 Ų3147.2 Ų47.216%0.16224%0.238CC..Hα-helixtrans-49-41.8173.8-175.876.9000113.2P193 C201 V202 L337 V341P193-L197 VanDerWaalsContact O-CB 3.27Å; P193-L197 WeakPolarHBondContact O-CB 3.41Å; P193-L197 PolarHBondContact O-N 3.15Å; L197-C201 PolarHBondContact O-N 2.9Å; L197-V202 HydrophobicContact CG-CG2 4.48Å; L197-V202 PolarHBondContact O-N 3.46Å; L197-V202 VanDerWaalsContact O-N 3.12Å; L197-L337 HydrophobicContact CD1-CB 3.97Å; L197-L337 HydrophobicContact CD1-CD2 3.84Å; L197-L337 HydrophobicContact CD1-CG 4.46Å; L197-V341 HydrophobicContact CD1-CG2 3.76Å; L197-V341 HydrophobicContact CD2-CG2 3.59Å; L197-V341 HydrophobicContact CG-CG2 4.35Å
198L91.2Very high89.8Confident79 Ų7944.1 Ų44.141%0.41422%0.224SC..Iπ-helixtrans-72.6-38.6178.1-69.2170.3000112.6Y194 I195 D196 V202 I203Y194-L198 WeakPolarHBondContact O-CD1 2.97Å; Y194-L198 VanDerWaalsContact O-CG 3.28Å; Y194-L198 WeakPolarHBondContact O-CG 3.49Å; I195-L198 WeakPolarHBondContact O-CB 3.26Å; I195-L198 PolarHBondContact O-N 3.44Å; I195-L198 VanDerWaalsContact O-N 3.13Å; D196-L198 PolarHBondContact O-N 3.39Å; D196-L198 VanDerWaalsContact O-N 3.11Å; L198-V202 HydrophobicContact CD2-CB 3.89Å; L198-V202 HydrophobicContact CD2-CG1 4.17Å; L198-V202 HydrophobicContact CD2-CG2 4.11Å; L198-V202 PolarHBondContact O-N 3.33Å; L198-I203 HydrophobicContact CB-CD1 4.27Å; L198-I203 WeakPolarHBondContact O-CB 3.1Å; L198-I203 WeakPolarHBondContact O-CG1 3.39Å; L198-I203 PolarHBondContact O-N 2.89Å
199L92.5Very high89.7Confident29 Ų2947.6 Ų47.615%0.15224%0.242CC..Iπ-helixtrans-85.3-26.4-175.1-70.3178.9000114.6Y110 W114 F156 I195 D196 P204Y110-L199 HydrophobicContact CE2-CD1 4.4Å; W114-L199 HydrophobicContact CZ2-CD2 4.17Å; W114-L199 PolarHBondContact NE1-O 3.44Å; W114-L199 VanDerWaalsContact NE1-O 3.1Å; F156-L199 HydrophobicContact CD1-CD1 4.15Å; F156-L199 HydrophobicContact CE1-CD1 3.47Å; F156-L199 VanDerWaalsContact CE1-CD1 3.47Å; F156-L199 HydrophobicContact CE2-CD1 4.14Å; F156-L199 HydrophobicContact CZ-CD1 3.48Å; F156-L199 VanDerWaalsContact CZ-CD1 3.48Å; I195-L199 HydrophobicContact CG2-CD1 3.93Å; I195-L199 HydrophobicContact CG2-CG 4.31Å; I195-L199 WeakPolarHBondContact O-CB 3.35Å; I195-L199 WeakPolarHBondContact O-CG 3.37Å; I195-L199 PolarHBondContact O-N 2.68Å; D196-L199 CarbonylContact O-C 3.47Å; D196-L199 PolarHBondContact O-N 3.36Å; L199-P204 WeakPolarHBondContact O-CD 3.19Å; L199-P204 WeakPolarHBondContact O-CG 3.17Å
200V90Very high90.1Very high7 Ų748.1 Ų48.14%0.04225%0.246CC..Iπ-helixtrans-87.3-44.3175.3169.80000111.7Y110 V113 D196 V333 W374Y110-V200 HydrophobicContact CD1-CG2 3.61Å; Y110-V200 HydrophobicContact CE1-CG2 3.45Å; Y110-V200 VanDerWaalsContact CE1-CG2 3.45Å; V113-V200 WeakPolarHBondContact CG1-O 3.38Å; D196-V200 WeakPolarHBondContact O-CB 3.32Å; D196-V200 PolarHBondContact O-N 3.32Å; D196-V200 WeakPolarHBondContact OD1-CG2 3.36Å; V200-V333 HydrophobicContact CG1-CG1 4.14Å; V200-W374 HydrophobicContact CG1-CH2 3.63Å; V200-W374 HydrophobicContact CG1-CZ3 3.6Å
201C87.2Confident90.4Very high14 Ų1445.9 Ų45.910%0.09523%0.234CC..Iπ-helixtrans-112.5-71.2178.9175.60000113.6L197 I203 P204 C205 L337L197-C201 PolarHBondContact O-N 2.9Å; C201-I203 VanDerWaalsContact C-N 3.25Å; C201-I203 CarbonylContact O-C 3.58Å; C201-I203 PolarHBondContact O-N 2.92Å; C201-P204 VanDerWaalsContact O-CD 3.25Å; C201-P204 WeakPolarHBondContact O-CD 3.15Å; C201-P204 VanDerWaalsContact O-N 3.15Å; C201-C205 WeakPolarHBondContact O-CB 3.48Å; C201-C205 PolarHBondContact O-N 3.07Å; C201-C205 PolarHBondContact O-SG 3.31Å; C201-C205 VanDerWaalsContact O-SG 3.35Å; C201-C205 PolarHBondContact SG-SG 3.12Å; C201-L337 HydrophobicContact CB-CD1 3.24Å; C201-L337 HydrophobicContact CB-CD2 3.45Å; C201-L337 VanDerWaalsContact CB-CD2 3.45Å; C201-L337 HydrophobicContact CB-CG 3.96Å; C201-L337 WeakPolarHBondContact SG-CD1 3.44Å
202V88.9Confident90.4Very high58 Ų5843 Ų4335%0.35222%0.219SC..Iπ-helixtrans-58.3-42.9-150.1-177.60000111.3L197 L198 L206L197-V202 HydrophobicContact CG-CG2 4.48Å; L197-V202 PolarHBondContact O-N 3.46Å; L197-V202 VanDerWaalsContact O-N 3.12Å; L198-V202 HydrophobicContact CD2-CB 3.89Å; L198-V202 HydrophobicContact CD2-CG1 4.17Å; L198-V202 HydrophobicContact CD2-CG2 4.11Å; L198-V202 PolarHBondContact O-N 3.33Å; V202-L206 HydrophobicContact CG1-CD1 4.21Å; V202-L206 WeakPolarHBondContact O-CB 3.46Å; V202-L206 WeakPolarHBondContact O-CD1 3.45Å; V202-L206 WeakPolarHBondContact O-CG 3.27Å; V202-L206 PolarHBondContact O-N 2.92Å
203I93Very high90.4Very high61 Ų6144.6 Ų44.631%0.31324%0.236SC..Hα-helixtrans-73.6-56.9176.8-59.4167.8000111.3W114 L198 C201 C205 L206 F207W114-I203 HydrophobicContact CH2-CG2 3.66Å; W114-I203 HydrophobicContact CZ2-CG2 4.14Å; L198-I203 HydrophobicContact CB-CD1 4.27Å; L198-I203 WeakPolarHBondContact O-CB 3.1Å; L198-I203 WeakPolarHBondContact O-CG1 3.39Å; L198-I203 PolarHBondContact O-N 2.89Å; C201-I203 VanDerWaalsContact C-N 3.25Å; C201-I203 CarbonylContact O-C 3.58Å; C201-I203 PolarHBondContact O-N 2.92Å; I203-C205 VanDerWaalsContact C-N 3.33Å; I203-C205 PolarHBondContact O-N 3.5Å; I203-L206 PolarHBondContact O-N 3.46Å; I203-F207 HydrophobicContact CG2-CD2 3.73Å; I203-F207 HydrophobicContact CG2-CE2 3.67Å; I203-F207 WeakPolarHBondContact O-CD2 3.21Å; I203-F207 PolarHBondContact O-N 2.92Å
204P92.8Very high90.7Very high0 Ų048.2 Ų48.20%025%0.254CS..Hα-helixtrans-48.6-46.2175-32.335.3000115.5V113 W114 V117 L199 C201 F207 M208V113-P204 HydrophobicContact CG1-CB 3.6Å; V113-P204 HydrophobicContact CG1-CG 3.44Å; V113-P204 VanDerWaalsContact CG1-CG 3.44Å; W114-P204 HydrophobicContact CZ2-CG 4.2Å; V117-P204 HydrophobicContact CG2-CB 3.64Å; V117-P204 HydrophobicContact CG2-CG 4.37Å; L199-P204 WeakPolarHBondContact O-CD 3.19Å; L199-P204 WeakPolarHBondContact O-CG 3.17Å; C201-P204 VanDerWaalsContact O-CD 3.25Å; C201-P204 WeakPolarHBondContact O-CD 3.15Å; C201-P204 VanDerWaalsContact O-N 3.15Å; P204-F207 PolarHBondContact O-N 2.8Å; P204-M208 HydrophobicContact CB-CE 4.08Å; P204-M208 WeakPolarHBondContact O-CB 3.44Å; P204-M208 WeakPolarHBondContact O-CG 3.2Å; P204-M208 PolarHBondContact O-N 3Å
205C89.7Confident90.7Very high6 Ų643.2 Ų43.24%0.04124%0.235CC..Hα-helixtrans-70.2-38.5-176.5-67.50000111.7C201 I203 M208 L209 M330C201-C205 WeakPolarHBondContact O-CB 3.48Å; C201-C205 PolarHBondContact O-N 3.07Å; C201-C205 PolarHBondContact O-SG 3.31Å; C201-C205 VanDerWaalsContact O-SG 3.35Å; C201-C205 PolarHBondContact SG-SG 3.12Å; I203-C205 VanDerWaalsContact C-N 3.33Å; I203-C205 PolarHBondContact O-N 3.5Å; C205-M208 PolarHBondContact O-N 3.32Å; C205-L209 VanDerWaalsContact O-CB 3.29Å; C205-L209 WeakPolarHBondContact O-CB 3.49Å; C205-L209 WeakPolarHBondContact O-CG 3.48Å; C205-L209 PolarHBondContact O-N 2.88Å; C205-M330 HydrophobicContact CB-CE 4.04Å; C205-M330 HydrophobicContact CB-SD 3.61Å; C205-M330 PolarHBondContact SG-SD 3.25Å
206L91.3Very high90.5Very high101 Ų10142.7 Ų42.753%0.52924%0.241SC..Hα-helixtrans-61.6-46.8170.1-74.5170.7000111.3V202 I203 M208 L209 I210V202-L206 HydrophobicContact CG1-CD1 4.21Å; V202-L206 WeakPolarHBondContact O-CB 3.46Å; V202-L206 WeakPolarHBondContact O-CD1 3.45Å; V202-L206 WeakPolarHBondContact O-CG 3.27Å; V202-L206 PolarHBondContact O-N 2.92Å; I203-L206 PolarHBondContact O-N 3.46Å; L206-M208 PolarHBondContact O-N 3.23Å; L206-L209 PolarHBondContact O-N 3.2Å; L206-I210 WeakPolarHBondContact O-CB 3.4Å; L206-I210 WeakPolarHBondContact O-CD1 3.45Å; L206-I210 VanDerWaalsContact O-CG1 3.24Å; L206-I210 WeakPolarHBondContact O-CG1 3.46Å; L206-I210 PolarHBondContact O-N 3.08Å
207F91.8Very high90.6Very high106 Ų10645.8 Ų45.847%0.46526%0.256SS..Hα-helixtrans-59.2-46.2175.6-88.7-74.9000112.2V117 I203 P204 A211V117-F207 HydrophobicContact CG1-CB 4Å; V117-F207 HydrophobicContact CG1-CG 4.42Å; I203-F207 HydrophobicContact CG2-CD2 3.73Å; I203-F207 HydrophobicContact CG2-CE2 3.67Å; I203-F207 WeakPolarHBondContact O-CD2 3.21Å; I203-F207 PolarHBondContact O-N 2.92Å; P204-F207 PolarHBondContact O-N 2.8Å; F207-A211 VanDerWaalsContact O-CB 3.26Å; F207-A211 WeakPolarHBondContact O-CB 3.47Å; F207-A211 PolarHBondContact O-N 3.03Å
208M90.4Very high90.6Very high2 Ų245.9 Ų45.91%0.0126%0.256CS..Hα-helixtrans-66.1-43.7178.9-74.8-170.9-78.600112.2L116 V117 T120 P204 C205 L206 I210 A211 N212 N326 F329L116-M208 HydrophobicContact CD2-CE 4.47Å; L116-M208 HydrophobicContact CD2-SD 3.91Å; L116-M208 HydrophobicContact CG-SD 3.92Å; V117-M208 HydrophobicContact CG2-CE 4.49Å; V117-M208 HydrophobicContact CG2-CG 4.26Å; T120-M208 HydrophobicContact CG2-CG 4.07Å; T120-M208 HydrophobicContact CG2-SD 4.42Å; P204-M208 HydrophobicContact CB-CE 4.08Å; P204-M208 WeakPolarHBondContact O-CB 3.44Å; P204-M208 WeakPolarHBondContact O-CG 3.2Å; P204-M208 PolarHBondContact O-N 3Å; C205-M208 PolarHBondContact O-N 3.32Å; L206-M208 PolarHBondContact O-N 3.23Å; M208-I210 PolarHBondContact O-N 3.07Å; M208-A211 PolarHBondContact O-N 3.19Å; M208-N212 VanDerWaalsContact O-CB 3.23Å; M208-N212 WeakPolarHBondContact O-CB 3.24Å; M208-N212 PolarHBondContact O-N 2.97Å; M208-N212 PolarHBondContact O-ND2 3.42Å; M208-N326 HydrophobicContact SD-CB 4.32Å; M208-F329 HydrophobicContact CE-CD1 3.62Å; M208-F329 HydrophobicContact CE-CE1 3.68Å; M208-F329 HydrophobicContact CE-CG 4.49Å
209L89.7Confident90.4Very high90 Ų9044.1 Ų44.147%0.47125%0.247SC..Hα-helixtrans-61.3-44.5177.5-74.1168.3000111.3C205 L206 G213C205-L209 VanDerWaalsContact O-CB 3.29Å; C205-L209 WeakPolarHBondContact O-CB 3.49Å; C205-L209 WeakPolarHBondContact O-CG 3.48Å; C205-L209 PolarHBondContact O-N 2.88Å; L206-L209 PolarHBondContact O-N 3.2Å; L209-G213 PolarHBondContact O-N 3.37Å
210I92.6Very high90.2Very high107 Ų10749.6 Ų49.655%0.54927%0.27SS..Hα-helixtrans-63.2-48.9175.9-66.8166000110.7L206 M208 G213 L214L206-I210 WeakPolarHBondContact O-CB 3.4Å; L206-I210 WeakPolarHBondContact O-CD1 3.45Å; L206-I210 VanDerWaalsContact O-CG1 3.24Å; L206-I210 WeakPolarHBondContact O-CG1 3.46Å; L206-I210 PolarHBondContact O-N 3.08Å; M208-I210 PolarHBondContact O-N 3.07Å; I210-G213 PolarHBondContact O-N 3.07Å; I210-L214 HydrophobicContact CG2-CD1 4.02Å; I210-L214 WeakPolarHBondContact O-CG 3.29Å; I210-L214 PolarHBondContact O-N 3.01Å
211A92.3Very high90.2Very high7 Ų757.1 Ų57.16%0.05830%0.297CS..Hα-helixtrans-60.6-48179.800000112.2A124 F207 M208 G213 L214 I215A124-A211 HydrophobicContact CB-CB 4.22Å; F207-A211 VanDerWaalsContact O-CB 3.26Å; F207-A211 WeakPolarHBondContact O-CB 3.47Å; F207-A211 PolarHBondContact O-N 3.03Å; M208-A211 PolarHBondContact O-N 3.19Å; A211-G213 PolarHBondContact O-N 3.39Å; A211-L214 PolarHBondContact O-N 3.3Å; A211-I215 WeakPolarHBondContact O-CB 3.5Å; A211-I215 WeakPolarHBondContact O-CD1 3.45Å; A211-I215 WeakPolarHBondContact O-CG1 3.05Å; A211-I215 PolarHBondContact O-N 2.95Å
212N89.2Confident90Very high12 Ų1259.2 Ų59.26%0.06431%0.306CS..Hα-helixtrans-65-38.6178.5-71.2-50.8000112M208 I215 G216 L323 N326M208-N212 VanDerWaalsContact O-CB 3.23Å; M208-N212 WeakPolarHBondContact O-CB 3.24Å; M208-N212 PolarHBondContact O-N 2.97Å; M208-N212 PolarHBondContact O-ND2 3.42Å; N212-I215 PolarHBondContact O-N 2.82Å; N212-G216 PolarHBondContact O-N 2.63Å; N212-L323 HydrophobicContact CB-CD2 3.75Å; N212-L323 WeakPolarHBondContact OD1-CD2 3.32Å; N212-N326 PolarHBondContact ND2-ND2 3.29Å; N212-N326 PolarHBondContact OD1-ND2 3.23Å
213G90.8Very high89.9Confident35 Ų3559 Ų5936%0.36131%0.308SS..Hα-helixtrans-61.5-48.5173.800000112.6L209 I210 A211 I215 G216 I217L209-G213 PolarHBondContact O-N 3.37Å; I210-G213 PolarHBondContact O-N 3.07Å; A211-G213 PolarHBondContact O-N 3.39Å; G213-I215 PolarHBondContact O-N 2.85Å; G213-G216 PolarHBondContact O-N 3.46Å; G213-I217 VanDerWaalsContact O-CG1 3.3Å; G213-I217 WeakPolarHBondContact O-CG1 3.21Å; G213-I217 PolarHBondContact O-N 2.98Å
214L92.1Very high89.7Confident86 Ų8658.8 Ų58.845%0.4531%0.307SS..Hα-helixtrans-60.1-43.3175.5-71171.7000112.1V128 I210 A211 Q218V128-L214 HydrophobicContact CG2-CB 4.2Å; I210-L214 HydrophobicContact CG2-CD1 4.02Å; I210-L214 WeakPolarHBondContact O-CG 3.29Å; I210-L214 PolarHBondContact O-N 3.01Å; A211-L214 PolarHBondContact O-N 3.3Å; L214-Q218 VanDerWaalsContact O-CB 3.25Å; L214-Q218 WeakPolarHBondContact O-CB 3.5Å; L214-Q218 PolarHBondContact O-N 3.3Å
215I89.5Confident89.4Confident3 Ų365.1 Ų65.12%0.01534%0.335CS..Hα-helixtrans-59.7-48.4174.6-72.4161.2000110.9A124 V127 A211 N212 G213 Q218 L219 T319A124-I215 HydrophobicContact CB-CD1 4Å; A124-I215 HydrophobicContact CB-CG1 4.02Å; V127-I215 HydrophobicContact CB-CG1 4.41Å; V127-I215 HydrophobicContact CG1-CG2 4.41Å; A211-I215 WeakPolarHBondContact O-CB 3.5Å; A211-I215 WeakPolarHBondContact O-CD1 3.45Å; A211-I215 WeakPolarHBondContact O-CG1 3.05Å; A211-I215 PolarHBondContact O-N 2.95Å; N212-I215 PolarHBondContact O-N 2.82Å; G213-I215 PolarHBondContact O-N 2.85Å; I215-Q218 PolarHBondContact O-N 2.93Å; I215-L219 HydrophobicContact CG2-CD1 4.21Å; I215-L219 HydrophobicContact CG2-CG 4.41Å; I215-L219 WeakPolarHBondContact O-CB 3.33Å; I215-L219 WeakPolarHBondContact O-CG 3.25Å; I215-L219 PolarHBondContact O-N 2.82Å; I215-T319 HydrophobicContact CG2-CG2 3.35Å
216G88.1Confident89.1Confident37 Ų3767.2 Ų67.238%0.38135%0.345SS..Hα-helixtrans-62.3-46.9-179.500000113.1N212 G213 Q218 L219 K220N212-G216 PolarHBondContact O-N 2.63Å; G213-G216 PolarHBondContact O-N 3.46Å; G216-Q218 VanDerWaalsContact C-N 3.3Å; G216-Q218 PolarHBondContact O-N 3.1Å; G216-L219 PolarHBondContact O-N 2.92Å; G216-K220 WeakPolarHBondContact O-CB 3.44Å; G216-K220 PolarHBondContact O-N 2.88Å
217I90.6Very high88.9Confident90 Ų9067.8 Ų67.846%0.46234%0.344SS..Hα-helixtrans-57.5-45.1174.9-69.7165.2000110.6G213 K220 R221G213-I217 VanDerWaalsContact O-CG1 3.3Å; G213-I217 WeakPolarHBondContact O-CG1 3.21Å; G213-I217 PolarHBondContact O-N 2.98Å; I217-K220 WeakPolarHBondContact O-CB 3.45Å; I217-K220 PolarHBondContact O-N 3.28Å; I217-R221 WeakPolarHBondContact O-CG 3.41Å; I217-R221 PolarHBondContact O-N 2.65Å
218Q89.1Confident88.8Confident33 Ų3369.7 Ų69.715%0.15435%0.352CS..Hα-helixtrans-74.1-37.1-176.3-175.671.5-16.100112.7V127 V128 L214 I215 G216 K220 R221 M222V127-Q218 HydrophobicContact CG1-CB 3.88Å; V127-Q218 HydrophobicContact CG1-CG 3.73Å; V127-Q218 VanDerWaalsContact O-CG 3.32Å; V127-Q218 WeakPolarHBondContact O-CG 3.49Å; V128-Q218 HydrophobicContact CG2-CB 4.37Å; V128-Q218 HydrophobicContact CG2-CG 4.49Å; L214-Q218 VanDerWaalsContact O-CB 3.25Å; L214-Q218 WeakPolarHBondContact O-CB 3.5Å; L214-Q218 PolarHBondContact O-N 3.3Å; I215-Q218 PolarHBondContact O-N 2.93Å; G216-Q218 VanDerWaalsContact C-N 3.3Å; G216-Q218 PolarHBondContact O-N 3.1Å; Q218-K220 VanDerWaalsContact C-N 3.33Å; Q218-K220 PolarHBondContact O-N 2.93Å; Q218-R221 WeakPolarHBondContact O-CB 3.23Å; Q218-R221 PolarHBondContact O-N 3.09Å; Q218-M222 HydrophobicContact CG-CE 4.12Å; Q218-M222 WeakPolarHBondContact O-CG 3.04Å; Q218-M222 PolarHBondContact O-N 3.02Å
219L86.1Confident88.5Confident43 Ų4375.8 Ų75.823%0.22538%0.375CS..Hα-helixtrans-63.7-37.7170.9-74.7-174.4000111.9V127 I215 G216 M222 S223 T319V127-L219 HydrophobicContact CG1-CD2 4.24Å; V127-L219 HydrophobicContact CG1-CG 4.27Å; I215-L219 HydrophobicContact CG2-CD1 4.21Å; I215-L219 HydrophobicContact CG2-CG 4.41Å; I215-L219 WeakPolarHBondContact O-CB 3.33Å; I215-L219 WeakPolarHBondContact O-CG 3.25Å; I215-L219 PolarHBondContact O-N 2.82Å; G216-L219 PolarHBondContact O-N 2.92Å; L219-M222 HydrophobicContact CD2-SD 4.42Å; L219-M222 PolarHBondContact O-N 2.87Å; L219-S223 WeakPolarHBondContact O-CB 3.33Å; L219-S223 PolarHBondContact O-N 3.49Å; L219-T319 HydrophobicContact CD1-CG2 3.61Å
220K88.4Confident88.3Confident144 Ų14477.4 Ų77.463%0.62638%0.38SS*.Hα-helixtrans-60.4-49.7171.7-174.7174.2179.2178.40111G216 I217 Q218 M222 S223 D224G216-K220 WeakPolarHBondContact O-CB 3.44Å; G216-K220 PolarHBondContact O-N 2.88Å; I217-K220 WeakPolarHBondContact O-CB 3.45Å; I217-K220 PolarHBondContact O-N 3.28Å; Q218-K220 VanDerWaalsContact C-N 3.33Å; Q218-K220 PolarHBondContact O-N 2.93Å; K220-M222 VanDerWaalsContact C-N 3.35Å; K220-M222 PolarHBondContact O-N 2.99Å; K220-S223 WeakPolarHBondContact O-CB 3.4Å; K220-S223 PolarHBondContact O-N 3.22Å; K220-S223 VanDerWaalsContact O-N 3.13Å; K220-D224 PolarHBondContact O-N 2.99Å
221R89.7Confident88.1Confident164 Ų16478.5 Ų78.562%0.61938%0.38SS*.Hα-helixtrans-55.4-44.7174.6-71.7168.7176.5176.3-1.2112.6I217 Q218 F225I217-R221 WeakPolarHBondContact O-CG 3.41Å; I217-R221 PolarHBondContact O-N 2.65Å; Q218-R221 WeakPolarHBondContact O-CB 3.23Å; Q218-R221 PolarHBondContact O-N 3.09Å; R221-F225 WeakPolarHBondContact O-CB 3.33Å; R221-F225 PolarHBondContact O-N 3.32Å
222M84.9Confident87.8Confident59 Ų5982.8 Ų82.829%0.29140%0.403SS..Hα-helixtrans-64.5-41.8175.8-71.2-175.1-175.800112.3V127 Q218 L219 K220 N226V127-M222 WeakPolarHBondContact O-CE 3.36Å; Q218-M222 HydrophobicContact CG-CE 4.12Å; Q218-M222 WeakPolarHBondContact O-CG 3.04Å; Q218-M222 PolarHBondContact O-N 3.02Å; L219-M222 HydrophobicContact CD2-SD 4.42Å; L219-M222 PolarHBondContact O-N 2.87Å; K220-M222 VanDerWaalsContact C-N 3.35Å; K220-M222 PolarHBondContact O-N 2.99Å; M222-N226 WeakPolarHBondContact O-CB 3.25Å; M222-N226 PolarHBondContact O-N 3.19Å; M222-N226 PolarHBondContact O-ND2 3.21Å
223S84.9Confident87.6Confident54 Ų5488.9 Ų88.938%0.37843%0.425SS..Hα-helixtrans-61.6-48.6176.7-170.80000111.2L219 K220 F225 N226 K227L219-S223 WeakPolarHBondContact O-CB 3.33Å; L219-S223 PolarHBondContact O-N 3.49Å; K220-S223 WeakPolarHBondContact O-CB 3.4Å; K220-S223 PolarHBondContact O-N 3.22Å; K220-S223 VanDerWaalsContact O-N 3.13Å; S223-F225 PolarHBondContact O-N 3Å; S223-N226 WeakPolarHBondContact O-CB 3.49Å; S223-N226 PolarHBondContact O-N 2.88Å; S223-N226 VanDerWaalsContact O-N 3.15Å; S223-K227 WeakPolarHBondContact O-CG 3.31Å; S223-K227 PolarHBondContact O-N 3.36Å
224D89Confident87.5Confident55 Ų5592.4 Ų92.429%0.29444%0.435SS..Hα-helixtrans-70.9-33.3-177.5-64.1-27.6000112.6K220 K227 K228K220-D224 PolarHBondContact O-N 2.99Å; D224-K227 PolarHBondContact O-N 3.43Å; D224-K227 IonicContact OD1-NZ 2.7Å; D224-K227 PolarHBondContact OD1-NZ 2.83Å; D224-K228 WeakPolarHBondContact O-CG 3.28Å; D224-K228 PolarHBondContact O-N 2.76Å
225F87.5Confident87.4Confident134 Ų13494.5 Ų94.559%0.58844%0.44SS*.Hα-helixtrans-63.1-42.4168.4-177.3-97.6000112R221 S223 K228 R229R221-F225 WeakPolarHBondContact O-CB 3.33Å; R221-F225 PolarHBondContact O-N 3.32Å; S223-F225 PolarHBondContact O-N 3Å; F225-K228 PolarHBondContact O-N 2.72Å; F225-R229 WeakPolarHBondContact O-CB 3.38Å; F225-R229 PolarHBondContact O-N 3.17Å
226N83Confident87.3Confident49 Ų49100.2 Ų100.226%0.26247%0.47SS..Hα-helixtrans-65.2-41.2176.3-79-48.6000112.4M222 S223 R229 Q230 M312M222-N226 WeakPolarHBondContact O-CB 3.25Å; M222-N226 PolarHBondContact O-N 3.19Å; M222-N226 PolarHBondContact O-ND2 3.21Å; S223-N226 WeakPolarHBondContact O-CB 3.49Å; S223-N226 PolarHBondContact O-N 2.88Å; S223-N226 VanDerWaalsContact O-N 3.15Å; N226-R229 PolarHBondContact O-N 3.19Å; N226-Q230 WeakPolarHBondContact O-CG 3.48Å; N226-Q230 PolarHBondContact O-N 2.84Å; N226-M312 PolarHBondContact ND2-SD 3.48Å
227K87.3Confident87.2Confident113 Ų113103 Ų10349%0.49148%0.476SS..Hα-helixtrans-59.4-48.3173-68170.7-164162.60111.4S223 D224 R229 Q230 K231S223-K227 WeakPolarHBondContact O-CG 3.31Å; S223-K227 PolarHBondContact O-N 3.36Å; D224-K227 PolarHBondContact O-N 3.43Å; D224-K227 IonicContact OD1-NZ 2.7Å; D224-K227 PolarHBondContact OD1-NZ 2.83Å; K227-R229 VanDerWaalsContact C-N 3.33Å; K227-R229 PolarHBondContact O-N 2.86Å; K227-Q230 PolarHBondContact O-N 3.02Å; K227-K231 PolarHBondContact O-N 2.95Å
228K89.1Confident87Confident146 Ų146104 Ų10464%0.63548%0.479SS*.Hα-helixtrans-57.4-44.9174.5-73.7176.6179.4-175.50111.3D224 F225 Q230 K231 N232D224-K228 WeakPolarHBondContact O-CG 3.28Å; D224-K228 PolarHBondContact O-N 2.76Å; F225-K228 PolarHBondContact O-N 2.72Å; K228-Q230 PolarHBondContact O-N 3.26Å; K228-K231 PolarHBondContact O-N 2.96Å; K228-N232 PolarHBondContact O-N 2.81Å; K228-N232 PolarHBondContact O-OD1 3Å
229R85.5Confident86.8Confident131 Ų131104.4 Ų104.449%0.49449%0.488SS..Hα-helixtrans-65.2-34.6177.7-165.7179.1-171.2-161.54.7113.3F225 N226 K227 R233F225-R229 WeakPolarHBondContact O-CB 3.38Å; F225-R229 PolarHBondContact O-N 3.17Å; N226-R229 PolarHBondContact O-N 3.19Å; K227-R229 VanDerWaalsContact C-N 3.33Å; K227-R229 PolarHBondContact O-N 2.86Å; R229-R233 WeakPolarHBondContact O-CG 3.39Å; R229-R233 PolarHBondContact O-N 3.22Å
230Q84.5Confident86.8Confident123 Ų123104.7 Ų104.758%0.57549%0.494SS*.Hα-helixtrans-69.3-47.1173.1-75.2172.8-18.800111.3N226 K227 K228 N232 R233 L234N226-Q230 WeakPolarHBondContact O-CG 3.48Å; N226-Q230 PolarHBondContact O-N 2.84Å; K227-Q230 PolarHBondContact O-N 3.02Å; K228-Q230 PolarHBondContact O-N 3.26Å; Q230-N232 VanDerWaalsContact C-N 3.35Å; Q230-N232 PolarHBondContact O-N 2.97Å; Q230-R233 WeakPolarHBondContact O-CB 3.38Å; Q230-R233 PolarHBondContact O-N 3.49Å; Q230-R233 VanDerWaalsContact O-N 3.13Å; Q230-L234 WeakPolarHBondContact O-CG 3.45Å; Q230-L234 PolarHBondContact O-N 3.16Å
231K88.5Confident86.5Confident130 Ų130102.3 Ų102.357%0.56549%0.486SS*.Hα-helixtrans-56.9-45.9175.8-174.4167.1179.8171.40111.7K227 K228 R233 L234 F235K227-K231 PolarHBondContact O-N 2.95Å; K228-K231 PolarHBondContact O-N 2.96Å; K231-R233 VanDerWaalsContact C-N 3.34Å; K231-R233 PolarHBondContact O-N 2.96Å; K231-L234 PolarHBondContact O-N 2.87Å; K231-F235 HydrophobicContact CD-CE2 4.18Å; K231-F235 HydrophobicContact CG-CD2 4.02Å; K231-F235 HydrophobicContact CG-CE2 3.65Å; K231-F235 HydrophobicContact CG-CZ 4.49Å; K231-F235 WeakPolarHBondContact O-CD2 3.29Å; K231-F235 PolarHBondContact O-N 3.4Å
232N86.6Confident86.3Confident98 Ų9899.8 Ų99.852%0.52448%0.481SS..Hα-helixtrans-64.7-34.7177.3-6919.2000112.8K228 Q230 L236K228-N232 PolarHBondContact O-N 2.81Å; K228-N232 PolarHBondContact O-OD1 3Å; Q230-N232 VanDerWaalsContact C-N 3.35Å; Q230-N232 PolarHBondContact O-N 2.97Å; N232-L236 WeakPolarHBondContact O-CB 3.29Å; N232-L236 VanDerWaalsContact O-CG 3.31Å; N232-L236 WeakPolarHBondContact O-CG 3.42Å; N232-L236 PolarHBondContact O-N 3.46Å
233R85.1Confident86.2Confident140 Ų140102.7 Ų102.753%0.52849%0.494SS..Hα-helixtrans-66.8-40172.5-79.2179.1171.1-160.6-3.1112.4R229 Q230 K231 L236 N237R229-R233 WeakPolarHBondContact O-CG 3.39Å; R229-R233 PolarHBondContact O-N 3.22Å; Q230-R233 WeakPolarHBondContact O-CB 3.38Å; Q230-R233 PolarHBondContact O-N 3.49Å; Q230-R233 VanDerWaalsContact O-N 3.13Å; K231-R233 VanDerWaalsContact C-N 3.34Å; K231-R233 PolarHBondContact O-N 2.96Å; R233-L236 PolarHBondContact O-N 2.86Å; R233-N237 WeakPolarHBondContact O-CB 3.41Å; R233-N237 VanDerWaalsContact O-CG 3.25Å; R233-N237 PolarHBondContact O-N 3.5Å; R233-N237 PolarHBondContact O-OD1 2.88Å
234L87.9Confident86Confident109 Ų109105.7 Ų105.757%0.57150%0.502SS*.Hα-helixtrans-65.3-39178-70.1167.8000112Q230 K231 H238Q230-L234 WeakPolarHBondContact O-CG 3.45Å; Q230-L234 PolarHBondContact O-N 3.16Å; K231-L234 PolarHBondContact O-N 2.87Å; L234-H238 PolarHBondContact O-N 3.39Å; L234-H238 PolarHBondContact O-ND1 2.84Å; L234-H238 VanDerWaalsContact O-ND1 3.13Å
235F89.4Confident85.5Confident129 Ų129108.4 Ų108.457%0.56651%0.513SS*.Hα-helixtrans-65.5-47.1172.5-76-53.6000112.8K231 N237 H238 A239K231-F235 HydrophobicContact CD-CE2 4.18Å; K231-F235 HydrophobicContact CG-CD2 4.02Å; K231-F235 HydrophobicContact CG-CE2 3.65Å; K231-F235 HydrophobicContact CG-CZ 4.49Å; K231-F235 WeakPolarHBondContact O-CD2 3.29Å; K231-F235 PolarHBondContact O-N 3.4Å; F235-N237 VanDerWaalsContact C-N 3.29Å; F235-N237 PolarHBondContact O-N 2.93Å; F235-H238 PolarHBondContact O-N 3.05Å; F235-A239 PolarHBondContact O-N 3.39Å
236L87.9Confident85.1Confident123 Ų123107.6 Ų107.664%0.64451%0.511SS*.Hα-helixtrans-60.4-39.8177.4-74.2167.7000111.8N232 R233 S240N232-L236 WeakPolarHBondContact O-CB 3.29Å; N232-L236 VanDerWaalsContact O-CG 3.31Å; N232-L236 WeakPolarHBondContact O-CG 3.42Å; N232-L236 PolarHBondContact O-N 3.46Å; R233-L236 PolarHBondContact O-N 2.86Å; L236-S240 WeakPolarHBondContact O-CB 3.42Å; L236-S240 PolarHBondContact O-N 3.31Å; L236-S240 PolarHBondContact O-OG 2.85Å
237N85.4Confident84.8Confident96 Ų96111.2 Ų111.251%0.51353%0.526SS..Hα-helixtrans-62.2-48.6173.5-73.312.2000111.3R233 F235 A239 S240 M241R233-N237 WeakPolarHBondContact O-CB 3.41Å; R233-N237 VanDerWaalsContact O-CG 3.25Å; R233-N237 PolarHBondContact O-N 3.5Å; R233-N237 PolarHBondContact O-OD1 2.88Å; F235-N237 VanDerWaalsContact C-N 3.29Å; F235-N237 PolarHBondContact O-N 2.93Å; N237-A239 PolarHBondContact O-N 3.37Å; N237-S240 PolarHBondContact O-N 3.02Å; N237-S240 PolarHBondContact O-OG 3.12Å; N237-M241 WeakPolarHBondContact O-CG 3.39Å; N237-M241 PolarHBondContact O-N 2.95Å
238H86.5Confident83.9Confident110 Ų110112.5 Ų112.551%0.50953%0.534SS..Hα-helixtrans-57.4-49.2177-90.676.3000112.7L234 F235 S240 M241 Q242L234-H238 PolarHBondContact O-N 3.39Å; L234-H238 PolarHBondContact O-ND1 2.84Å; L234-H238 VanDerWaalsContact O-ND1 3.13Å; F235-H238 PolarHBondContact O-N 3.05Å; H238-S240 VanDerWaalsContact C-N 3.28Å; H238-S240 PolarHBondContact O-N 3.39Å; H238-M241 PolarHBondContact O-N 3.13Å; H238-M241 VanDerWaalsContact O-N 3.14Å; H238-Q242 WeakPolarHBondContact O-CG 3.43Å; H238-Q242 PolarHBondContact O-N 3.1Å
239A86.8Confident82.6Confident42 Ų42112.3 Ų112.335%0.34754%0.536SS..Hα-helixtrans-58.5-40.2177.400000111.9F235 N237 Q242 Q243F235-A239 PolarHBondContact O-N 3.39Å; N237-A239 PolarHBondContact O-N 3.37Å; A239-Q242 PolarHBondContact O-N 3.38Å; A239-Q243 WeakPolarHBondContact O-CG 3.31Å; A239-Q243 PolarHBondContact O-N 2.88Å
240S84.5Confident81.3Confident50 Ų50114.2 Ų114.235%0.3555%0.55SS.*Hα-helixtrans-68.2-34.217771.50000113.7L236 N237 H238 Q244L236-S240 WeakPolarHBondContact O-CB 3.42Å; L236-S240 PolarHBondContact O-N 3.31Å; L236-S240 PolarHBondContact O-OG 2.85Å; N237-S240 PolarHBondContact O-N 3.02Å; N237-S240 PolarHBondContact O-OG 3.12Å; H238-S240 VanDerWaalsContact C-N 3.28Å; H238-S240 PolarHBondContact O-N 3.39Å; S240-Q244 WeakPolarHBondContact O-CG 3.36Å; S240-Q244 PolarHBondContact O-N 2.92Å; S240-Q244 VanDerWaalsContact O-N 3.12Å
241M82.7Confident79.9Confident94 Ų94116.1 Ų116.146%0.46356%0.559SS.*Hα-helixtrans-70.8-40174.3-66.1-168-50.400111.4N237 H238 Q243 Q244 Q245N237-M241 WeakPolarHBondContact O-CG 3.39Å; N237-M241 PolarHBondContact O-N 2.95Å; H238-M241 PolarHBondContact O-N 3.13Å; H238-M241 VanDerWaalsContact O-N 3.14Å; M241-Q243 PolarHBondContact O-N 2.94Å; M241-Q244 PolarHBondContact O-N 2.83Å; M241-Q245 WeakPolarHBondContact O-CG 3.33Å; M241-Q245 PolarHBondContact O-N 3.42Å
242Q84.8Confident77.9Confident111 Ų111117.9 Ų117.952%0.51957%0.569SS.*Hα-helixtrans-61.8-42.3175-72.7173.6-34.100111.7H238 A239 Q244 Q245 Q246H238-Q242 WeakPolarHBondContact O-CG 3.43Å; H238-Q242 PolarHBondContact O-N 3.1Å; A239-Q242 PolarHBondContact O-N 3.38Å; Q242-Q244 PolarHBondContact O-N 2.85Å; Q242-Q245 PolarHBondContact O-N 3.25Å; Q242-Q246 WeakPolarHBondContact O-CG 3.4Å; Q242-Q246 PolarHBondContact O-N 3.43Å
243Q82.7Confident75.9Confident119 Ų119119 Ų11956%0.55658%0.582SS**Hα-helixtrans-62.9-39.2174-74.6178.2-16.400112.6A239 M241 Q246 Q247A239-Q243 WeakPolarHBondContact O-CG 3.31Å; A239-Q243 PolarHBondContact O-N 2.88Å; M241-Q243 PolarHBondContact O-N 2.94Å; Q243-Q246 PolarHBondContact O-N 3.43Å; Q243-Q247 WeakPolarHBondContact O-CB 3.39Å; Q243-Q247 WeakPolarHBondContact O-CG 3.15Å; Q243-Q247 PolarHBondContact O-N 3.01Å
244Q81.4Confident74Confident117 Ų117118.8 Ų118.855%0.54760%0.596SS.*Hα-helixtrans-66.7-40.1175.4-74.7176-9.500112.3S240 M241 Q242 Q247 Q248S240-Q244 WeakPolarHBondContact O-CG 3.36Å; S240-Q244 PolarHBondContact O-N 2.92Å; S240-Q244 VanDerWaalsContact O-N 3.12Å; M241-Q244 PolarHBondContact O-N 2.83Å; Q242-Q244 PolarHBondContact O-N 2.85Å; Q244-Q247 PolarHBondContact O-N 3.5Å; Q244-Q248 WeakPolarHBondContact O-CG 3.4Å; Q244-Q248 PolarHBondContact O-N 3.13Å
245Q79.4Confident71.9Confident112 Ų112123 Ų12352%0.52361%0.613SS.*Hα-helixtrans-64.5-42.3175.2-73.3172.7-20.700111.9M241 Q242 Q248 Q249M241-Q245 WeakPolarHBondContact O-CG 3.33Å; M241-Q245 PolarHBondContact O-N 3.42Å; Q242-Q245 PolarHBondContact O-N 3.25Å; Q245-Q248 PolarHBondContact O-N 3.22Å; Q245-Q249 WeakPolarHBondContact O-CG 3.37Å; Q245-Q249 PolarHBondContact O-N 3.29Å
246Q78.5Confident69.5Low117 Ų117120.7 Ų120.755%0.54763%0.626SS.*Hα-helixtrans-63.2-41.8175.1-74.1173.2-15.100112.1Q242 Q243 Q248 Q249 Q250Q242-Q246 WeakPolarHBondContact O-CG 3.4Å; Q242-Q246 PolarHBondContact O-N 3.43Å; Q243-Q246 PolarHBondContact O-N 3.43Å; Q246-Q248 PolarHBondContact O-N 2.95Å; Q246-Q249 PolarHBondContact O-N 3.38Å; Q246-Q250 WeakPolarHBondContact O-CG 3.48Å; Q246-Q250 PolarHBondContact O-N 2.96Å
247Q76.9Confident66.9Low125 Ų125120.1 Ų120.158%0.58463%0.632SS**Hα-helixtrans-64.8-37.1175.6-74.4174.8-0.900112.5Q243 Q244 Q251Q243-Q247 WeakPolarHBondContact O-CB 3.39Å; Q243-Q247 WeakPolarHBondContact O-CG 3.15Å; Q243-Q247 PolarHBondContact O-N 3.01Å; Q244-Q247 PolarHBondContact O-N 3.5Å; Q247-Q251 PolarHBondContact O-N 2.78Å
248Q67.6Low64.8Low141 Ų141123.4 Ų123.466%0.65965%0.649SS**Hα-helixtrans-68.8-37.4173.9-74.1176-12.200112.4Q244 Q245 Q246 Q251Q244-Q248 WeakPolarHBondContact O-CG 3.4Å; Q244-Q248 PolarHBondContact O-N 3.13Å; Q245-Q248 PolarHBondContact O-N 3.22Å; Q246-Q248 PolarHBondContact O-N 2.95Å; Q248-Q251 PolarHBondContact O-N 3.34Å
249Q61.8Low62.4Low142 Ų142127.5 Ų127.566%0.66467%0.665SS**Hα-helixtrans-70.3-31176.3-73.9176.1-10.700113.1Q245 Q246 Q251Q245-Q249 WeakPolarHBondContact O-CG 3.37Å; Q245-Q249 PolarHBondContact O-N 3.29Å; Q246-Q249 PolarHBondContact O-N 3.38Å; Q249-Q251 VanDerWaalsContact C-N 3.25Å; Q249-Q251 PolarHBondContact O-N 2.83Å
250Q59.2Low59.7Low171 Ų171131.9 Ų131.980%0.79969%0.692SS**THydrogen-bonded Turntrans-78.2-5.5172.7-71.7-179-17.800113.8Q246Q246-Q250 WeakPolarHBondContact O-CG 3.48Å; Q246-Q250 PolarHBondContact O-N 2.96Å
251Q54.2Low57.3Low163 Ų163134.3 Ų134.376%0.76272%0.715SS**  trans-10849.6172.6-70-172.8-21.100111.7Q247 Q248 Q249 P253Q247-Q251 PolarHBondContact O-N 2.78Å; Q248-Q251 PolarHBondContact O-N 3.34Å; Q249-Q251 VanDerWaalsContact C-N 3.25Å; Q249-Q251 PolarHBondContact O-N 2.83Å; Q251-P253 VanDerWaalsContact O-CD 3.3Å; Q251-P253 WeakPolarHBondContact O-CD 3.3Å
252Q45.7Very low54.8Low166 Ų166136.5 Ų136.578%0.77674%0.738SS**  trans-83.3113.7163.2-76.3-170.1-12.500110.2
253P45.9Very low52.6Low123 Ų123135.5 Ų135.580%0.79975%0.749SS**  trans-77.2131.3172.231.4-33.2000110.6Q251 Q255Q251-P253 VanDerWaalsContact O-CD 3.3Å; Q251-P253 WeakPolarHBondContact O-CD 3.3Å; P253-Q255 PolarHBondContact O-N 3.44Å
254T45.5Very low50.2Low135 Ų135137.6 Ų137.683%0.82876%0.763SS**SBendtrans-68.2118.7167.8440000110.5
255Q43.5Very low48.1Very low196 Ų196138.5 Ų138.592%0.91678%0.777SS**SBendtrans55.9110.8164.8-61-179.9-12.200117.1P253P253-Q255 PolarHBondContact O-N 3.44Å
256G37.9Very low46.1Very low82 Ų82139.8 Ų139.885%0.84579%0.792SS**  trans17798169.700000113
257S34.1Very low44Very low110 Ų110137.9 Ų137.977%0.76980%0.804SS**  trans-79124.5175.4-178.10000110.9
258L40.3Very low41.9Very low166 Ų166141.4 Ų141.487%0.86982%0.818SS**  -163.7170.4119.1-125.374.2000111.5
259K37.6Very low40.3Very low196 Ų196142.9 Ų142.985%0.85283%0.829SS**  trans-102.2164.9-167.9-68.6175.8-179.81730113.7
260C29Very low38.9Very low133 Ų133141.5 Ų141.590%0.89983%0.83SS**  trans-32.8134.8175.9-51.90000116.9
261A35.5Very low37.7Very low102 Ų102140 Ų14084%0.84383%0.828SS**  trans-140.5107.5152.700000109.4
262C30.3Very low36.9Very low140 Ų140138.2 Ų138.295%0.94682%0.823SS**  trans-115.992.8170.7-164.60000107.2
263A37.3Very low36.5Very low90 Ų90134.9 Ų134.974%0.74481%0.814SS**  trans-145151.1-173.400000111.4
264L32.4Very low36Very low162 Ų162139.8 Ų139.885%0.84882%0.817SS**  trans-72.4139.1176.7-71.657000109.8
265T38.1Very low35.5Very low137 Ų137140.1 Ų140.184%0.8481%0.813SS**  -164.9134.711421.40000114.3
266T35.8Very low35.2Very low139 Ų139136.5 Ų136.585%0.85380%0.8SS**  trans-47.7152.9155.747.40000115
267G35.2Very low35Very low77 Ų77138.7 Ų138.779%0.79479%0.793SS**  trans139.3118.7143.700000116.3
268K32.4Very low35.3Very low199 Ų199140.6 Ų140.687%0.86579%0.794SS**  trans-51146.6168.9-60.5166.1171.9178.10112.7
269L34.2Very low35Very low172 Ų172140.9 Ų140.990%0.90179%0.793SS**  -146.3168119.2-135.470.7000109.8
270T32Very low35.1Very low112 Ų112136.2 Ų136.269%0.68778%0.783SS**  trans-133.7157.4-169.5460000111
271N34.4Very low35.2Very low139 Ų139136 Ų13674%0.74378%0.777SS**  trans72.7155.8173.1-66.528.7000114.5
272D37Very low35.2Very low126 Ų126138.7 Ų138.767%0.67478%0.778SS**  cis-150.114610.5-130.3-40.3000114.9
273T37.6Very low35.3Very low96 Ų96138.2 Ų138.259%0.58977%0.77SS**  trans58126.5135.2-75.80000124.7
274R35.3Very low35.1Very low226 Ų226139.8 Ų139.885%0.85378%0.776SS**  trans70.5155.4154.8-74.5162.7-162.5-1653.5120.2
275L35.7Very low35.1Very low143 Ų143135.6 Ų135.675%0.74977%0.771SS**  cis-170.2166.7-37.7-134.2132.1000108.6
276N36.3Very low35.1Very low120 Ų120135.3 Ų135.364%0.64276%0.763SS**  trans68.1148.2175.3-6256.1000115.5
277D35.4Very low34.9Very low128 Ų128137.7 Ų137.768%0.68477%0.765SS**  cis-154.7-175.2-12.6-101.2-23.7000110.7
278D38.7Very low34.8Very low150 Ų150141.4 Ų141.480%0.80276%0.756SS**  trans73.485.9163.6-63.1-33.5000122.1
279M35.7Very low35Very low172 Ų172137.9 Ų137.985%0.84775%0.753SS**  43.4138.6105.4-165.692.391.200120.5
280P39.1Very low35.6Very low98 Ų98137.9 Ų137.964%0.63674%0.741SS**  cis-137.1-163.2-33.541.7-23.1000113.7
281T31.5Very low36.2Very low127 Ų127142 Ų14278%0.77975%0.75SS**  trans73.7106.816764.10000120.2
282N33.9Very low36.3Very low160 Ų160146.1 Ų146.186%0.85676%0.755SS**  -160.7166.4111.8-131.1-60.4000113.9
283V33.9Very low36.6Very low129 Ų129144.8 Ų144.878%0.78275%0.754SS**  trans-93.2121.5-178.1176.20000111.2
284S33.1Very low37.3Very low124 Ų124147.2 Ų147.287%0.86776%0.757SS**  trans175.8135.9138.642.90000112.8
285G32.4Very low38.5Very low73 Ų73139 Ų13975%0.75373%0.734SS**  trans-155.211.4-177.900000116.4Q287G285-Q287 PolarHBondContact O-N 2.75Å
286I36.6Very low39.9Very low131 Ų131137.4 Ų137.467%0.67273%0.726SS**  trans-8094.3-177.4-54.6179.9000110.3Y288I286-Y288 HydrophobicContact CB-CE2 4.05Å; I286-Y288 HydrophobicContact CG2-CD2 3.99Å; I286-Y288 HydrophobicContact CG2-CE1 4.31Å; I286-Y288 HydrophobicContact CG2-CE2 3.5Å; I286-Y288 VanDerWaalsContact CG2-CE2 3.5Å; I286-Y288 VanDerWaalsContact O-CD2 3.26Å; I286-Y288 WeakPolarHBondContact O-CD2 3.25Å; I286-Y288 PolarHBondContact O-N 3.27Å; I286-Y288 VanDerWaalsContact O-N 3.11Å
287Q33.1Very low41.5Very low190 Ų190134.6 Ų134.689%0.88872%0.72SS**  trans-76.692.8-175.7-168.2176.312.900112.5G285 P289G285-Q287 PolarHBondContact O-N 2.75Å; Q287-P289 VanDerWaalsContact O-CD 3.26Å; Q287-P289 WeakPolarHBondContact O-CD 3.39Å
288Y33.1Very low43.1Very low154 Ų154134 Ų13460%0.60472%0.716SS**  trans-83.3114.6179.1-71.3-82.7000113.8I286 R290I286-Y288 HydrophobicContact CB-CE2 4.05Å; I286-Y288 HydrophobicContact CG2-CD2 3.99Å; I286-Y288 HydrophobicContact CG2-CE1 4.31Å; I286-Y288 HydrophobicContact CG2-CE2 3.5Å; I286-Y288 VanDerWaalsContact CG2-CE2 3.5Å; I286-Y288 VanDerWaalsContact O-CD2 3.26Å; I286-Y288 WeakPolarHBondContact O-CD2 3.25Å; I286-Y288 PolarHBondContact O-N 3.27Å; I286-Y288 VanDerWaalsContact O-N 3.11Å; Y288-R290 PolarHBondContact O-N 3.23Å
289P36.2Very low44.5Very low125 Ų125133.4 Ų133.481%0.81271%0.706SS**  trans-77.248.1176.133.2-37.1000113.5Q287Q287-P289 VanDerWaalsContact O-CD 3.26Å; Q287-P289 WeakPolarHBondContact O-CD 3.39Å
290R45.7Very low45.9Very low172 Ų172130.9 Ų130.965%0.64969%0.692SS**  trans-88.4-8.7-162.6-120.4172.6179.9174.30.5116.7Y288Y288-R290 PolarHBondContact O-N 3.23Å
291K44.7Very low47.4Very low198 Ų198130 Ų13086%0.86169%0.687SS**Hα-helixtrans-81.5-46.1-173.6-72.6-176.3178.8176.80114.3
292R37Very low49.2Very low226 Ų226127.4 Ų127.485%0.85367%0.671SS**Hα-helixtrans-67.6-40.9-171.4-153.9173.7-169.4174.22.9113.1K294 S295R292-K294 PolarHBondContact O-N 2.96Å; R292-S295 PolarHBondContact O-N 3.09Å
293C43.1Very low50.9Low98 Ų98127 Ų12766%0.66266%0.662SS**Hα-helixtrans-65.9-36.3-176.7-163.50000113.4S295 N296 A297C293-S295 VanDerWaalsContact C-N 3.28Å; C293-S295 PolarHBondContact O-N 2.74Å; C293-N296 PolarHBondContact O-N 2.76Å; C293-A297 PolarHBondContact O-N 3Å
294K53.3Low52.5Low147 Ų147124.4 Ų124.464%0.63964%0.644SS**Hα-helixtrans-59.3-35.3176.9-74.4-173.5174.9-173.50113R292 L298R292-K294 PolarHBondContact O-N 2.96Å; K294-L298 VanDerWaalsContact O-CB 3.3Å; K294-L298 WeakPolarHBondContact O-CB 3.3Å; K294-L298 PolarHBondContact O-N 3.33Å
295S59.4Low54.1Low55 Ų55121.5 Ų121.539%0.38562%0.623SS.*Hα-helixtrans-64.4-46.8-178.3-172.30000112.2R292 C293 L298 K299R292-S295 PolarHBondContact O-N 3.09Å; C293-S295 VanDerWaalsContact C-N 3.28Å; C293-S295 PolarHBondContact O-N 2.74Å; S295-L298 PolarHBondContact O-N 2.92Å; S295-K299 WeakPolarHBondContact O-CB 3.47Å; S295-K299 WeakPolarHBondContact O-CG 3.42Å; S295-K299 PolarHBondContact O-N 2.98Å
296N65.5Low55.5Low109 Ų109123.2 Ų123.258%0.58361%0.614SS**Hα-helixtrans-68.7-41-179.8-71.7-3.7000111.9C293 L298 K299 H300C293-N296 PolarHBondContact O-N 2.76Å; N296-L298 PolarHBondContact O-N 3.15Å; N296-K299 PolarHBondContact O-N 3.33Å; N296-H300 WeakPolarHBondContact O-CB 3.48Å; N296-H300 PolarHBondContact O-N 2.91Å
297A70.7Confident56.7Low61 Ų61123.3 Ų123.350%0.50461%0.61SS.*Hα-helixtrans-61-43174.400000112.2C293 H300 C301C293-A297 PolarHBondContact O-N 3Å; A297-H300 PolarHBondContact O-N 2.9Å; A297-C301 WeakPolarHBondContact O-CB 3.38Å; A297-C301 PolarHBondContact O-N 3.21Å
298L69.3Low58.1Low114 Ų114116.1 Ų116.160%0.59759%0.586SS**Hα-helixtrans-65.3-46176.6-176.262.1000111.8K294 S295 N296 H300 C301 V302K294-L298 VanDerWaalsContact O-CB 3.3Å; K294-L298 WeakPolarHBondContact O-CB 3.3Å; K294-L298 PolarHBondContact O-N 3.33Å; S295-L298 PolarHBondContact O-N 2.92Å; N296-L298 PolarHBondContact O-N 3.15Å; L298-H300 VanDerWaalsContact C-N 3.31Å; L298-H300 PolarHBondContact O-N 3.07Å; L298-C301 PolarHBondContact O-N 2.91Å; L298-V302 HydrophobicContact CD1-CG2 4.3Å; L298-V302 HydrophobicContact CG-CG2 4.48Å; L298-V302 WeakPolarHBondContact O-CG2 3.34Å; L298-V302 PolarHBondContact O-N 2.94Å
299K67.1Low59.5Low139 Ų139117 Ų11760%0.60459%0.589SS**Hα-helixtrans-56.4-43.4174.6-74.9175.8-179.8-176.80111.8S295 N296 K303S295-K299 WeakPolarHBondContact O-CB 3.47Å; S295-K299 WeakPolarHBondContact O-CG 3.42Å; S295-K299 PolarHBondContact O-N 2.98Å; N296-K299 PolarHBondContact O-N 3.33Å; K299-K303 WeakPolarHBondContact O-CB 3.28Å; K299-K303 PolarHBondContact O-N 2.96Å
300H66Low60.6Low118 Ų118113.7 Ų113.755%0.54657%0.569SS.*Hα-helixtrans-66.5-43.4177.1-171.3-132.3000112.2N296 A297 L298 K303 N304N296-H300 WeakPolarHBondContact O-CB 3.48Å; N296-H300 PolarHBondContact O-N 2.91Å; A297-H300 PolarHBondContact O-N 2.9Å; L298-H300 VanDerWaalsContact C-N 3.31Å; L298-H300 PolarHBondContact O-N 3.07Å; H300-K303 PolarHBondContact O-N 2.61Å; H300-N304 PolarHBondContact CE1-ND2 2.96Å; H300-N304 PolarHBondContact NE2-ND2 3.14Å; H300-N304 VanDerWaalsContact NE2-ND2 3.13Å; H300-N304 WeakPolarHBondContact O-CB 3.37Å; H300-N304 VanDerWaalsContact O-CG 3.3Å; H300-N304 PolarHBondContact O-N 3.02Å; H300-N304 PolarHBondContact O-ND2 3.11Å
301C69.2Low61.5Low80 Ų80110 Ų11054%0.54156%0.562SS.*Hα-helixtrans-60.5-45175.4-174.40000112.2A297 L298 N304 S305A297-C301 WeakPolarHBondContact O-CB 3.38Å; A297-C301 PolarHBondContact O-N 3.21Å; L298-C301 PolarHBondContact O-N 2.91Å; C301-N304 PolarHBondContact O-N 3.41Å; C301-S305 WeakPolarHBondContact O-CB 3.47Å; C301-S305 PolarHBondContact O-N 3.37Å
302V70.1Confident62.4Low73 Ų73104.2 Ų104.244%0.44254%0.538SS..Hα-helixtrans-63.2-47.9175.71710000111L298 N304 S305 I306L298-V302 HydrophobicContact CD1-CG2 4.3Å; L298-V302 HydrophobicContact CG-CG2 4.48Å; L298-V302 WeakPolarHBondContact O-CG2 3.34Å; L298-V302 PolarHBondContact O-N 2.94Å; V302-N304 VanDerWaalsContact C-N 3.3Å; V302-N304 PolarHBondContact O-N 3.22Å; V302-S305 PolarHBondContact O-N 3.46Å; V302-S305 VanDerWaalsContact O-N 3.15Å; V302-I306 HydrophobicContact CG1-CD1 3.74Å; V302-I306 HydrophobicContact CG1-CG1 4.4Å; V302-I306 WeakPolarHBondContact O-CG1 3.35Å; V302-I306 PolarHBondContact O-N 2.81Å
303K68.5Low63.7Low150 Ų15097.8 Ų97.865%0.65252%0.521SS*.Hα-helixtrans-56.7-42.6176.4-173.2174.1-177.8176.30111.9K299 H300 I306 K307K299-K303 WeakPolarHBondContact O-CB 3.28Å; K299-K303 PolarHBondContact O-N 2.96Å; H300-K303 PolarHBondContact O-N 2.61Å; K303-I306 PolarHBondContact O-N 3.26Å; K303-K307 WeakPolarHBondContact O-CB 3.48Å; K303-K307 PolarHBondContact O-N 3.38Å
304N68.4Low64.8Low76 Ų7696.3 Ų96.341%0.40650%0.502SS..Hα-helixtrans-71.9-35.6177.5-69.7-20.2000112.6H300 C301 V302 K307 G308H300-N304 PolarHBondContact CE1-ND2 2.96Å; H300-N304 PolarHBondContact NE2-ND2 3.14Å; H300-N304 VanDerWaalsContact NE2-ND2 3.13Å; H300-N304 WeakPolarHBondContact O-CB 3.37Å; H300-N304 VanDerWaalsContact O-CG 3.3Å; H300-N304 PolarHBondContact O-N 3.02Å; H300-N304 PolarHBondContact O-ND2 3.11Å; C301-N304 PolarHBondContact O-N 3.41Å; V302-N304 VanDerWaalsContact C-N 3.3Å; V302-N304 PolarHBondContact O-N 3.22Å; N304-K307 PolarHBondContact O-N 2.86Å; N304-G308 PolarHBondContact O-N 2.9Å
305S65.7Low65.5Low62 Ų6291 Ų9143%0.43448%0.483SS..Hα-helixtrans-66.6-37.1173.2-168.70000112.4C301 V302 R309C301-S305 WeakPolarHBondContact O-CB 3.47Å; C301-S305 PolarHBondContact O-N 3.37Å; V302-S305 PolarHBondContact O-N 3.46Å; V302-S305 VanDerWaalsContact O-N 3.15Å; S305-R309 PolarHBondContact O-N 3.28Å
306I62.5Low66Low110 Ų11091.2 Ų91.256%0.56448%0.484SS*.Hα-helixtrans-67-49174.2-68.2166.7000109.7V302 K303 G308 R309 S310V302-I306 HydrophobicContact CG1-CD1 3.74Å; V302-I306 HydrophobicContact CG1-CG1 4.4Å; V302-I306 WeakPolarHBondContact O-CG1 3.35Å; V302-I306 PolarHBondContact O-N 2.81Å; K303-I306 PolarHBondContact O-N 3.26Å; I306-G308 VanDerWaalsContact C-N 3.29Å; I306-G308 PolarHBondContact O-N 3.02Å; I306-R309 PolarHBondContact O-N 3.47Å; I306-R309 VanDerWaalsContact O-N 3.12Å; I306-S310 PolarHBondContact O-N 3.01Å; I306-S310 PolarHBondContact O-OG 2.95Å
307K62.3Low66.3Low132 Ų13286.8 Ų86.857%0.57446%0.462SS*.Hα-helixtrans-60.9-36.3177.4-170171.7-178.6175.90112.6K303 N304 S310 N311K303-K307 WeakPolarHBondContact O-CB 3.48Å; K303-K307 PolarHBondContact O-N 3.38Å; N304-K307 PolarHBondContact O-N 2.86Å; K307-S310 WeakPolarHBondContact CA-OG 3.41Å; K307-S310 PolarHBondContact O-OG 3.44Å; K307-N311 WeakPolarHBondContact O-CB 3.35Å; K307-N311 PolarHBondContact O-N 3.06Å; K307-N311 PolarHBondContact O-OD1 2.86Å
308G61.4Low66.5Low39 Ų3985 Ų8540%0.40244%0.444SS..Hα-helixtrans-63-48.1171.600000112.4N304 I306 N311 M312N304-G308 PolarHBondContact O-N 2.9Å; I306-G308 VanDerWaalsContact C-N 3.29Å; I306-G308 PolarHBondContact O-N 3.02Å; G308-N311 PolarHBondContact O-N 3.39Å; G308-M312 WeakPolarHBondContact O-CB 3.49Å; G308-M312 PolarHBondContact O-N 3.18Å
309R62.9Low66.9Low174 Ų17479.7 Ų79.766%0.65742%0.416SS*.Hα-helixtrans-65.3-40.4178.3-166.5177-174.3-176.70.8112.4S305 I306 M312 N313S305-R309 PolarHBondContact O-N 3.28Å; I306-R309 PolarHBondContact O-N 3.47Å; I306-R309 VanDerWaalsContact O-N 3.12Å; R309-M312 PolarHBondContact O-N 3.48Å; R309-N313 WeakPolarHBondContact O-CB 3.1Å; R309-N313 VanDerWaalsContact O-CG 3.3Å; R309-N313 PolarHBondContact O-N 3.48Å; R309-N313 PolarHBondContact O-OD1 2.8Å
310S60.4Low67.5Low55 Ų5575.2 Ų75.239%0.38541%0.405SS..Hα-helixtrans-65.1-39.9176.2620000112.2I306 K307 R314I306-S310 PolarHBondContact O-N 3.01Å; I306-S310 PolarHBondContact O-OG 2.95Å; K307-S310 WeakPolarHBondContact CA-OG 3.41Å; K307-S310 PolarHBondContact O-OG 3.44Å; S310-R314 WeakPolarHBondContact O-CB 3.11Å; S310-R314 PolarHBondContact O-N 3.32Å
311N63Low68.2Low94 Ų9469.8 Ų69.850%0.50338%0.38SS..Hα-helixtrans-66.8-42.2176-74.89000111.7K307 G308 R314 S315K307-N311 WeakPolarHBondContact O-CB 3.35Å; K307-N311 PolarHBondContact O-N 3.06Å; K307-N311 PolarHBondContact O-OD1 2.86Å; G308-N311 PolarHBondContact O-N 3.39Å; N311-R314 PolarHBondContact O-N 3.15Å; N311-S315 WeakPolarHBondContact O-CB 3.32Å; N311-S315 PolarHBondContact O-N 2.86Å
312M64.3Low68.9Low76 Ų7666.2 Ų66.237%0.37436%0.355SS..Hα-helixtrans-62.7-44.3176-170.8-179.373.500111.8N226 G308 R309 S315 S316N226-M312 PolarHBondContact ND2-SD 3.48Å; G308-M312 WeakPolarHBondContact O-CB 3.49Å; G308-M312 PolarHBondContact O-N 3.18Å; R309-M312 PolarHBondContact O-N 3.48Å; M312-S315 PolarHBondContact O-N 3.32Å; M312-S316 WeakPolarHBondContact O-CB 3.37Å; M312-S316 PolarHBondContact O-N 2.98Å
313N64.2Low69.6Low91 Ų9165.3 Ų65.349%0.48735%0.348SS..Hα-helixtrans-63.5-41.3175.6-72.417.5000111.9R309 S317R309-N313 WeakPolarHBondContact O-CB 3.1Å; R309-N313 VanDerWaalsContact O-CG 3.3Å; R309-N313 PolarHBondContact O-N 3.48Å; R309-N313 PolarHBondContact O-OD1 2.8Å; N313-S317 WeakPolarHBondContact O-CB 3.39Å; N313-S317 PolarHBondContact O-N 3.23Å
314R66.7Low70.5Confident68 Ų6859.6 Ų59.626%0.25733%0.329SS..Hα-helixtrans-62.1-43.3173.9-177.6170.8-174.4-169.61.2111.5L51 S310 N311 L318L51-R314 PolarHBondContact O-NH2 2.88Å; S310-R314 WeakPolarHBondContact O-CB 3.11Å; S310-R314 PolarHBondContact O-N 3.32Å; N311-R314 PolarHBondContact O-N 3.15Å; R314-L318 HydrophobicContact CG-CD1 4.03Å; R314-L318 WeakPolarHBondContact O-CG 3.15Å; R314-L318 PolarHBondContact O-N 3.49Å
315S68Low71.4Confident34 Ų3456 Ų5624%0.23831%0.31CS..Hα-helixtrans-63.6-47.9178.2-160.10000111.6N311 M312 S317 L318 T319N311-S315 WeakPolarHBondContact O-CB 3.32Å; N311-S315 PolarHBondContact O-N 2.86Å; M312-S315 PolarHBondContact O-N 3.32Å; S315-S317 PolarHBondContact O-N 3.42Å; S315-L318 PolarHBondContact O-N 3.19Å; S315-T319 WeakPolarHBondContact O-CB 3.29Å; S315-T319 PolarHBondContact O-N 3.39Å; S315-T319 PolarHBondContact O-OG1 2.96Å; S315-T319 VanDerWaalsContact O-OG1 3.08Å
316S69.2Low72.4Confident60 Ų6053.2 Ų53.242%0.4229%0.29SS..Hα-helixtrans-61.5-43.5179.3-171.40000112.3M312 T319 A320M312-S316 WeakPolarHBondContact O-CB 3.37Å; M312-S316 PolarHBondContact O-N 2.98Å; S316-T319 PolarHBondContact O-N 3.41Å; S316-A320 PolarHBondContact O-N 3.08Å
317S72.8Confident73.6Confident17 Ų1752.5 Ų52.512%0.11929%0.285CS..Hα-helixtrans-63.3-42.8176.2172.80000112.9N313 S315 M321 P390N313-S317 WeakPolarHBondContact O-CB 3.39Å; N313-S317 PolarHBondContact O-N 3.23Å; S315-S317 PolarHBondContact O-N 3.42Å; S317-M321 WeakPolarHBondContact O-CB 3.38Å; S317-M321 PolarHBondContact O-N 3.45Å; S317-P390 WeakPolarHBondContact OG-CD 3.09Å
318L73.9Confident74.9Confident22 Ų2249 Ų4912%0.11527%0.27CS..Hα-helixtrans-68.1-36.9176-70.2171.6000111.4R314 S315 M321 L322R314-L318 HydrophobicContact CG-CD1 4.03Å; R314-L318 WeakPolarHBondContact O-CG 3.15Å; R314-L318 PolarHBondContact O-N 3.49Å; S315-L318 PolarHBondContact O-N 3.19Å; L318-M321 HydrophobicContact CD2-CE 4.02Å; L318-M321 HydrophobicContact CD2-SD 4.3Å; L318-M321 WeakPolarHBondContact O-CB 3.37Å; L318-M321 PolarHBondContact O-N 2.83Å; L318-L322 WeakPolarHBondContact O-CD1 3.4Å; L318-L322 VanDerWaalsContact O-CG 3.26Å; L318-L322 WeakPolarHBondContact O-CG 3.44Å; L318-L322 PolarHBondContact O-N 3.49Å
319T77.9Confident76.2Confident4 Ų447.6 Ų47.63%0.02525%0.253CS..Hα-helixtrans-61.9-47.6173.8-66.90000112.2I215 L219 S315 S316 M321 L322 L323I215-T319 HydrophobicContact CG2-CG2 3.35Å; L219-T319 HydrophobicContact CD1-CG2 3.61Å; S315-T319 WeakPolarHBondContact O-CB 3.29Å; S315-T319 PolarHBondContact O-N 3.39Å; S315-T319 PolarHBondContact O-OG1 2.96Å; S315-T319 VanDerWaalsContact O-OG1 3.08Å; S316-T319 PolarHBondContact O-N 3.41Å; T319-M321 PolarHBondContact O-N 3.18Å; T319-L322 PolarHBondContact O-N 3.42Å; T319-L323 HydrophobicContact CG2-CD1 3.69Å; T319-L323 HydrophobicContact CG2-CG 4.15Å; T319-L323 WeakPolarHBondContact O-CB 3.29Å; T319-L323 WeakPolarHBondContact O-CG 3.42Å; T319-L323 PolarHBondContact O-N 2.04Å
320A79.4Confident77.4Confident45 Ų4541.8 Ų41.837%0.37223%0.234SC..Hα-helixtrans-60.2-37.5178.900000112.1S316 A324S316-A320 PolarHBondContact O-N 3.08Å; A320-A324 WeakPolarHBondContact O-CB 3.49Å; A320-A324 PolarHBondContact O-N 2.88Å; A320-A324 VanDerWaalsContact O-N 3.08Å
321M82.2Confident78.7Confident4 Ų444.9 Ų44.92%0.0225%0.245CC..Hα-helixtrans-61.7-46.6174-171.2-172.287.700112.5L60 S317 L318 T319 A324 I325 Y385 S388L60-M321 HydrophobicContact CD1-CE 3.76Å; S317-M321 WeakPolarHBondContact O-CB 3.38Å; S317-M321 PolarHBondContact O-N 3.45Å; L318-M321 HydrophobicContact CD2-CE 4.02Å; L318-M321 HydrophobicContact CD2-SD 4.3Å; L318-M321 WeakPolarHBondContact O-CB 3.37Å; L318-M321 PolarHBondContact O-N 2.83Å; T319-M321 PolarHBondContact O-N 3.18Å; M321-A324 PolarHBondContact O-N 3.02Å; M321-I325 HydrophobicContact CG-CD1 4.27Å; M321-I325 WeakPolarHBondContact O-CD1 3.41Å; M321-I325 WeakPolarHBondContact O-CG1 3.25Å; M321-I325 PolarHBondContact O-N 3.26Å; M321-Y385 HydrophobicContact CE-CD1 3.73Å; M321-Y385 HydrophobicContact CE-CE1 3.9Å; M321-Y385 HydrophobicContact CG-CD1 3.76Å; M321-Y385 HydrophobicContact SD-CD1 3.53Å; M321-Y385 VanDerWaalsContact SD-CD1 3.53Å; M321-Y385 HydrophobicContact SD-CE1 4.32Å; M321-Y385 HydrophobicContact SD-CG 4.29Å; M321-S388 VanDerWaalsContact CA-CB 3.46Å
322L82.6Confident80Confident4 Ų440.6 Ų40.62%0.02122%0.222CC..Hα-helixtrans-70.1-41.7179.4-65.9154.6000112.1V119 R123 L318 T319 A324 I325 N326V119-L322 HydrophobicContact CB-CD2 4.49Å; V119-L322 HydrophobicContact CG1-CD2 3.84Å; V119-L322 HydrophobicContact CG2-CD2 3.91Å; R123-L322 HydrophobicContact CB-CD1 3.8Å; R123-L322 HydrophobicContact CG-CD1 3.45Å; R123-L322 VanDerWaalsContact CG-CD1 3.45Å; L318-L322 WeakPolarHBondContact O-CD1 3.4Å; L318-L322 VanDerWaalsContact O-CG 3.26Å; L318-L322 WeakPolarHBondContact O-CG 3.44Å; L318-L322 PolarHBondContact O-N 3.49Å; T319-L322 PolarHBondContact O-N 3.42Å; L322-A324 VanDerWaalsContact C-N 3.27Å; L322-A324 PolarHBondContact O-N 3.41Å; L322-I325 PolarHBondContact O-N 3.19Å; L322-N326 WeakPolarHBondContact O-CB 3.26Å; L322-N326 PolarHBondContact O-N 3.46Å; L322-N326 PolarHBondContact O-ND2 2.8Å; L322-N326 PolarHBondContact O-OD1 2.9Å
323L85.7Confident81.1Confident54 Ų5437 Ų3728%0.28320%0.204SC..Hα-helixtrans-56.5-42.8173.6-73.7168.7000111.1N212 T319 M327N212-L323 HydrophobicContact CB-CD2 3.75Å; N212-L323 WeakPolarHBondContact OD1-CD2 3.32Å; T319-L323 HydrophobicContact CG2-CD1 3.69Å; T319-L323 HydrophobicContact CG2-CG 4.15Å; T319-L323 WeakPolarHBondContact O-CB 3.29Å; T319-L323 WeakPolarHBondContact O-CG 3.42Å; T319-L323 PolarHBondContact O-N 2.04Å; L323-M327 VanDerWaalsContact O-CB 3.29Å; L323-M327 WeakPolarHBondContact O-CB 3.5Å; L323-M327 WeakPolarHBondContact O-CG 3.43Å; L323-M327 PolarHBondContact O-N 3.15Å
324A86.7Confident82.2Confident30 Ų3035.6 Ų35.625%0.24820%0.201CC..Hα-helixtrans-63.1-41.5176.800000112.9A320 M321 L322 F328A320-A324 WeakPolarHBondContact O-CB 3.49Å; A320-A324 PolarHBondContact O-N 2.88Å; A320-A324 VanDerWaalsContact O-N 3.08Å; M321-A324 PolarHBondContact O-N 3.02Å; L322-A324 VanDerWaalsContact C-N 3.27Å; L322-A324 PolarHBondContact O-N 3.41Å; A324-F328 WeakPolarHBondContact O-CB 3.05Å; A324-F328 PolarHBondContact O-N 3.34Å
325I87Confident83.4Confident2 Ų234.3 Ų34.31%0.0120%0.202CC..Hα-helixtrans-69.8-46.6179.6-63.5157.8000111.1L116 M321 L322 M327 F328 F329 L384 Y385L116-I325 HydrophobicContact CD1-CG2 3.7Å; L116-I325 HydrophobicContact CD2-CG2 4.31Å; M321-I325 HydrophobicContact CG-CD1 4.27Å; M321-I325 WeakPolarHBondContact O-CD1 3.41Å; M321-I325 WeakPolarHBondContact O-CG1 3.25Å; M321-I325 PolarHBondContact O-N 3.26Å; L322-I325 PolarHBondContact O-N 3.19Å; I325-M327 VanDerWaalsContact C-N 3.33Å; I325-M327 PolarHBondContact O-N 3.27Å; I325-F328 PolarHBondContact O-N 3.02Å; I325-F329 WeakPolarHBondContact O-CB 3.25Å; I325-F329 PolarHBondContact O-N 3Å; I325-L384 HydrophobicContact CB-CD1 4.34Å; I325-L384 HydrophobicContact CG1-CB 3.86Å; I325-L384 HydrophobicContact CG1-CD1 3.73Å; I325-L384 HydrophobicContact CG1-CG 4.46Å; I325-Y385 HydrophobicContact CD1-CD1 3.79Å; I325-Y385 HydrophobicContact CD1-CE1 3.34Å
326N87.3Confident84.3Confident3 Ų333.2 Ų33.22%0.01619%0.193CC..Hα-helixtrans-61.6-42.5178-59.2-25.1000111.1T120 M208 N212 L322 F329 M330T120-N326 WeakPolarHBondContact CG2-ND2 3.29Å; T120-N326 VanDerWaalsContact CG2-OD1 3.31Å; T120-N326 WeakPolarHBondContact CG2-OD1 3.38Å; M208-N326 HydrophobicContact SD-CB 4.32Å; N212-N326 PolarHBondContact ND2-ND2 3.29Å; N212-N326 PolarHBondContact OD1-ND2 3.23Å; L322-N326 WeakPolarHBondContact O-CB 3.26Å; L322-N326 PolarHBondContact O-N 3.46Å; L322-N326 PolarHBondContact O-ND2 2.8Å; L322-N326 PolarHBondContact O-OD1 2.9Å; N326-F329 PolarHBondContact O-N 2.84Å; N326-M330 VanDerWaalsContact O-CG 3.31Å; N326-M330 WeakPolarHBondContact O-CG 3.48Å; N326-M330 PolarHBondContact O-N 2.97Å
327M86.7Confident85.1Confident95 Ų9531.4 Ų31.447%0.46818%0.179SC..Hα-helixtrans-68.3-37.1176.8-67.6-67.9170.400111.8L323 I325 M330 I331L323-M327 VanDerWaalsContact O-CB 3.29Å; L323-M327 WeakPolarHBondContact O-CB 3.5Å; L323-M327 WeakPolarHBondContact O-CG 3.43Å; L323-M327 PolarHBondContact O-N 3.15Å; I325-M327 VanDerWaalsContact C-N 3.33Å; I325-M327 PolarHBondContact O-N 3.27Å; M327-M330 PolarHBondContact O-N 3.38Å; M327-I331 WeakPolarHBondContact O-CD1 3.03Å; M327-I331 WeakPolarHBondContact O-CG1 3.29Å; M327-I331 PolarHBondContact O-N 3.44Å; M327-I331 VanDerWaalsContact O-N 3.16Å
328F90.4Very high85.7Confident58 Ų5834.3 Ų34.325%0.25420%0.195SC..Hα-helixtrans-61.4-48.9172.4-173-87.3000111A324 I325 M330 I331 S332 T376 N377 V380 L384A324-F328 WeakPolarHBondContact O-CB 3.05Å; A324-F328 PolarHBondContact O-N 3.34Å; I325-F328 PolarHBondContact O-N 3.02Å; F328-M330 PolarHBondContact O-N 2.71Å; F328-I331 WeakPolarHBondContact O-CA 3.35Å; F328-I331 PolarHBondContact O-N 2.95Å; F328-S332 PolarHBondContact O-N 2.93Å; F328-S332 PolarHBondContact O-OG 3.47Å; F328-T376 WeakPolarHBondContact CZ-OG1 3.35Å; F328-N377 WeakPolarHBondContact CD1-OD1 3.27Å; F328-N377 WeakPolarHBondContact CE1-OD1 3.42Å; F328-V380 HydrophobicContact CD1-CG2 3.61Å; F328-V380 HydrophobicContact CD2-CG2 4.47Å; F328-V380 HydrophobicContact CE1-CG1 4.32Å; F328-V380 HydrophobicContact CE1-CG2 3.5Å; F328-V380 VanDerWaalsContact CE1-CG2 3.5Å; F328-V380 HydrophobicContact CE2-CG1 4.39Å; F328-V380 HydrophobicContact CE2-CG2 4.37Å; F328-V380 HydrophobicContact CG-CG2 4.12Å; F328-V380 HydrophobicContact CZ-CG1 3.95Å; F328-V380 HydrophobicContact CZ-CG2 3.91Å; F328-L384 HydrophobicContact CB-CD1 4.04Å; F328-L384 HydrophobicContact CG-CD1 4.32Å
329F89.6Confident86.4Confident9 Ų934.2 Ų34.24%0.03919%0.194CC..Hα-helixtrans-55.1-46.7176.2-176.8-90000112.2V113 L116 M208 I325 N326 I331 S332 V333V113-F329 HydrophobicContact CB-CZ 4.46Å; V113-F329 HydrophobicContact CG1-CZ 4.01Å; V113-F329 HydrophobicContact CG2-CE2 3.79Å; V113-F329 HydrophobicContact CG2-CZ 3.74Å; L116-F329 HydrophobicContact CD2-CB 4.11Å; L116-F329 HydrophobicContact CD2-CD2 3.99Å; L116-F329 HydrophobicContact CD2-CG 3.99Å; M208-F329 HydrophobicContact CE-CD1 3.62Å; M208-F329 HydrophobicContact CE-CE1 3.68Å; M208-F329 HydrophobicContact CE-CG 4.49Å; I325-F329 WeakPolarHBondContact O-CB 3.25Å; I325-F329 PolarHBondContact O-N 3Å; N326-F329 PolarHBondContact O-N 2.84Å; F329-I331 PolarHBondContact O-N 3.48Å; F329-S332 WeakPolarHBondContact CA-OG 3.32Å; F329-S332 PolarHBondContact O-N 3.12Å; F329-S332 PolarHBondContact O-OG 3.3Å; F329-V333 HydrophobicContact CD1-CG2 4.16Å; F329-V333 HydrophobicContact CD2-CG2 3.75Å; F329-V333 HydrophobicContact CE1-CB 4.49Å; F329-V333 HydrophobicContact CE1-CG2 4.04Å; F329-V333 HydrophobicContact CE2-CG2 3.61Å; F329-V333 HydrophobicContact CG-CG2 4.03Å; F329-V333 HydrophobicContact CZ-CG2 3.77Å; F329-V333 VanDerWaalsContact O-CB 3.24Å; F329-V333 WeakPolarHBondContact O-CB 3.42Å; F329-V333 WeakPolarHBondContact O-CG2 3.37Å; F329-V333 PolarHBondContact O-N 3.17Å
330M86.6Confident86.7Confident52 Ų5235 Ų3526%0.25620%0.198SC..Hα-helixtrans-57.4-36.5174.4-69.1-59.4-48.800112.7C205 N326 M327 F328 C334C205-M330 HydrophobicContact CB-CE 4.04Å; C205-M330 HydrophobicContact CB-SD 3.61Å; C205-M330 PolarHBondContact SG-SD 3.25Å; N326-M330 VanDerWaalsContact O-CG 3.31Å; N326-M330 WeakPolarHBondContact O-CG 3.48Å; N326-M330 PolarHBondContact O-N 2.97Å; M327-M330 PolarHBondContact O-N 3.38Å; F328-M330 PolarHBondContact O-N 2.71Å; M330-C334 WeakPolarHBondContact O-CB 3.29Å; M330-C334 PolarHBondContact O-N 3.32Å
331I89Confident86.9Confident121 Ų12135.9 Ų35.962%0.62120%0.198SC*.Hα-helixtrans-81.4-39.1-175.6-68.9164.7000112M327 F328 F329 P335M327-I331 WeakPolarHBondContact O-CD1 3.03Å; M327-I331 WeakPolarHBondContact O-CG1 3.29Å; M327-I331 PolarHBondContact O-N 3.44Å; M327-I331 VanDerWaalsContact O-N 3.16Å; F328-I331 WeakPolarHBondContact O-CA 3.35Å; F328-I331 PolarHBondContact O-N 2.95Å; F329-I331 PolarHBondContact O-N 3.48Å; I331-P335 WeakPolarHBondContact O-CD 3.16Å
332S89Confident87.1Confident3 Ų339.1 Ų39.12%0.02122%0.215CC..Hα-helixtrans-80.5-35-177.656.30000113.1F328 F329 N377F328-S332 PolarHBondContact O-N 2.93Å; F328-S332 PolarHBondContact O-OG 3.47Å; F329-S332 WeakPolarHBondContact CA-OG 3.32Å; F329-S332 PolarHBondContact O-N 3.12Å; F329-S332 PolarHBondContact O-OG 3.3Å; S332-N377 PolarHBondContact OG-ND2 3.1Å; S332-N377 PolarHBondContact OG-OD1 3.06Å
333V87.7Confident87Confident1 Ų140 Ų401%0.00622%0.218CC..Hα-helixtrans-82.4-38.4-178.9-178.40000111.3V200 F329 L336 L337 W374 N377V200-V333 HydrophobicContact CG1-CG1 4.14Å; F329-V333 HydrophobicContact CD1-CG2 4.16Å; F329-V333 HydrophobicContact CD2-CG2 3.75Å; F329-V333 HydrophobicContact CE1-CB 4.49Å; F329-V333 HydrophobicContact CE1-CG2 4.04Å; F329-V333 HydrophobicContact CE2-CG2 3.61Å; F329-V333 HydrophobicContact CG-CG2 4.03Å; F329-V333 HydrophobicContact CZ-CG2 3.77Å; F329-V333 VanDerWaalsContact O-CB 3.24Å; F329-V333 WeakPolarHBondContact O-CB 3.42Å; F329-V333 WeakPolarHBondContact O-CG2 3.37Å; F329-V333 PolarHBondContact O-N 3.17Å; V333-L336 WeakPolarHBondContact O-CB 3.43Å; V333-L336 PolarHBondContact O-N 2.87Å; V333-L337 HydrophobicContact CG1-CD1 4.22Å; V333-L337 HydrophobicContact CG1-CD2 3.92Å; V333-L337 HydrophobicContact CG1-CG 3.99Å; V333-L337 WeakPolarHBondContact O-CG 3.13Å; V333-L337 PolarHBondContact O-N 3.48Å; V333-W374 HydrophobicContact CB-CE3 4.45Å; V333-W374 HydrophobicContact CB-CZ3 4.44Å; V333-W374 HydrophobicContact CG1-CE3 4.2Å; V333-W374 HydrophobicContact CG1-CZ3 3.94Å; V333-W374 HydrophobicContact CG2-CE3 3.77Å; V333-W374 HydrophobicContact CG2-CZ3 3.69Å; V333-N377 WeakPolarHBondContact CG2-ND2 3.39Å
334C88.2Confident86.6Confident61 Ų6139.6 Ų39.641%0.41221%0.214SC..Hα-helixtrans-50.5-43.5-176.7179.50000114.8M330 L336 L337 V338M330-C334 WeakPolarHBondContact O-CB 3.29Å; M330-C334 PolarHBondContact O-N 3.32Å; C334-L336 VanDerWaalsContact C-N 3.34Å; C334-L336 PolarHBondContact O-N 3.44Å; C334-L337 PolarHBondContact O-N 3.19Å; C334-V338 WeakPolarHBondContact O-CG2 3.49Å; C334-V338 PolarHBondContact O-N 3.21Å
335P90.8Very high86.2Confident42 Ų4241.1 Ų41.127%0.27323%0.226SC..Hα-helixtrans-58.7-38.1174.6-27.637.5000114.6I331 V338 Y339 V370 L373I331-P335 WeakPolarHBondContact O-CD 3.16Å; P335-V338 PolarHBondContact O-N 3.05Å; P335-Y339 PolarHBondContact O-N 3.48Å; P335-V370 HydrophobicContact CB-CB 4.46Å; P335-V370 HydrophobicContact CB-CG1 3.75Å; P335-L373 HydrophobicContact CB-CD1 4.13Å; P335-L373 HydrophobicContact CG-CD1 3.92Å
336L88.3Confident85.6Confident11 Ų1148.5 Ų48.56%0.05826%0.259CS..Hα-helixtrans-63.3-49.6175.9179.663.5000110.1V333 C334 V338 Y339 D340 V370 Y371 W374V333-L336 WeakPolarHBondContact O-CB 3.43Å; V333-L336 PolarHBondContact O-N 2.87Å; C334-L336 VanDerWaalsContact C-N 3.34Å; C334-L336 PolarHBondContact O-N 3.44Å; L336-V338 VanDerWaalsContact C-N 3.29Å; L336-V338 PolarHBondContact O-N 3.29Å; L336-Y339 CarbonylContact O-C 3.59Å; L336-Y339 WeakPolarHBondContact O-CA 3.45Å; L336-Y339 VanDerWaalsContact O-CB 3.29Å; L336-Y339 WeakPolarHBondContact O-CB 3.4Å; L336-Y339 PolarHBondContact O-N 2.65Å; L336-D340 WeakPolarHBondContact CG-OD2 3.43Å; L336-D340 PolarHBondContact O-N 3.07Å; L336-D340 VanDerWaalsContact O-OD2 3.09Å; L336-V370 HydrophobicContact CB-CB 4.26Å; L336-V370 HydrophobicContact CB-CG2 4.5Å; L336-V370 HydrophobicContact CD1-CB 4.34Å; L336-V370 HydrophobicContact CD1-CG2 3.73Å; L336-Y371 HydrophobicContact CD1-CD2 4.29Å; L336-Y371 HydrophobicContact CD1-CE2 3.86Å; L336-W374 HydrophobicContact CD2-CB 4.01Å; L336-W374 HydrophobicContact CD2-CD2 3.78Å; L336-W374 HydrophobicContact CD2-CE3 3.74Å; L336-W374 HydrophobicContact CD2-CG 3.9Å
337L84.4Confident84.8Confident22 Ų2252.1 Ų52.112%0.11528%0.278CS..Hα-helixtrans-59.7-38.5178.5-46.5169.8000113.1L197 C201 V333 C334 Y339 D340 V341L197-L337 HydrophobicContact CD1-CB 3.97Å; L197-L337 HydrophobicContact CD1-CD2 3.84Å; L197-L337 HydrophobicContact CD1-CG 4.46Å; C201-L337 HydrophobicContact CB-CD1 3.24Å; C201-L337 HydrophobicContact CB-CD2 3.45Å; C201-L337 VanDerWaalsContact CB-CD2 3.45Å; C201-L337 HydrophobicContact CB-CG 3.96Å; C201-L337 WeakPolarHBondContact SG-CD1 3.44Å; V333-L337 HydrophobicContact CG1-CD1 4.22Å; V333-L337 HydrophobicContact CG1-CD2 3.92Å; V333-L337 HydrophobicContact CG1-CG 3.99Å; V333-L337 WeakPolarHBondContact O-CG 3.13Å; V333-L337 PolarHBondContact O-N 3.48Å; C334-L337 PolarHBondContact O-N 3.19Å; L337-Y339 VanDerWaalsContact C-N 3.34Å; L337-D340 PolarHBondContact O-N 3.05Å; L337-V341 VanDerWaalsContact O-CB 3.32Å; L337-V341 WeakPolarHBondContact O-CB 3.21Å; L337-V341 VanDerWaalsContact O-CG2 3.25Å; L337-V341 WeakPolarHBondContact O-CG2 3.2Å; L337-V341 PolarHBondContact O-N 3.25Å
338V86.6Confident84.1Confident78 Ų7848.4 Ų48.447%0.47326%0.26SS..Hα-helixtrans-67.4-39.81771720000109.8C334 P335 L336 I342C334-V338 WeakPolarHBondContact O-CG2 3.49Å; C334-V338 PolarHBondContact O-N 3.21Å; P335-V338 PolarHBondContact O-N 3.05Å; L336-V338 VanDerWaalsContact C-N 3.29Å; L336-V338 PolarHBondContact O-N 3.29Å; V338-I342 HydrophobicContact CG1-CD1 3.8Å; V338-I342 VanDerWaalsContact O-CB 3.29Å; V338-I342 WeakPolarHBondContact O-CB 3.34Å; V338-I342 WeakPolarHBondContact O-CD1 3.35Å; V338-I342 WeakPolarHBondContact O-CG1 3.47Å; V338-I342 PolarHBondContact O-N 3.02Å
339Y88.5Confident83.1Confident20 Ų2046.9 Ų46.98%0.07826%0.255CS..Hα-helixtrans-61-50.5171.2173.3-91.5000111.6P335 L336 L337 I342 Y343 V363 I366 E367 V370P335-Y339 PolarHBondContact O-N 3.48Å; L336-Y339 CarbonylContact O-C 3.59Å; L336-Y339 WeakPolarHBondContact O-CA 3.45Å; L336-Y339 VanDerWaalsContact O-CB 3.29Å; L336-Y339 WeakPolarHBondContact O-CB 3.4Å; L336-Y339 PolarHBondContact O-N 2.65Å; L337-Y339 VanDerWaalsContact C-N 3.34Å; Y339-I342 PolarHBondContact O-N 3.01Å; Y339-Y343 VanDerWaalsContact O-CB 3.29Å; Y339-Y343 WeakPolarHBondContact O-CB 3.32Å; Y339-Y343 PolarHBondContact O-N 2.81Å; Y339-V363 HydrophobicContact CE2-CG1 4.12Å; Y339-I366 HydrophobicContact CD2-CG2 3.82Å; Y339-I366 HydrophobicContact CE2-CG2 4.46Å; Y339-E367 HydrophobicContact CE1-CB 4.36Å; Y339-E367 HydrophobicContact CE1-CG 4.09Å; Y339-E367 HydrophobicContact CE2-CB 3.84Å; Y339-E367 HydrophobicContact CE2-CG 4.41Å; Y339-E367 WeakPolarHBondContact OH-CG 3.42Å; Y339-E367 PolarHBondContact OH-OE2 3.34Å; Y339-V370 HydrophobicContact CD1-CG2 4.27Å; Y339-V370 HydrophobicContact CG-CG2 4.08Å
340D84.4Confident82.1Confident21 Ų2149.8 Ų49.811%0.11227%0.273CS..Hα-helixtrans-63.2-48.2-177.8-57.2-36.7000111.8L336 L337 I342 Y343 F344L336-D340 WeakPolarHBondContact CG-OD2 3.43Å; L336-D340 PolarHBondContact O-N 3.07Å; L336-D340 VanDerWaalsContact O-OD2 3.09Å; L337-D340 PolarHBondContact O-N 3.05Å; D340-I342 VanDerWaalsContact C-N 3.29Å; D340-I342 PolarHBondContact O-N 3.38Å; D340-Y343 PolarHBondContact O-N 2.78Å; D340-Y343 VanDerWaalsContact O-N 3.11Å; D340-F344 HydrophobicContact CB-CD2 4.26Å; D340-F344 HydrophobicContact CB-CE2 4.23Å; D340-F344 WeakPolarHBondContact O-CD2 3.49Å; D340-F344 PolarHBondContact O-N 2.79Å
341V84Confident81.4Confident62 Ų6253.6 Ų53.638%0.37629%0.285SS..Hα-helixtrans-61.1-39.5177.11710000110.9L197 L337 A345L197-V341 HydrophobicContact CD1-CG2 3.76Å; L197-V341 HydrophobicContact CD2-CG2 3.59Å; L197-V341 HydrophobicContact CG-CG2 4.35Å; L337-V341 VanDerWaalsContact O-CB 3.32Å; L337-V341 WeakPolarHBondContact O-CB 3.21Å; L337-V341 VanDerWaalsContact O-CG2 3.25Å; L337-V341 WeakPolarHBondContact O-CG2 3.2Å; L337-V341 PolarHBondContact O-N 3.25Å; V341-A345 HydrophobicContact CG1-CB 4.47Å; V341-A345 WeakPolarHBondContact O-CB 3.31Å; V341-A345 PolarHBondContact O-N 3.46Å
342I84.9Confident80.4Confident73 Ų7348.2 Ų48.237%0.37426%0.257SS..Hα-helixtrans-65.8-43.8174-72.5169.8000110.8V338 Y339 D340 F346 L348V338-I342 HydrophobicContact CG1-CD1 3.8Å; V338-I342 VanDerWaalsContact O-CB 3.29Å; V338-I342 WeakPolarHBondContact O-CB 3.34Å; V338-I342 WeakPolarHBondContact O-CD1 3.35Å; V338-I342 WeakPolarHBondContact O-CG1 3.47Å; V338-I342 PolarHBondContact O-N 3.02Å; Y339-I342 PolarHBondContact O-N 3.01Å; D340-I342 VanDerWaalsContact C-N 3.29Å; D340-I342 PolarHBondContact O-N 3.38Å; I342-F346 WeakPolarHBondContact O-CB 3.23Å; I342-F346 PolarHBondContact O-N 3.42Å; I342-L348 HydrophobicContact CG2-CD1 4.13Å; I342-L348 HydrophobicContact CG2-CD2 4.5Å
343Y81.3Confident79.4Confident23 Ų2352.7 Ų52.79%0.0928%0.278CS..Hα-helixtrans-60.6-52.2-178.6-179.7-94.3000111.9Y339 D340 N347 L348 N349 I492Y339-Y343 VanDerWaalsContact O-CB 3.29Å; Y339-Y343 WeakPolarHBondContact O-CB 3.32Å; Y339-Y343 PolarHBondContact O-N 2.81Å; D340-Y343 PolarHBondContact O-N 2.78Å; D340-Y343 VanDerWaalsContact O-N 3.11Å; Y343-N347 WeakPolarHBondContact O-CA 3.29Å; Y343-N347 PolarHBondContact O-N 2.9Å; Y343-L348 HydrophobicContact CD2-CB 3.95Å; Y343-L348 HydrophobicContact CD2-CD2 4.12Å; Y343-L348 HydrophobicContact CE2-CB 4.5Å; Y343-L348 PolarHBondContact O-N 2.92Å; Y343-N349 PolarHBondContact OH-ND2 2.93Å; Y343-I492 HydrophobicContact CE2-CD1 4.29Å; Y343-I492 HydrophobicContact CE2-CG1 3.96Å; Y343-I492 WeakPolarHBondContact OH-CD1 3.42Å; Y343-I492 WeakPolarHBondContact OH-CG1 3.35Å; Y343-I492 WeakPolarHBondContact OH-CG2 3.23Å
344F76.8Confident78.2Confident45 Ų4560.1 Ų60.120%0.19731%0.31CS..Hα-helixtrans-80.7-45.6-176.6-63.9-68.5000113.5P193 Y194 D340 N347P193-F344 HydrophobicContact CB-CD1 4.26Å; P193-F344 HydrophobicContact CB-CD2 3.76Å; P193-F344 HydrophobicContact CB-CE1 3.87Å; P193-F344 HydrophobicContact CB-CE2 3.35Å; P193-F344 HydrophobicContact CB-CG 4.23Å; P193-F344 HydrophobicContact CB-CZ 3.42Å; P193-F344 VanDerWaalsContact CB-CZ 3.42Å; P193-F344 HydrophobicContact CG-CD1 4.32Å; P193-F344 HydrophobicContact CG-CE1 3.65Å; P193-F344 HydrophobicContact CG-CE2 4Å; P193-F344 HydrophobicContact CG-CZ 3.49Å; P193-F344 VanDerWaalsContact CG-CZ 3.49Å; Y194-F344 HydrophobicContact CE1-CB 4.44Å; D340-F344 HydrophobicContact CB-CD2 4.26Å; D340-F344 HydrophobicContact CB-CE2 4.23Å; D340-F344 WeakPolarHBondContact O-CD2 3.49Å; D340-F344 PolarHBondContact O-N 2.79Å; F344-N347 PolarHBondContact O-N 3.24Å
345A77.5Confident77.2Confident61 Ų6161.3 Ų61.350%0.50431%0.312SS..Hα-helixtrans-77.5-29.8-171.400000113.8V341V341-A345 HydrophobicContact CG1-CB 4.47Å; V341-A345 WeakPolarHBondContact O-CB 3.31Å; V341-A345 PolarHBondContact O-N 3.46Å
346F75.5Confident76.3Confident157 Ų15761.6 Ų61.669%0.68931%0.31SS*.THydrogen-bonded Turntrans-98.53174.1-65.4-90.6000112.9I342I342-F346 WeakPolarHBondContact O-CB 3.23Å; I342-F346 PolarHBondContact O-N 3.42Å
347N70.1Confident75.6Confident80 Ų8065 Ų6543%0.42833%0.328SS..THydrogen-bonded Turntrans41.468.8-172.4-172.67.6000111.7Y343 F344 N349 T350Y343-N347 WeakPolarHBondContact O-CA 3.29Å; Y343-N347 PolarHBondContact O-N 2.9Å; F344-N347 PolarHBondContact O-N 3.24Å; N347-N349 PolarHBondContact O-N 3.28Å; N347-N349 PolarHBondContact OD1-ND2 2.94Å; N347-T350 HydrophobicContact CB-CG2 4.44Å; N347-T350 PolarHBondContact O-N 2.93Å; N347-T350 PolarHBondContact O-OG1 2.89Å
348L73.1Confident75.4Confident16 Ų1669.6 Ų69.68%0.08435%0.351CS..THydrogen-bonded Turntrans-55.5-23-166.1-171.566.9000114I342 Y343 T350 W351 I352 V363I342-L348 HydrophobicContact CG2-CD1 4.13Å; I342-L348 HydrophobicContact CG2-CD2 4.5Å; Y343-L348 HydrophobicContact CD2-CB 3.95Å; Y343-L348 HydrophobicContact CD2-CD2 4.12Å; Y343-L348 HydrophobicContact CE2-CB 4.5Å; Y343-L348 PolarHBondContact O-N 2.92Å; L348-T350 VanDerWaalsContact C-N 3.27Å; L348-T350 PolarHBondContact O-N 3.07Å; L348-W351 HydrophobicContact CD1-CB 4.2Å; L348-W351 HydrophobicContact CD1-CD2 4.38Å; L348-W351 HydrophobicContact CD1-CE3 3.96Å; L348-W351 WeakPolarHBondContact O-CA 3.32Å; L348-W351 WeakPolarHBondContact O-CB 3.33Å; L348-W351 PolarHBondContact O-N 2.81Å; L348-I352 HydrophobicContact CG-CD1 4.21Å; L348-I352 HydrophobicContact CG-CG1 4.41Å; L348-I352 WeakPolarHBondContact O-CG1 3.46Å; L348-I352 PolarHBondContact O-N 2.84Å; L348-V363 HydrophobicContact CD2-CG1 3.91Å; L348-V363 HydrophobicContact CD2-CG2 3.79Å; L348-V363 HydrophobicContact CG-CG2 4.32Å
349N67.8Low75.1Confident26 Ų2668 Ų6814%0.13934%0.337CS..Hα-helixtrans-45.9-48.3167.5-61-68.3000113Y343 N347 W351 I352 E353 K488 I492Y343-N349 PolarHBondContact OH-ND2 2.93Å; N347-N349 PolarHBondContact O-N 3.28Å; N347-N349 PolarHBondContact OD1-ND2 2.94Å; N349-W351 PolarHBondContact O-N 3.03Å; N349-I352 WeakPolarHBondContact O-CB 3.45Å; N349-I352 PolarHBondContact O-N 2.99Å; N349-I352 VanDerWaalsContact O-N 3.16Å; N349-E353 WeakPolarHBondContact O-CG 3.25Å; N349-E353 PolarHBondContact O-N 3.17Å; N349-E353 VanDerWaalsContact O-N 3.08Å; N349-K488 WeakPolarHBondContact OD1-CE 3.3Å; N349-I492 WeakPolarHBondContact OD1-CD1 3.43Å
350T70.5Confident74.7Confident70 Ų7067.7 Ų67.743%0.42934%0.34SS..Hα-helixtrans-68.2-20.8-179.8660000113.7N347 L348N347-T350 HydrophobicContact CB-CG2 4.44Å; N347-T350 PolarHBondContact O-N 2.93Å; N347-T350 PolarHBondContact O-OG1 2.89Å; L348-T350 VanDerWaalsContact C-N 3.27Å; L348-T350 PolarHBondContact O-N 3.07Å
351W70.2Confident74.7Confident133 Ų13367.3 Ų67.350%0.50434%0.338SS..Hα-helixtrans-87.8-32.9174.2-172.986.9000111.6L348 N349 R359L348-W351 HydrophobicContact CD1-CB 4.2Å; L348-W351 HydrophobicContact CD1-CD2 4.38Å; L348-W351 HydrophobicContact CD1-CE3 3.96Å; L348-W351 WeakPolarHBondContact O-CA 3.32Å; L348-W351 WeakPolarHBondContact O-CB 3.33Å; L348-W351 PolarHBondContact O-N 2.81Å; N349-W351 PolarHBondContact O-N 3.03Å; W351-R359 VanDerWaalsContact CE2-NH1 3.25Å; W351-R359 HydrophobicContact CE3-CB 4.39Å; W351-R359 HydrophobicContact CE3-CG 4.3Å; W351-R359 HydrophobicContact CH2-CG 4.18Å; W351-R359 HydrophobicContact CZ3-CB 4.03Å; W351-R359 HydrophobicContact CZ3-CG 3.84Å; W351-R359 WeakPolarHBondContact O-CD 3.26Å; W351-R359 PolarHBondContact O-NH1 3.43Å
352I69.5Low74.8Confident7 Ų769.2 Ų69.24%0.03635%0.346CS..Hα-helixtrans-64.3-43.9175.5-71.1163.9000111.1L348 N349 K354 D355 E356 R359 V363 Y484L348-I352 HydrophobicContact CG-CD1 4.21Å; L348-I352 HydrophobicContact CG-CG1 4.41Å; L348-I352 WeakPolarHBondContact O-CG1 3.46Å; L348-I352 PolarHBondContact O-N 2.84Å; N349-I352 WeakPolarHBondContact O-CB 3.45Å; N349-I352 PolarHBondContact O-N 2.99Å; N349-I352 VanDerWaalsContact O-N 3.16Å; I352-K354 PolarHBondContact O-N 2.9Å; I352-D355 CarbonylContact O-C 3.55Å; I352-D355 PolarHBondContact O-N 3.4Å; I352-D355 VanDerWaalsContact O-N 3.15Å; I352-E356 WeakPolarHBondContact O-CA 3.3Å; I352-E356 PolarHBondContact O-N 3.33Å; I352-R359 HydrophobicContact CG1-CB 4.44Å; I352-V363 HydrophobicContact CD1-CB 4.33Å; I352-V363 HydrophobicContact CD1-CG1 4.21Å; I352-V363 HydrophobicContact CD1-CG2 4.06Å; I352-V363 HydrophobicContact CG1-CG2 4.05Å; I352-Y484 HydrophobicContact CG2-CE1 4.18Å; I352-Y484 WeakPolarHBondContact CG2-OH 3.05Å
353E66.4Low74.9Confident98 Ų9866.3 Ų66.346%0.45833%0.331SS..THydrogen-bonded Turntrans-55-12.8-177-80147.7-150.400115.5N349 K488N349-E353 WeakPolarHBondContact O-CG 3.25Å; N349-E353 PolarHBondContact O-N 3.17Å; N349-E353 VanDerWaalsContact O-N 3.08Å; E353-K488 IonicContact OE1-NZ 3.23Å; E353-K488 PolarHBondContact OE1-NZ 2.91Å
354K64.1Low75.1Confident157 Ų15765.7 Ų65.768%0.68333%0.329SS*.THydrogen-bonded Turntrans-85.7-25.3179.3-65.4-172.3179.1-175.80115.1I352I352-K354 PolarHBondContact O-N 2.9Å
355D67.4Low75.7Confident86 Ų8664.5 Ų64.546%0.4633%0.33SS..SBendtrans-148.865171.4-58.7-83.2000108.4I352 L357 I358 R359I352-D355 CarbonylContact O-C 3.55Å; I352-D355 PolarHBondContact O-N 3.4Å; I352-D355 VanDerWaalsContact O-N 3.15Å; D355-L357 VanDerWaalsContact C-N 3.34Å; D355-L357 PolarHBondContact O-N 2.88Å; D355-L357 VanDerWaalsContact O-N 3.12Å; D355-I358 PolarHBondContact O-N 2.84Å; D355-I358 VanDerWaalsContact O-N 3.12Å; D355-R359 HydrophobicContact CB-CG 4.01Å; D355-R359 PolarHBondContact O-N 2.95Å; D355-R359 IonicContact OD2-CZ 2.76Å; D355-R359 IonicContact OD2-NE 3.82Å; D355-R359 PolarHBondContact OD2-NE 3.02Å; D355-R359 IonicContact OD2-NH2 2.75Å; D355-R359 PolarHBondContact OD2-NH2 3.42Å
356E70.7Confident76.3Confident48 Ų4865.9 Ų65.922%0.22433%0.328CS..Hα-helixtrans-43.5-53.7-164.6-66.5-129.6111.600113.8I352 I358 G360 Y484 K488I352-E356 WeakPolarHBondContact O-CA 3.3Å; I352-E356 PolarHBondContact O-N 3.33Å; E356-I358 PolarHBondContact O-N 3.16Å; E356-G360 WeakPolarHBondContact O-CA 3.47Å; E356-G360 PolarHBondContact O-N 2.92Å; E356-Y484 HydrophobicContact CB-CD1 4.16Å; E356-Y484 HydrophobicContact CB-CE1 3.76Å; E356-Y484 HydrophobicContact CB-CE2 4.25Å; E356-Y484 VanDerWaalsContact CD-CD1 3.47Å; E356-Y484 HydrophobicContact CG-CD1 4.44Å; E356-Y484 HydrophobicContact CG-CE1 4.11Å; E356-Y484 WeakPolarHBondContact O-CE2 3.34Å; E356-Y484 VanDerWaalsContact O-CZ 3.24Å; E356-Y484 PolarHBondContact O-OH 2.87Å; E356-Y484 VanDerWaalsContact OE1-CE1 3.26Å; E356-Y484 WeakPolarHBondContact OE1-CE1 3.42Å; E356-Y484 WeakPolarHBondContact OE2-CD1 3.43Å; E356-K488 IonicContact OE1-NZ 2.95Å
357L74.3Confident76.9Confident83 Ų8358.4 Ų58.444%0.43530%0.295SS..Hα-helixtrans-61.4-48.9-176.1179.156.4000112.9P14 D355 V361 I479P14-L357 HydrophobicContact CB-CD1 3.82Å; P14-L357 HydrophobicContact CG-CD1 3.5Å; P14-L357 VanDerWaalsContact CG-CD1 3.5Å; D355-L357 VanDerWaalsContact C-N 3.34Å; D355-L357 PolarHBondContact O-N 2.88Å; D355-L357 VanDerWaalsContact O-N 3.12Å; L357-V361 HydrophobicContact CD1-CG2 4.32Å; L357-V361 VanDerWaalsContact O-CG2 3.24Å; L357-V361 WeakPolarHBondContact O-CG2 3.46Å; L357-V361 PolarHBondContact O-N 3.32Å; L357-I479 HydrophobicContact CD1-CD1 3.8Å; L357-I479 HydrophobicContact CD2-CD1 4.28Å
358I79.3Confident77.9Confident118 Ų11854.7 Ų54.761%0.60528%0.275SS*.Hα-helixtrans-74.7-45.3-175.2-60.8178.5000110.2D355 E356 L362D355-I358 PolarHBondContact O-N 2.84Å; D355-I358 VanDerWaalsContact O-N 3.12Å; E356-I358 PolarHBondContact O-N 3.16Å; I358-L362 HydrophobicContact CG2-CD1 4.03Å; I358-L362 WeakPolarHBondContact O-CG 3.43Å; I358-L362 PolarHBondContact O-N 3.26Å; I358-L362 VanDerWaalsContact O-N 3.1Å
359R81Confident78.8Confident43 Ų4359.8 Ų59.816%0.16230%0.297CS..Hα-helixtrans-68.5-40.5-177.8-65.6175-168.5-134.6-2.5111.7W351 I352 D355 V361 L362 V363W351-R359 VanDerWaalsContact CE2-NH1 3.25Å; W351-R359 HydrophobicContact CE3-CB 4.39Å; W351-R359 HydrophobicContact CE3-CG 4.3Å; W351-R359 HydrophobicContact CH2-CG 4.18Å; W351-R359 HydrophobicContact CZ3-CB 4.03Å; W351-R359 HydrophobicContact CZ3-CG 3.84Å; W351-R359 WeakPolarHBondContact O-CD 3.26Å; W351-R359 PolarHBondContact O-NH1 3.43Å; I352-R359 HydrophobicContact CG1-CB 4.44Å; D355-R359 HydrophobicContact CB-CG 4.01Å; D355-R359 PolarHBondContact O-N 2.95Å; D355-R359 IonicContact OD2-CZ 2.76Å; D355-R359 IonicContact OD2-NE 3.82Å; D355-R359 PolarHBondContact OD2-NE 3.02Å; D355-R359 IonicContact OD2-NH2 2.75Å; D355-R359 PolarHBondContact OD2-NH2 3.42Å; R359-V361 PolarHBondContact O-N 3.47Å; R359-L362 PolarHBondContact O-N 2.84Å; R359-V363 WeakPolarHBondContact O-CB 3.32Å; R359-V363 VanDerWaalsContact O-CG2 3.32Å; R359-V363 WeakPolarHBondContact O-CG2 3.46Å; R359-V363 PolarHBondContact O-N 3.23Å
360G79.8Confident80Confident14 Ų1458.8 Ų58.814%0.14429%0.291CS..Hα-helixtrans-59.7-46176.600000113E356 V363 F364 Y484E356-G360 WeakPolarHBondContact O-CA 3.47Å; E356-G360 PolarHBondContact O-N 2.92Å; G360-V363 PolarHBondContact O-N 3.49Å; G360-F364 VanDerWaalsContact O-CB 3.31Å; G360-F364 WeakPolarHBondContact O-CB 3.43Å; G360-F364 PolarHBondContact O-N 2.97Å; G360-Y484 WeakPolarHBondContact CA-OH 3.26Å; G360-Y484 PolarHBondContact N-OH 2.97Å
361V84.1Confident81Confident13 Ų1356 Ų568%0.07927%0.273CS..Hα-helixtrans-71.7-32-179.6-175.30000112.1L16 V17 I20 L357 R359 G365L16-V361 HydrophobicContact CB-CG1 3.89Å; L16-V361 HydrophobicContact CD2-CG1 3.62Å; L16-V361 HydrophobicContact CG-CG1 3.53Å; V17-V361 HydrophobicContact CG2-CB 4.44Å; V17-V361 HydrophobicContact CG2-CG1 4.12Å; V17-V361 HydrophobicContact CG2-CG2 3.6Å; I20-V361 HydrophobicContact CD1-CG1 3.77Å; L357-V361 HydrophobicContact CD1-CG2 4.32Å; L357-V361 VanDerWaalsContact O-CG2 3.24Å; L357-V361 WeakPolarHBondContact O-CG2 3.46Å; L357-V361 PolarHBondContact O-N 3.32Å; R359-V361 PolarHBondContact O-N 3.47Å; V361-G365 PolarHBondContact O-N 2.68Å
362L86.2Confident82.1Confident102 Ų10250.7 Ų50.753%0.53426%0.255SS..Hα-helixtrans-65.2-47170.4-73.4171.5000111.9I358 R359 G365 I366I358-L362 HydrophobicContact CG2-CD1 4.03Å; I358-L362 WeakPolarHBondContact O-CG 3.43Å; I358-L362 PolarHBondContact O-N 3.26Å; I358-L362 VanDerWaalsContact O-N 3.1Å; R359-L362 PolarHBondContact O-N 2.84Å; L362-G365 PolarHBondContact O-N 2.95Å; L362-I366 VanDerWaalsContact O-CG1 3.3Å; L362-I366 WeakPolarHBondContact O-CG1 3.17Å; L362-I366 PolarHBondContact O-N 3.23Å
363V86.2Confident83.2Confident12 Ų1252.5 Ų52.57%0.07327%0.265CS..Hα-helixtrans-61.6-47.9177.4170.60000110.5Y339 L348 I352 R359 G360 G365 I366 E367Y339-V363 HydrophobicContact CE2-CG1 4.12Å; L348-V363 HydrophobicContact CD2-CG1 3.91Å; L348-V363 HydrophobicContact CD2-CG2 3.79Å; L348-V363 HydrophobicContact CG-CG2 4.32Å; I352-V363 HydrophobicContact CD1-CB 4.33Å; I352-V363 HydrophobicContact CD1-CG1 4.21Å; I352-V363 HydrophobicContact CD1-CG2 4.06Å; I352-V363 HydrophobicContact CG1-CG2 4.05Å; R359-V363 WeakPolarHBondContact O-CB 3.32Å; R359-V363 VanDerWaalsContact O-CG2 3.32Å; R359-V363 WeakPolarHBondContact O-CG2 3.46Å; R359-V363 PolarHBondContact O-N 3.23Å; G360-V363 PolarHBondContact O-N 3.49Å; V363-G365 VanDerWaalsContact C-N 3.3Å; V363-G365 PolarHBondContact O-N 3.39Å; V363-I366 PolarHBondContact O-N 2.75Å; V363-E367 WeakPolarHBondContact O-CB 3.49Å; V363-E367 PolarHBondContact O-N 3.37Å
364F86.5Confident84.5Confident10 Ų1048.3 Ų48.34%0.04425%0.245CC..Hα-helixtrans-55.7-42.2173.4-179.3-92.3000112.5V17 I20 Y82 F86 G360 R368V17-F364 HydrophobicContact CG1-CD1 4.01Å; V17-F364 HydrophobicContact CG1-CE1 3.61Å; V17-F364 HydrophobicContact CG1-CE2 4.22Å; V17-F364 HydrophobicContact CG1-CG 4.47Å; V17-F364 HydrophobicContact CG1-CZ 3.72Å; I20-F364 HydrophobicContact CB-CD1 4.24Å; I20-F364 HydrophobicContact CB-CE1 3.99Å; I20-F364 HydrophobicContact CD1-CD1 4.18Å; I20-F364 HydrophobicContact CG2-CD1 3.84Å; I20-F364 HydrophobicContact CG2-CE1 3.61Å; Y82-F364 HydrophobicContact CE1-CE2 4.05Å; Y82-F364 AromaticContact CE1-CZ 3.92Å; Y82-F364 HydrophobicContact CE1-CZ 3.92Å; F86-F364 HydrophobicContact CE2-CE2 4.01Å; F86-F364 HydrophobicContact CE2-CZ 4.21Å; F86-F364 HydrophobicContact CZ-CE2 4.06Å; F86-F364 HydrophobicContact CZ-CZ 4.19Å; G360-F364 VanDerWaalsContact O-CB 3.31Å; G360-F364 WeakPolarHBondContact O-CB 3.43Å; G360-F364 PolarHBondContact O-N 2.97Å; F364-R368 HydrophobicContact CD1-CG 4.32Å; F364-R368 HydrophobicContact CE1-CG 4.03Å; F364-R368 HydrophobicContact CE2-CG 4.29Å; F364-R368 HydrophobicContact CZ-CG 4.02Å; F364-R368 WeakPolarHBondContact O-CB 3.43Å; F364-R368 VanDerWaalsContact O-CG 3.28Å; F364-R368 WeakPolarHBondContact O-CG 3.25Å; F364-R368 PolarHBondContact O-N 2.97Å
365G89.6Confident85.9Confident21 Ų2140.9 Ų40.922%0.21621%0.212CC..Hα-helixtrans-63.7-42.9176.400000113.5V361 L362 V363 F369V361-G365 PolarHBondContact O-N 2.68Å; L362-G365 PolarHBondContact O-N 2.95Å; V363-G365 VanDerWaalsContact C-N 3.3Å; V363-G365 PolarHBondContact O-N 3.39Å; G365-F369 WeakPolarHBondContact O-CB 3.29Å; G365-F369 PolarHBondContact O-N 2.73Å; G365-F369 VanDerWaalsContact O-N 3.08Å
366I90.9Very high87.2Confident89 Ų8938.1 Ų38.146%0.45620%0.199SC..Hα-helixtrans-67.1-49177-65.4162.1000110.3Y339 L362 V363 R368 F369 V370Y339-I366 HydrophobicContact CD2-CG2 3.82Å; Y339-I366 HydrophobicContact CE2-CG2 4.46Å; L362-I366 VanDerWaalsContact O-CG1 3.3Å; L362-I366 WeakPolarHBondContact O-CG1 3.17Å; L362-I366 PolarHBondContact O-N 3.23Å; V363-I366 PolarHBondContact O-N 2.75Å; I366-R368 PolarHBondContact O-N 3.25Å; I366-F369 WeakPolarHBondContact O-CB 3.34Å; I366-F369 PolarHBondContact O-N 3.33Å; I366-F369 VanDerWaalsContact O-N 3.1Å; I366-V370 HydrophobicContact CG2-CG1 4.47Å; I366-V370 PolarHBondContact O-N 2.62Å
367E88.2Confident88.2Confident0 Ų036 Ų360%019%0.189CC..Hα-helixtrans-51.4-54.3176.4-175.1-161108.600110.7Y339 V363 F369 V370 Y371 S491Y339-E367 HydrophobicContact CE1-CB 4.36Å; Y339-E367 HydrophobicContact CE1-CG 4.09Å; Y339-E367 HydrophobicContact CE2-CB 3.84Å; Y339-E367 HydrophobicContact CE2-CG 4.41Å; Y339-E367 WeakPolarHBondContact OH-CG 3.42Å; Y339-E367 PolarHBondContact OH-OE2 3.34Å; V363-E367 WeakPolarHBondContact O-CB 3.49Å; V363-E367 PolarHBondContact O-N 3.37Å; E367-F369 VanDerWaalsContact C-N 3.3Å; E367-F369 PolarHBondContact O-N 2.92Å; E367-V370 WeakPolarHBondContact O-CG2 3.39Å; E367-V370 PolarHBondContact O-N 2.95Å; E367-Y371 HydrophobicContact CG-CD2 4.34Å; E367-Y371 WeakPolarHBondContact O-CD2 3.29Å; E367-Y371 PolarHBondContact O-N 2.85Å; E367-S491 WeakPolarHBondContact OE1-CB 3.29Å; E367-S491 VanDerWaalsContact OE2-CB 3.27Å; E367-S491 WeakPolarHBondContact OE2-CB 3.39Å; E367-S491 PolarHBondContact OE2-OG 2.93Å
368R90.8Very high89.1Confident2 Ų232.3 Ų32.31%0.00817%0.17CC..Hα-helixtrans-66.4-29.7179-65.5-56.9100.1-164.714113.2I20 Y28 Y82 F364 I366 V372 T494 G495I20-R368 HydrophobicContact CG2-CB 4.43Å; Y28-R368 PolarHBondContact OH-O 2.94Å; Y82-R368 VanDerWaalsContact OH-CD 3.29Å; Y82-R368 WeakPolarHBondContact OH-CD 3.49Å; Y82-R368 PolarHBondContact OH-NE 3.01Å; Y82-R368 PolarHBondContact OH-NH1 2.88Å; Y82-R368 PolarHBondContact OH-NH2 3.19Å; F364-R368 HydrophobicContact CD1-CG 4.32Å; F364-R368 HydrophobicContact CE1-CG 4.03Å; F364-R368 HydrophobicContact CE2-CG 4.29Å; F364-R368 HydrophobicContact CZ-CG 4.02Å; F364-R368 WeakPolarHBondContact O-CB 3.43Å; F364-R368 VanDerWaalsContact O-CG 3.28Å; F364-R368 WeakPolarHBondContact O-CG 3.25Å; F364-R368 PolarHBondContact O-N 2.97Å; I366-R368 PolarHBondContact O-N 3.25Å; R368-V372 VanDerWaalsContact O-CG2 3.32Å; R368-V372 WeakPolarHBondContact O-CG2 3.32Å; R368-V372 PolarHBondContact O-N 3.08Å; R368-T494 PolarHBondContact NH1-O 2.98Å; R368-T494 PolarHBondContact NH2-O 3.41Å; R368-G495 VanDerWaalsContact NH2-CA 3.33Å
369F92.3Very high89.8Confident124 Ų12427.2 Ų27.254%0.54415%0.145SC..Hα-helixtrans-69.7-45.4173.8175-101.4000112.6G365 I366 E367 Y371 V372 L373G365-F369 WeakPolarHBondContact O-CB 3.29Å; G365-F369 PolarHBondContact O-N 2.73Å; G365-F369 VanDerWaalsContact O-N 3.08Å; I366-F369 WeakPolarHBondContact O-CB 3.34Å; I366-F369 PolarHBondContact O-N 3.33Å; I366-F369 VanDerWaalsContact O-N 3.1Å; E367-F369 VanDerWaalsContact C-N 3.3Å; E367-F369 PolarHBondContact O-N 2.92Å; F369-Y371 VanDerWaalsContact C-N 3.33Å; F369-Y371 PolarHBondContact O-N 2.82Å; F369-V372 PolarHBondContact O-N 2.92Å; F369-L373 HydrophobicContact CD1-CD1 4.22Å; F369-L373 HydrophobicContact CE1-CD1 3.56Å; F369-L373 HydrophobicContact CE1-CG 4.26Å; F369-L373 HydrophobicContact CZ-CD1 3.78Å; F369-L373 HydrophobicContact CZ-CD2 4.46Å; F369-L373 HydrophobicContact CZ-CG 4.19Å; F369-L373 PolarHBondContact O-N 3.37Å
370V93Very high90.3Very high4 Ų426.3 Ų26.32%0.02414%0.144CC..Hα-helixtrans-67.6-34.6178.1-59.50000111.7P335 L336 Y339 I366 E367 L373 W374P335-V370 HydrophobicContact CB-CB 4.46Å; P335-V370 HydrophobicContact CB-CG1 3.75Å; L336-V370 HydrophobicContact CB-CB 4.26Å; L336-V370 HydrophobicContact CB-CG2 4.5Å; L336-V370 HydrophobicContact CD1-CB 4.34Å; L336-V370 HydrophobicContact CD1-CG2 3.73Å; Y339-V370 HydrophobicContact CD1-CG2 4.27Å; Y339-V370 HydrophobicContact CG-CG2 4.08Å; I366-V370 HydrophobicContact CG2-CG1 4.47Å; I366-V370 PolarHBondContact O-N 2.62Å; E367-V370 WeakPolarHBondContact O-CG2 3.39Å; E367-V370 PolarHBondContact O-N 2.95Å; V370-L373 PolarHBondContact O-N 3.46Å; V370-W374 WeakPolarHBondContact O-CB 3.19Å; V370-W374 PolarHBondContact O-N 3Å
371Y91.4Very high90.7Very high13 Ų1326 Ų265%0.05114%0.139CC..Hα-helixtrans-66-40.4171.6-89.3-75.9000112.9L336 E367 F369 L373 W374 Y375 G495 I497L336-Y371 HydrophobicContact CD1-CD2 4.29Å; L336-Y371 HydrophobicContact CD1-CE2 3.86Å; E367-Y371 HydrophobicContact CG-CD2 4.34Å; E367-Y371 WeakPolarHBondContact O-CD2 3.29Å; E367-Y371 PolarHBondContact O-N 2.85Å; F369-Y371 VanDerWaalsContact C-N 3.33Å; F369-Y371 PolarHBondContact O-N 2.82Å; Y371-L373 VanDerWaalsContact C-N 3.34Å; Y371-L373 PolarHBondContact O-N 3.42Å; Y371-W374 PolarHBondContact O-N 3.27Å; Y371-Y375 HydrophobicContact CD1-CD2 4.37Å; Y371-Y375 AromaticContact CD1-CE2 3.79Å; Y371-Y375 HydrophobicContact CD1-CE2 3.79Å; Y371-Y375 WeakPolarHBondContact O-CD2 3.2Å; Y371-Y375 PolarHBondContact O-N 3.44Å; Y371-G495 PolarHBondContact OH-O 3.05Å; Y371-I497 WeakPolarHBondContact CE1-OXT 3.49Å
372V92.8Very high90.8Very high20 Ų2026.4 Ų26.412%0.12114%0.14CC..Hα-helixtrans-57.5-46.3170.9166.50000110.9F27 Y28 I31 R368 F369 Y375 T376F27-V372 HydrophobicContact CB-CG1 4.36Å; F27-V372 HydrophobicContact CB-CG2 4.48Å; Y28-V372 HydrophobicContact CD1-CG2 4.06Å; Y28-V372 HydrophobicContact CE1-CB 4.33Å; Y28-V372 HydrophobicContact CE1-CG2 3.47Å; Y28-V372 VanDerWaalsContact CE1-CG2 3.47Å; Y28-V372 HydrophobicContact CE2-CG2 4.45Å; I31-V372 HydrophobicContact CD1-CG1 4.19Å; R368-V372 VanDerWaalsContact O-CG2 3.32Å; R368-V372 WeakPolarHBondContact O-CG2 3.32Å; R368-V372 PolarHBondContact O-N 3.08Å; F369-V372 PolarHBondContact O-N 2.92Å; V372-Y375 PolarHBondContact O-N 3.01Å; V372-T376 WeakPolarHBondContact O-CG2 3.1Å; V372-T376 PolarHBondContact O-N 3.45Å
373L93.1Very high90.8Very high46 Ų4625.5 Ų25.524%0.24114%0.135CC..Hα-helixtrans-61-47.1176.5-69.6-179.9000112.3P335 F369 V370 Y371 Y375 T376P335-L373 HydrophobicContact CB-CD1 4.13Å; P335-L373 HydrophobicContact CG-CD1 3.92Å; F369-L373 HydrophobicContact CD1-CD1 4.22Å; F369-L373 HydrophobicContact CE1-CD1 3.56Å; F369-L373 HydrophobicContact CE1-CG 4.26Å; F369-L373 HydrophobicContact CZ-CD1 3.78Å; F369-L373 HydrophobicContact CZ-CD2 4.46Å; F369-L373 HydrophobicContact CZ-CG 4.19Å; F369-L373 PolarHBondContact O-N 3.37Å; V370-L373 PolarHBondContact O-N 3.46Å; Y371-L373 VanDerWaalsContact C-N 3.34Å; Y371-L373 PolarHBondContact O-N 3.42Å; L373-Y375 PolarHBondContact O-N 3.29Å; L373-T376 PolarHBondContact O-N 3.32Å; L373-T376 PolarHBondContact O-OG1 2.82Å
374W92.4Very high90.9Very high10 Ų1026.1 Ų26.14%0.03814%0.138CC..Hα-helixtrans-53.8-53.5176.1168.6-104.7000112.2Y70 A109 V113 V200 V333 L336 V370 Y371 T376 N377 F378Y70-W374 AromaticContact CE1-NE1 3.85Å; Y70-W374 AromaticContact CZ-NE1 3.72Å; Y70-W374 PolarHBondContact OH-NE1 2.82Å; A109-W374 HydrophobicContact CB-CZ2 3.88Å; V113-W374 HydrophobicContact CG2-CH2 4.5Å; V200-W374 HydrophobicContact CG1-CH2 3.63Å; V200-W374 HydrophobicContact CG1-CZ3 3.6Å; V333-W374 HydrophobicContact CB-CE3 4.45Å; V333-W374 HydrophobicContact CB-CZ3 4.44Å; V333-W374 HydrophobicContact CG1-CE3 4.2Å; V333-W374 HydrophobicContact CG1-CZ3 3.94Å; V333-W374 HydrophobicContact CG2-CE3 3.77Å; V333-W374 HydrophobicContact CG2-CZ3 3.69Å; L336-W374 HydrophobicContact CD2-CB 4.01Å; L336-W374 HydrophobicContact CD2-CD2 3.78Å; L336-W374 HydrophobicContact CD2-CE3 3.74Å; L336-W374 HydrophobicContact CD2-CG 3.9Å; V370-W374 WeakPolarHBondContact O-CB 3.19Å; V370-W374 PolarHBondContact O-N 3Å; Y371-W374 PolarHBondContact O-N 3.27Å; W374-T376 PolarHBondContact O-N 3.06Å; W374-N377 WeakPolarHBondContact O-CB 3.36Å; W374-N377 PolarHBondContact O-N 2.9Å; W374-N377 VanDerWaalsContact O-N 3.14Å; W374-N377 PolarHBondContact O-ND2 3.08Å; W374-F378 HydrophobicContact CD2-CE2 4.25Å; W374-F378 AromaticContact CE2-CE2 3.74Å; W374-F378 AromaticContact CE2-CZ 3.92Å; W374-F378 HydrophobicContact CH2-CZ 4.24Å; W374-F378 AromaticContact CZ2-CE2 3.98Å; W374-F378 HydrophobicContact CZ2-CE2 3.98Å; W374-F378 AromaticContact CZ2-CZ 3.66Å; W374-F378 HydrophobicContact CZ2-CZ 3.66Å; W374-F378 AromaticContact NE1-CE2 3.79Å
375Y94Very high90.8Very high0 Ų025.8 Ų25.80%014%0.136CC..Hα-helixtrans-64-23.5-178.9-76.4-67.7000113.2Y28 I31 Y70 L75 T78 Y371 V372 L373 N377 I497Y28-Y375 HydrophobicContact CD1-CD2 4.37Å; Y28-Y375 AromaticContact CE1-CD2 3.86Å; Y28-Y375 HydrophobicContact CE1-CD2 3.86Å; Y28-Y375 HydrophobicContact CE1-CE2 4.45Å; I31-Y375 WeakPolarHBondContact CG2-O 3.44Å; Y70-Y375 HydrophobicContact CD1-CE1 4.47Å; Y70-Y375 AromaticContact CE1-CD1 3.7Å; Y70-Y375 HydrophobicContact CE1-CD1 3.7Å; Y70-Y375 AromaticContact CE1-CE1 3.49Å; Y70-Y375 HydrophobicContact CE1-CE1 3.49Å; Y70-Y375 VanDerWaalsContact CE1-CE1 3.49Å; Y70-Y375 AromaticContact CZ-CE1 3.65Å; Y70-Y375 WeakPolarHBondContact OH-CE1 3.14Å; L75-Y375 HydrophobicContact CB-CD1 3.76Å; L75-Y375 HydrophobicContact CB-CE1 3.77Å; L75-Y375 HydrophobicContact CB-CG 4.49Å; L75-Y375 HydrophobicContact CD1-CD1 3.95Å; L75-Y375 HydrophobicContact CD1-CD2 4.02Å; L75-Y375 HydrophobicContact CD1-CE1 4.28Å; L75-Y375 HydrophobicContact CD1-CE2 4.4Å; L75-Y375 HydrophobicContact CD1-CG 3.82Å; L75-Y375 HydrophobicContact CG-CD1 4.29Å; T78-Y375 HydrophobicContact CG2-CE2 4.32Å; T78-Y375 PolarHBondContact OG1-OH 2.96Å; T78-Y375 VanDerWaalsContact OG1-OH 3.12Å; Y371-Y375 HydrophobicContact CD1-CD2 4.37Å; Y371-Y375 AromaticContact CD1-CE2 3.79Å; Y371-Y375 HydrophobicContact CD1-CE2 3.79Å; Y371-Y375 WeakPolarHBondContact O-CD2 3.2Å; Y371-Y375 PolarHBondContact O-N 3.44Å; V372-Y375 PolarHBondContact O-N 3.01Å; L373-Y375 PolarHBondContact O-N 3.29Å; Y375-N377 VanDerWaalsContact C-N 3.26Å; Y375-N377 PolarHBondContact O-N 2.65Å; Y375-I497 PolarHBondContact OH-O 3.1Å; Y375-I497 PolarHBondContact OH-OXT 3.22Å
376T93.6Very high90.5Very high29 Ų2926 Ų2618%0.17813%0.134CC..Hα-helixtrans-63.9-26.3174.563.30000114I31 F328 V372 L373 W374 F378 A379 V380I31-T376 HydrophobicContact CD1-CG2 3.67Å; I31-T376 HydrophobicContact CG1-CG2 4.02Å; F328-T376 WeakPolarHBondContact CZ-OG1 3.35Å; V372-T376 WeakPolarHBondContact O-CG2 3.1Å; V372-T376 PolarHBondContact O-N 3.45Å; L373-T376 PolarHBondContact O-N 3.32Å; L373-T376 PolarHBondContact O-OG1 2.82Å; W374-T376 PolarHBondContact O-N 3.06Å; T376-F378 VanDerWaalsContact C-N 3.32Å; T376-F378 PolarHBondContact O-N 3.33Å; T376-A379 PolarHBondContact O-N 2.95Å; T376-V380 WeakPolarHBondContact O-CG1 3.49Å; T376-V380 PolarHBondContact O-N 3.33Å
377N91.9Very high90.1Very high4 Ų427.7 Ų27.72%0.02114%0.143CC..Hα-helixtrans-51.7-52.2179.7-77.8-54.1000112.1F328 S332 V333 W374 Y375 A379 H381F328-N377 WeakPolarHBondContact CD1-OD1 3.27Å; F328-N377 WeakPolarHBondContact CE1-OD1 3.42Å; S332-N377 PolarHBondContact OG-ND2 3.1Å; S332-N377 PolarHBondContact OG-OD1 3.06Å; V333-N377 WeakPolarHBondContact CG2-ND2 3.39Å; W374-N377 WeakPolarHBondContact O-CB 3.36Å; W374-N377 PolarHBondContact O-N 2.9Å; W374-N377 VanDerWaalsContact O-N 3.14Å; W374-N377 PolarHBondContact O-ND2 3.08Å; Y375-N377 VanDerWaalsContact C-N 3.26Å; Y375-N377 PolarHBondContact O-N 2.65Å; N377-A379 PolarHBondContact O-N 3.28Å; N377-A379 VanDerWaalsContact O-N 3.15Å; N377-H381 PolarHBondContact O-CE1 3.16Å; N377-H381 PolarHBondContact O-ND1 3.08Å
378F93.8Very high89.6Confident5 Ų529.4 Ų29.42%0.02216%0.155CC..Hα-helixtrans-66.6-12.8-177.9-50.5-87.6000112.8N39 D67 Y70 L71 W374 T376N39-F378 PolarHBondContact ND2-O 3.17Å; D67-F378 HydrophobicContact CB-CB 4.29Å; D67-F378 HydrophobicContact CB-CD1 4.4Å; Y70-F378 AromaticContact CD1-CD1 3.61Å; Y70-F378 HydrophobicContact CD1-CD1 3.61Å; Y70-F378 AromaticContact CD1-CD2 3.73Å; Y70-F378 HydrophobicContact CD1-CD2 3.73Å; Y70-F378 AromaticContact CD1-CE1 3.53Å; Y70-F378 HydrophobicContact CD1-CE1 3.53Å; Y70-F378 AromaticContact CD1-CE2 3.68Å; Y70-F378 HydrophobicContact CD1-CE2 3.68Å; Y70-F378 AromaticContact CD1-CG 3.71Å; Y70-F378 HydrophobicContact CD1-CG 3.71Å; Y70-F378 AromaticContact CD1-CZ 3.57Å; Y70-F378 HydrophobicContact CD1-CZ 3.57Å; Y70-F378 HydrophobicContact CE1-CD1 4.34Å; Y70-F378 AromaticContact CE1-CD2 3.75Å; Y70-F378 HydrophobicContact CE1-CD2 3.75Å; Y70-F378 AromaticContact CE1-CE1 4Å; Y70-F378 HydrophobicContact CE1-CE1 4Å; Y70-F378 AromaticContact CE1-CE2 3.38Å; Y70-F378 HydrophobicContact CE1-CE2 3.38Å; Y70-F378 HydrophobicContact CE1-CG 4.23Å; Y70-F378 AromaticContact CE1-CZ 3.51Å; Y70-F378 HydrophobicContact CE1-CZ 3.51Å; Y70-F378 HydrophobicContact CG-CD1 4.32Å; Y70-F378 HydrophobicContact CG-CE1 4.13Å; Y70-F378 HydrophobicContact CG-CZ 4.42Å; L71-F378 HydrophobicContact CD1-CB 4.42Å; L71-F378 HydrophobicContact CD2-CB 4.12Å; L71-F378 HydrophobicContact CG-CB 4.13Å; W374-F378 HydrophobicContact CD2-CE2 4.25Å; W374-F378 AromaticContact CE2-CE2 3.74Å; W374-F378 AromaticContact CE2-CZ 3.92Å; W374-F378 HydrophobicContact CH2-CZ 4.24Å; W374-F378 AromaticContact CZ2-CE2 3.98Å; W374-F378 HydrophobicContact CZ2-CE2 3.98Å; W374-F378 AromaticContact CZ2-CZ 3.66Å; W374-F378 HydrophobicContact CZ2-CZ 3.66Å; W374-F378 AromaticContact NE1-CE2 3.79Å; T376-F378 VanDerWaalsContact C-N 3.32Å; T376-F378 PolarHBondContact O-N 3.33Å
379A93.6Very high88.8Confident10 Ų1029.4 Ų29.48%0.08316%0.156CC..Hα-helixtrans-106-34.3179.500000114.5I31 T376 N377 H381I31-A379 HydrophobicContact CG2-CB 3.86Å; T376-A379 PolarHBondContact O-N 2.95Å; N377-A379 PolarHBondContact O-N 3.28Å; N377-A379 VanDerWaalsContact O-N 3.15Å; A379-H381 VanDerWaalsContact C-N 3.3Å; A379-H381 PolarHBondContact O-N 2.99Å
380V91Very high88Confident25 Ų2526.6 Ų26.615%0.15215%0.15CC..Hα-helixtrans-75.2-14.3-172.8-63.80000114.6F328 T376 F382 L383 L384F328-V380 HydrophobicContact CD1-CG2 3.61Å; F328-V380 HydrophobicContact CD2-CG2 4.47Å; F328-V380 HydrophobicContact CE1-CG1 4.32Å; F328-V380 HydrophobicContact CE1-CG2 3.5Å; F328-V380 VanDerWaalsContact CE1-CG2 3.5Å; F328-V380 HydrophobicContact CE2-CG1 4.39Å; F328-V380 HydrophobicContact CE2-CG2 4.37Å; F328-V380 HydrophobicContact CG-CG2 4.12Å; F328-V380 HydrophobicContact CZ-CG1 3.95Å; F328-V380 HydrophobicContact CZ-CG2 3.91Å; T376-V380 WeakPolarHBondContact O-CG1 3.49Å; T376-V380 PolarHBondContact O-N 3.33Å; V380-F382 VanDerWaalsContact C-N 3.34Å; V380-F382 PolarHBondContact O-N 2.93Å; V380-L383 WeakPolarHBondContact O-CB 3.19Å; V380-L383 PolarHBondContact O-N 2.93Å; V380-L384 HydrophobicContact CB-CD1 4.42Å; V380-L384 HydrophobicContact CB-CG 4.48Å; V380-L384 HydrophobicContact CG2-CD1 3.83Å; V380-L384 HydrophobicContact CG2-CG 4.42Å; V380-L384 PolarHBondContact O-N 3.45Å
381H89.1Confident87Confident6 Ų630.2 Ų30.23%0.02817%0.167CC..Hα-helixtrans-51.3-47.7-173-8017.1000113D67 N377 A379 L383 L384 Y385D67-H381 IonicContact OD2-CD2 3.13Å; N377-H381 PolarHBondContact O-CE1 3.16Å; N377-H381 PolarHBondContact O-ND1 3.08Å; A379-H381 VanDerWaalsContact C-N 3.3Å; A379-H381 PolarHBondContact O-N 2.99Å; H381-L383 VanDerWaalsContact C-N 3.34Å; H381-L383 PolarHBondContact O-N 3.3Å; H381-L384 PolarHBondContact O-N 2.88Å; H381-Y385 HydrophobicContact CB-CE2 3.87Å; H381-Y385 WeakPolarHBondContact O-CD2 3.36Å; H381-Y385 PolarHBondContact O-N 2.8Å
382F86.6Confident86.3Confident23 Ų2330.4 Ų30.410%0.10117%0.168CC..Hα-helixtrans-59.4-39.1176.2176.2-102.7000114.1G38 L41 I45 V380 C386 F392G38-F382 WeakPolarHBondContact O-CB 3.48Å; G38-F382 WeakPolarHBondContact O-CD2 3.47Å; G38-F382 WeakPolarHBondContact O-CG 3.49Å; L41-F382 HydrophobicContact CB-CD2 4.08Å; L41-F382 HydrophobicContact CB-CE2 3.69Å; L41-F382 HydrophobicContact CB-CZ 4.23Å; L41-F382 HydrophobicContact CD1-CE1 4.14Å; L41-F382 HydrophobicContact CD1-CE2 3.93Å; L41-F382 HydrophobicContact CD1-CZ 3.58Å; I45-F382 HydrophobicContact CD1-CE2 4.03Å; V380-F382 VanDerWaalsContact C-N 3.34Å; V380-F382 PolarHBondContact O-N 2.93Å; F382-C386 VanDerWaalsContact CZ-SG 3.57Å; F382-C386 WeakPolarHBondContact O-CB 3.49Å; F382-C386 PolarHBondContact O-N 2.85Å; F382-C386 PolarHBondContact O-SG 3.46Å; F382-F392 AromaticContact CD2-CE1 3.82Å; F382-F392 HydrophobicContact CD2-CE1 3.82Å; F382-F392 AromaticContact CD2-CZ 3.91Å; F382-F392 HydrophobicContact CD2-CZ 3.91Å; F382-F392 AromaticContact CE2-CE1 3.75Å; F382-F392 HydrophobicContact CE2-CE1 3.75Å; F382-F392 HydrophobicContact CE2-CZ 4.03Å
383L87Confident85.8Confident82 Ų8234.1 Ų34.143%0.42918%0.18SC..Hα-helixtrans-68-43177.9-60176.3000110.3V380 H381 C386 L387V380-L383 WeakPolarHBondContact O-CB 3.19Å; V380-L383 PolarHBondContact O-N 2.93Å; H381-L383 VanDerWaalsContact C-N 3.34Å; H381-L383 PolarHBondContact O-N 3.3Å; L383-C386 PolarHBondContact O-N 3.48Å; L383-L387 WeakPolarHBondContact O-CB 3.32Å; L383-L387 VanDerWaalsContact O-CG 3.28Å; L383-L387 WeakPolarHBondContact O-CG 3.45Å; L383-L387 PolarHBondContact O-N 3.14Å
384L87.3Confident85.3Confident26 Ų2634.8 Ų34.814%0.13619%0.192CC..Hα-helixtrans-65.5-39.3176.4-62.1177.5000112.1I325 F328 V380 H381 L387 S388I325-L384 HydrophobicContact CB-CD1 4.34Å; I325-L384 HydrophobicContact CG1-CB 3.86Å; I325-L384 HydrophobicContact CG1-CD1 3.73Å; I325-L384 HydrophobicContact CG1-CG 4.46Å; F328-L384 HydrophobicContact CB-CD1 4.04Å; F328-L384 HydrophobicContact CG-CD1 4.32Å; V380-L384 HydrophobicContact CB-CD1 4.42Å; V380-L384 HydrophobicContact CB-CG 4.48Å; V380-L384 HydrophobicContact CG2-CD1 3.83Å; V380-L384 HydrophobicContact CG2-CG 4.42Å; V380-L384 PolarHBondContact O-N 3.45Å; H381-L384 PolarHBondContact O-N 2.88Å; L384-L387 PolarHBondContact O-N 2.77Å; L384-S388 WeakPolarHBondContact O-CB 3.36Å; L384-S388 PolarHBondContact O-N 2.76Å
385Y84.9Confident84.8Confident3 Ų335.9 Ų35.91%0.01220%0.198CC..Hα-helixtrans-60.5-43.6170.2-57-34.5000111.6T42 L60 M321 I325 H381 G389 F392T42-Y385 HydrophobicContact CG2-CD2 3.88Å; T42-Y385 HydrophobicContact CG2-CE2 3.54Å; L60-Y385 HydrophobicContact CD2-CE1 4.05Å; M321-Y385 HydrophobicContact CE-CD1 3.73Å; M321-Y385 HydrophobicContact CE-CE1 3.9Å; M321-Y385 HydrophobicContact CG-CD1 3.76Å; M321-Y385 HydrophobicContact SD-CD1 3.53Å; M321-Y385 VanDerWaalsContact SD-CD1 3.53Å; M321-Y385 HydrophobicContact SD-CE1 4.32Å; M321-Y385 HydrophobicContact SD-CG 4.29Å; I325-Y385 HydrophobicContact CD1-CD1 3.79Å; I325-Y385 HydrophobicContact CD1-CE1 3.34Å; H381-Y385 HydrophobicContact CB-CE2 3.87Å; H381-Y385 WeakPolarHBondContact O-CD2 3.36Å; H381-Y385 PolarHBondContact O-N 2.8Å; Y385-G389 VanDerWaalsContact O-CA 3.26Å; Y385-G389 WeakPolarHBondContact O-CA 3.3Å; Y385-G389 PolarHBondContact O-N 3.1Å; Y385-F392 HydrophobicContact CD2-CE1 4.49Å; Y385-F392 HydrophobicContact CD2-CE2 4.39Å; Y385-F392 HydrophobicContact CD2-CZ 4.11Å; Y385-F392 HydrophobicContact CG-CZ 4.47Å
386C83.3Confident84.2Confident26 Ų2636.1 Ų36.118%0.17620%0.199CC..Hα-helixtrans-68.1-38.5178.4-780000113.6F382 L383 R393F382-C386 VanDerWaalsContact CZ-SG 3.57Å; F382-C386 WeakPolarHBondContact O-CB 3.49Å; F382-C386 PolarHBondContact O-N 2.85Å; F382-C386 PolarHBondContact O-SG 3.46Å; L383-C386 PolarHBondContact O-N 3.48Å; C386-R393 WeakPolarHBondContact O-CB 3.32Å; C386-R393 WeakPolarHBondContact O-CD 3.45Å; C386-R393 PolarHBondContact O-NH1 2.85Å
387L82.8Confident83.9Confident124 Ų12441 Ų4165%0.64922%0.218SC*.Hα-helixtrans-74.6-56-179.8-70.6168000111.3L383 L384 R393L383-L387 WeakPolarHBondContact O-CB 3.32Å; L383-L387 VanDerWaalsContact O-CG 3.28Å; L383-L387 WeakPolarHBondContact O-CG 3.45Å; L383-L387 PolarHBondContact O-N 3.14Å; L384-L387 PolarHBondContact O-N 2.77Å; L387-R393 PolarHBondContact O-NH1 3.38Å
388S77.3Confident83.5Confident36 Ų3646.1 Ų46.125%0.25224%0.242SC..Hα-helixtrans-84.3-20.1-171.9-600000114.1M321 L384 P390M321-S388 VanDerWaalsContact CA-CB 3.46Å; L384-S388 WeakPolarHBondContact O-CB 3.36Å; L384-S388 PolarHBondContact O-N 2.76Å; S388-P390 WeakPolarHBondContact O-CD 3.49Å
389G73.7Confident83Confident2 Ų250.7 Ų50.72%0.02126%0.259CS..  trans-106.583.8-176.500000114.1Y385 Q391 F392 R393Y385-G389 VanDerWaalsContact O-CA 3.26Å; Y385-G389 WeakPolarHBondContact O-CA 3.3Å; Y385-G389 PolarHBondContact O-N 3.1Å; G389-Q391 PolarHBondContact O-N 2.75Å; G389-Q391 VanDerWaalsContact O-N 3.07Å; G389-F392 WeakPolarHBondContact O-CA 3.38Å; G389-F392 WeakPolarHBondContact O-CB 3.5Å; G389-F392 PolarHBondContact O-N 3.35Å; G389-R393 WeakPolarHBondContact O-CB 3.43Å; G389-R393 PolarHBondContact O-N 3.44Å
390P75.3Confident82.6Confident65 Ų6554.3 Ų54.342%0.42228%0.276SS..Hα-helixtrans-53.4-29.6174.618.5-33.2000114.6S317 S388 A394S317-P390 WeakPolarHBondContact OG-CD 3.09Å; S388-P390 WeakPolarHBondContact O-CD 3.49Å; P390-A394 WeakPolarHBondContact O-CB 3.3Å; P390-A394 PolarHBondContact O-N 2.93Å; P390-A394 VanDerWaalsContact O-N 3.08Å
391Q72.3Confident82.4Confident80 Ų8059.7 Ų59.737%0.37430%0.3SS..Hα-helixtrans-72.7-38.9174.2-64.8-171.60.800112.7G389 Q395G389-Q391 PolarHBondContact O-N 2.75Å; G389-Q391 VanDerWaalsContact O-N 3.07Å; Q391-Q395 WeakPolarHBondContact O-CG 3.46Å; Q391-Q395 PolarHBondContact O-N 2.88Å
392F76.6Confident82.2Confident17 Ų1762 Ų628%0.07532%0.316CS..Hα-helixtrans-67.7-49.1174.3-175.4-90.8000110T42 I45 L46 F382 Y385 G389 A394 Q395 A396T42-F392 HydrophobicContact CG2-CE2 4.45Å; I45-F392 HydrophobicContact CB-CE2 4.05Å; I45-F392 HydrophobicContact CB-CZ 4.31Å; I45-F392 HydrophobicContact CD1-CE1 4.24Å; I45-F392 HydrophobicContact CD1-CE2 4.45Å; I45-F392 HydrophobicContact CD1-CZ 3.9Å; I45-F392 HydrophobicContact CG2-CD2 3.86Å; I45-F392 HydrophobicContact CG2-CE2 3.6Å; I45-F392 HydrophobicContact CG2-CZ 4.14Å; L46-F392 HydrophobicContact CD2-CD2 4.03Å; L46-F392 HydrophobicContact CD2-CE2 3.95Å; L46-F392 HydrophobicContact CG-CE2 4.29Å; F382-F392 AromaticContact CD2-CE1 3.82Å; F382-F392 HydrophobicContact CD2-CE1 3.82Å; F382-F392 AromaticContact CD2-CZ 3.91Å; F382-F392 HydrophobicContact CD2-CZ 3.91Å; F382-F392 AromaticContact CE2-CE1 3.75Å; F382-F392 HydrophobicContact CE2-CE1 3.75Å; F382-F392 HydrophobicContact CE2-CZ 4.03Å; Y385-F392 HydrophobicContact CD2-CE1 4.49Å; Y385-F392 HydrophobicContact CD2-CE2 4.39Å; Y385-F392 HydrophobicContact CD2-CZ 4.11Å; Y385-F392 HydrophobicContact CG-CZ 4.47Å; G389-F392 WeakPolarHBondContact O-CA 3.38Å; G389-F392 WeakPolarHBondContact O-CB 3.5Å; G389-F392 PolarHBondContact O-N 3.35Å; F392-A394 VanDerWaalsContact C-N 3.27Å; F392-A394 PolarHBondContact O-N 3.48Å; F392-Q395 CarbonylContact O-C 3.44Å; F392-Q395 PolarHBondContact O-N 3.4Å; F392-A396 WeakPolarHBondContact O-CB 3.46Å; F392-A396 PolarHBondContact O-N 3.24Å
393R82.9Confident82Confident98 Ų9863.2 Ų63.237%0.3733%0.327SS..Hα-helixtrans-53.9-38175.3-176.7167.761-116.915.2113.5C386 L387 G389 K397C386-R393 WeakPolarHBondContact O-CB 3.32Å; C386-R393 WeakPolarHBondContact O-CD 3.45Å; C386-R393 PolarHBondContact O-NH1 2.85Å; L387-R393 PolarHBondContact O-NH1 3.38Å; G389-R393 WeakPolarHBondContact O-CB 3.43Å; G389-R393 PolarHBondContact O-N 3.44Å; R393-K397 WeakPolarHBondContact O-CB 3.32Å; R393-K397 WeakPolarHBondContact O-CG 3.38Å; R393-K397 PolarHBondContact O-N 2.92Å
394A81.8Confident81.8Confident60 Ų6067 Ų6750%0.49634%0.337SS..Hα-helixtrans-66.7-41.8175.600000112.5P390 F392 H398P390-A394 WeakPolarHBondContact O-CB 3.3Å; P390-A394 PolarHBondContact O-N 2.93Å; P390-A394 VanDerWaalsContact O-N 3.08Å; F392-A394 VanDerWaalsContact C-N 3.27Å; F392-A394 PolarHBondContact O-N 3.48Å; A394-H398 PolarHBondContact O-N 3.45Å; A394-H398 VanDerWaalsContact O-N 3.07Å
395Q82Confident81.6Confident33 Ų3371.9 Ų71.915%0.15436%0.359CS..Hα-helixtrans-71.3-39.1176.6-63.9-773000111.9I45 L51 Q391 F392 H398 W399I45-Q395 HydrophobicContact CG2-CB 3.94Å; L51-Q395 HydrophobicContact CD1-CG 4.39Å; Q391-Q395 WeakPolarHBondContact O-CG 3.46Å; Q391-Q395 PolarHBondContact O-N 2.88Å; F392-Q395 CarbonylContact O-C 3.44Å; F392-Q395 PolarHBondContact O-N 3.4Å; Q395-H398 PolarHBondContact O-N 3.36Å; Q395-W399 PolarHBondContact O-N 2.7Å
396A82.2Confident81.4Confident4 Ų479.7 Ų79.73%0.03339%0.393CS..Hα-helixtrans-60-46.5173.900000111.3I45 F392 W399 L400I45-A396 HydrophobicContact CD1-CB 3.72Å; F392-A396 WeakPolarHBondContact O-CB 3.46Å; F392-A396 PolarHBondContact O-N 3.24Å; A396-W399 PolarHBondContact O-N 3.49Å; A396-L400 WeakPolarHBondContact O-CB 3.18Å; A396-L400 VanDerWaalsContact O-CG 3.29Å; A396-L400 WeakPolarHBondContact O-CG 3.26Å; A396-L400 PolarHBondContact O-N 2.85Å
397K85.9Confident81.2Confident131 Ų13184.8 Ų84.857%0.5742%0.417SS*.Hα-helixtrans-60.3-46174.2-78.4-171.1172.9-160.20112.2R393 W399 L400 Q401R393-K397 WeakPolarHBondContact O-CB 3.32Å; R393-K397 WeakPolarHBondContact O-CG 3.38Å; R393-K397 PolarHBondContact O-N 2.92Å; K397-W399 PolarHBondContact O-N 2.64Å; K397-L400 PolarHBondContact O-N 3.22Å; K397-Q401 WeakPolarHBondContact O-CB 3.11Å; K397-Q401 VanDerWaalsContact O-CG 3.23Å; K397-Q401 WeakPolarHBondContact O-CG 3.32Å; K397-Q401 PolarHBondContact O-N 2.95Å; K397-Q401 PolarHBondContact O-OE1 2.8Å
398H84.7Confident80.9Confident113 Ų11383.2 Ų83.252%0.52341%0.41SS..Hα-helixtrans-58.9-45.8176.1-175.1-62.5000111.9A394 Q395 Q401 S402A394-H398 PolarHBondContact O-N 3.45Å; A394-H398 VanDerWaalsContact O-N 3.07Å; Q395-H398 PolarHBondContact O-N 3.36Å; H398-Q401 PolarHBondContact O-N 2.8Å; H398-S402 PolarHBondContact ND1-OG 3.15Å; H398-S402 WeakPolarHBondContact O-CB 3.28Å; H398-S402 PolarHBondContact O-N 3.49Å; H398-S402 PolarHBondContact O-OG 3.3Å
399W83.4Confident80.5Confident101 Ų10186.2 Ų86.238%0.38342%0.422SS..Hα-helixtrans-61.5-50.5176.5-101103000112.1V44 I45 Q395 A396 K397 Q401 S402 C403V44-W399 HydrophobicContact CG1-CD2 4.02Å; V44-W399 HydrophobicContact CG1-CE3 4.1Å; V44-W399 HydrophobicContact CG1-CH2 3.57Å; V44-W399 HydrophobicContact CG1-CZ2 3.47Å; V44-W399 VanDerWaalsContact CG1-CZ2 3.47Å; V44-W399 HydrophobicContact CG1-CZ3 3.89Å; I45-W399 HydrophobicContact CG1-CG 4.4Å; Q395-W399 PolarHBondContact O-N 2.7Å; A396-W399 PolarHBondContact O-N 3.49Å; K397-W399 PolarHBondContact O-N 2.64Å; W399-Q401 VanDerWaalsContact C-N 3.33Å; W399-Q401 PolarHBondContact O-N 2.87Å; W399-S402 WeakPolarHBondContact O-CA 3.39Å; W399-S402 WeakPolarHBondContact O-CB 3.36Å; W399-S402 PolarHBondContact O-N 3.37Å; W399-C403 PolarHBondContact O-N 2.88Å; W399-C403 PolarHBondContact O-SG 2.94Å; W399-C403 VanDerWaalsContact O-SG 3.39Å
400L84.2Confident79.8Confident86 Ų8690.4 Ų90.445%0.4545%0.449SS..Hα-helixtrans-61.2-39.2178.8-70.3168.4000112.3A396 K397 C403 Y404A396-L400 WeakPolarHBondContact O-CB 3.18Å; A396-L400 VanDerWaalsContact O-CG 3.29Å; A396-L400 WeakPolarHBondContact O-CG 3.26Å; A396-L400 PolarHBondContact O-N 2.85Å; K397-L400 PolarHBondContact O-N 3.22Å; L400-C403 PolarHBondContact O-N 2.66Å; L400-Y404 VanDerWaalsContact O-CB 3.25Å; L400-Y404 WeakPolarHBondContact O-CB 3.43Å; L400-Y404 PolarHBondContact O-N 3.18Å
401Q87.1Confident78.5Confident137 Ų13793.2 Ų93.264%0.6447%0.469SS*.Hα-helixtrans-65.6-37.6172.8-72.4172.6-52.900112.2K397 H398 W399 H405K397-Q401 WeakPolarHBondContact O-CB 3.11Å; K397-Q401 VanDerWaalsContact O-CG 3.23Å; K397-Q401 WeakPolarHBondContact O-CG 3.32Å; K397-Q401 PolarHBondContact O-N 2.95Å; K397-Q401 PolarHBondContact O-OE1 2.8Å; H398-Q401 PolarHBondContact O-N 2.8Å; W399-Q401 VanDerWaalsContact C-N 3.33Å; W399-Q401 PolarHBondContact O-N 2.87Å; Q401-H405 WeakPolarHBondContact O-CB 3.24Å; Q401-H405 PolarHBondContact O-N 2.88Å
402S84.6Confident77.2Confident54 Ų5497 Ų9738%0.37849%0.491SS..Hα-helixtrans-66.4-45.5176.1-51.50000111.2H398 W399 H405 F406H398-S402 PolarHBondContact ND1-OG 3.15Å; H398-S402 WeakPolarHBondContact O-CB 3.28Å; H398-S402 PolarHBondContact O-N 3.49Å; H398-S402 PolarHBondContact O-OG 3.3Å; W399-S402 WeakPolarHBondContact O-CA 3.39Å; W399-S402 WeakPolarHBondContact O-CB 3.36Å; W399-S402 PolarHBondContact O-N 3.37Å; S402-H405 PolarHBondContact O-N 3.1Å; S402-F406 WeakPolarHBondContact O-CB 3.38Å; S402-F406 PolarHBondContact O-N 3.34Å
403C83.4Confident75.7Confident49 Ų49103.1 Ų103.133%0.33152%0.523SS..Hα-helixtrans-63-43.5175.2-67.80000111.7W399 L400 H405 F406 I407W399-C403 PolarHBondContact O-N 2.88Å; W399-C403 PolarHBondContact O-SG 2.94Å; W399-C403 VanDerWaalsContact O-SG 3.39Å; L400-C403 PolarHBondContact O-N 2.66Å; C403-H405 PolarHBondContact O-N 2.8Å; C403-F406 PolarHBondContact O-N 2.8Å; C403-I407 WeakPolarHBondContact O-CB 3.14Å; C403-I407 WeakPolarHBondContact O-CD1 3.47Å; C403-I407 VanDerWaalsContact O-CG1 3.26Å; C403-I407 WeakPolarHBondContact O-CG1 3.32Å; C403-I407 PolarHBondContact O-N 2.98Å
404Y83.2Confident73.6Confident161 Ų161107 Ų10763%0.63155%0.545SS*.Hα-helixtrans-61.6-43176.3-177.9-94.6000111.6L400 F406 I407 N408L400-Y404 VanDerWaalsContact O-CB 3.25Å; L400-Y404 WeakPolarHBondContact O-CB 3.43Å; L400-Y404 PolarHBondContact O-N 3.18Å; Y404-F406 VanDerWaalsContact C-N 3.34Å; Y404-F406 PolarHBondContact O-N 2.78Å; Y404-I407 PolarHBondContact O-N 2.71Å; Y404-N408 VanDerWaalsContact CD2-ND2 3.32Å; Y404-N408 WeakPolarHBondContact CD2-ND2 3.28Å; Y404-N408 WeakPolarHBondContact CE2-ND2 3.42Å; Y404-N408 WeakPolarHBondContact O-CB 3.17Å; Y404-N408 PolarHBondContact O-N 3.44Å; Y404-N408 PolarHBondContact O-ND2 2.83Å
405H82.3Confident71.8Confident129 Ų129111.7 Ų111.760%0.59756%0.562SS**Hα-helixtrans-65.3-35.8174.1-169.4-44.7000112.2Q401 S402 C403 L409Q401-H405 WeakPolarHBondContact O-CB 3.24Å; Q401-H405 PolarHBondContact O-N 2.88Å; S402-H405 PolarHBondContact O-N 3.1Å; C403-H405 PolarHBondContact O-N 2.8Å; H405-L409 WeakPolarHBondContact O-CB 3.31Å; H405-L409 PolarHBondContact O-N 3.36Å; H405-L409 VanDerWaalsContact O-N 3.15Å
406F80.3Confident69.7Low168 Ų168118.4 Ų118.474%0.73759%0.59SS**Hα-helixtrans-69.3-42.6177-173.9-97.9000112.2S402 C403 Y404 L409S402-F406 WeakPolarHBondContact O-CB 3.38Å; S402-F406 PolarHBondContact O-N 3.34Å; C403-F406 PolarHBondContact O-N 2.8Å; Y404-F406 VanDerWaalsContact C-N 3.34Å; Y404-F406 PolarHBondContact O-N 2.78Å; F406-L409 PolarHBondContact O-N 2.88Å
407I79.8Confident67.6Low132 Ų132123.9 Ų123.968%0.67763%0.626SS**Hα-helixtrans-69.3-36.7179.3-68.1163.7000111.8C403 Y404 L409C403-I407 WeakPolarHBondContact O-CB 3.14Å; C403-I407 WeakPolarHBondContact O-CD1 3.47Å; C403-I407 VanDerWaalsContact O-CG1 3.26Å; C403-I407 WeakPolarHBondContact O-CG1 3.32Å; C403-I407 PolarHBondContact O-N 2.98Å; Y404-I407 PolarHBondContact O-N 2.71Å; I407-L409 VanDerWaalsContact C-N 3.34Å
408N75.6Confident65.5Low92 Ų92123.2 Ų123.249%0.49263%0.632SS.*THydrogen-bonded Turntrans-90.37.3178-65.6-85.9000113.5Y404 P410Y404-N408 VanDerWaalsContact CD2-ND2 3.32Å; Y404-N408 WeakPolarHBondContact CD2-ND2 3.28Å; Y404-N408 WeakPolarHBondContact CE2-ND2 3.42Å; Y404-N408 WeakPolarHBondContact O-CB 3.17Å; Y404-N408 PolarHBondContact O-N 3.44Å; Y404-N408 PolarHBondContact O-ND2 2.83Å; N408-P410 VanDerWaalsContact O-CD 3.31Å; N408-P410 WeakPolarHBondContact O-CD 3.13Å
409L70.3Confident63.2Low98 Ų98125.2 Ų125.251%0.51365%0.646SS.*SBendtrans-78114171.6-171.169.2000108.2H405 F406 I407 C411H405-L409 WeakPolarHBondContact O-CB 3.31Å; H405-L409 PolarHBondContact O-N 3.36Å; H405-L409 VanDerWaalsContact O-N 3.15Å; F406-L409 PolarHBondContact O-N 2.88Å; I407-L409 VanDerWaalsContact C-N 3.34Å; L409-C411 PolarHBondContact O-N 3.39Å
410P57.4Low61.2Low91 Ų91129.4 Ų129.459%0.59167%0.667SS**  trans-61.9128.5178.625.7-33.8000109.4N408 L412N408-P410 VanDerWaalsContact O-CD 3.31Å; N408-P410 WeakPolarHBondContact O-CD 3.13Å; P410-L412 PolarHBondContact O-N 3.31Å
411C48.8Very low59.1Low124 Ų124132.4 Ų132.484%0.83868%0.682SS**  trans-71.875.1174.9-71.70000109.9L409 I413L409-C411 PolarHBondContact O-N 3.39Å; C411-I413 VanDerWaalsContact C-N 3.34Å; C411-I413 PolarHBondContact O-N 2.96Å
412L44.2Very low57Low158 Ų158130.6 Ų130.683%0.82768%0.682SS**  trans-70.692.3175.1-89.8165.9000110P410P410-L412 PolarHBondContact O-N 3.31Å
413I45.9Very low54.8Low146 Ų146135.3 Ų135.375%0.74970%0.703SS**  trans-53.3133.2167.4-65.3159.6000109.2C411C411-I413 VanDerWaalsContact C-N 3.34Å; C411-I413 PolarHBondContact O-N 2.96Å
414H39.5Very low52.6Low181 Ų181139.6 Ų139.684%0.83873%0.728SS**  trans51.6103170.7-93.1-106.9000117.1
415D42.6Very low50.5Low158 Ų158137.1 Ų137.185%0.84573%0.73SS**  -150.6164.2121.4-135.6-31.8000112.9
416K38.3Very low48.3Very low174 Ų174140.3 Ų140.376%0.75774%0.742SS**  trans-67.8143.5-171.3-81176.5176171.80113.4T418K416-T418 VanDerWaalsContact C-N 3.33Å; K416-T418 PolarHBondContact O-N 3.38Å
417P37.5Very low46.1Very low119 Ų119140.4 Ų140.477%0.77375%0.749SS**  trans-71.786.1171.431.5-34.8000110.7I419P417-I419 PolarHBondContact O-N 3.47Å
418T42.2Very low43.9Very low116 Ų116143.2 Ų143.271%0.71276%0.758SS**  trans-71.7100.1170.7-53.80000108.5K416 K420K416-T418 VanDerWaalsContact C-N 3.33Å; K416-T418 PolarHBondContact O-N 3.38Å; T418-K420 PolarHBondContact O-N 3.46Å
419I37.4Very low42.1Very low156 Ų156147.3 Ų147.380%0.877%0.774SS**  trans-63.899.2-179.4-56.7175.3000109.2P417P417-I419 PolarHBondContact O-N 3.47Å
420K40.8Very low40.4Very low189 Ų189151.7 Ų151.782%0.82279%0.79SS**  trans-90104.6163.5-72.8-168.2175.3-174.60108.9T418T418-K420 PolarHBondContact O-N 3.46Å
421L40.7Very low39.4Very low148 Ų148155.5 Ų155.578%0.77580%0.8SS**  trans-61.3132.7169.4-16773.1000108.8
422P42.6Very low38.8Very low100 Ų100156.8 Ų156.865%0.64980%0.798SS**  trans-75.1133.2175.429.9-33000110.4T424P422-T424 PolarHBondContact O-N 2.98Å
423D39Very low38.4Very low152 Ų152154.2 Ų154.281%0.81379%0.793SS**  trans-60.7103.6179.9-76.8-63.3000112.5T425D423-T425 VanDerWaalsContact C-N 3.27Å; D423-T425 PolarHBondContact O-N 3.17Å
424T36.1Very low38Very low139 Ų139154.1 Ų154.185%0.85379%0.793SS**  trans-7875.2172.252.70000110.7P422P422-T424 PolarHBondContact O-N 2.98Å
425T39.3Very low37.8Very low110 Ų110153.1 Ų153.168%0.67579%0.792SS**  trans-118.3140.7165.852.10000111.2D423D423-T425 VanDerWaalsContact C-N 3.27Å; D423-T425 PolarHBondContact O-N 3.17Å
426K35.7Very low37.5Very low195 Ų195154.1 Ų154.185%0.84879%0.792SS**SBendtrans68.363.9175.5-53.4175.7179.8174.10117.1
427I34.7Very low37.3Very low171 Ų171155.8 Ų155.888%0.87780%0.799SS**  -148.2107.9117.3-80.4122.2000105.6
428H33.7Very low37.1Very low190 Ų190155.6 Ų155.688%0.8880%0.797SS**  trans-147.443.3177.8-147.8-57.6000111.4
429E37.4Very low36.7Very low178 Ų178158.3 Ų158.383%0.83281%0.807SS**  trans-156.171.9-178.7-142.4175.7-146.700111
430F35.1Very low36.6Very low191 Ų191156 Ų15684%0.83880%0.804SS**SBendtrans-177.3146.6142.6-121.5-112.8000111.1
431H37.1Very low36.1Very low171 Ų171155.3 Ų155.379%0.79280%0.804SS**  trans60.380.7178.4-81.9-66.9000117.6
432D34.7Very low35.8Very low150 Ų150157.7 Ų157.780%0.80281%0.811SS**  trans-50.5166.8140.4-86.8-62.4000114.2
433S35.9Very low35.1Very low105 Ų105159.7 Ų159.773%0.73482%0.816SS**  trans89.3142.9158.578.60000119.4
434I37.4Very low34.7Very low144 Ų144160.6 Ų160.674%0.73882%0.821SS**  trans88.178.1167.2-46.5-176.3000117.5
435I36.6Very low34.3Very low160 Ų160160.8 Ų160.882%0.82182%0.816SS**  trans82.9131.5134.6-62.2173.6000119.4
436Q35.6Very low33.9Very low179 Ų179166 Ų16684%0.83683%0.825SS**  trans-96.4148.7-179.4-51.4142.6-62.100112.3
437K34.9Very low33.7Very low209 Ų209161.5 Ų161.591%0.90982%0.818SS**  trans-174.8121.5131.6-112.4179.9178.5-178.30113.3
438P32.6Very low33.6Very low114 Ų114159.6 Ų159.674%0.7482%0.817SS**  trans-117.1153.1166.238.4-28.7000113.2
439L34.4Very low33.5Very low173 Ų173155.7 Ų155.791%0.90681%0.811SS**  trans171145164-92.1154.2000105.6
440S35Very low33.2Very low108 Ų108152.5 Ų152.576%0.75581%0.808SS**  cis-159.8160-1338.40000109
441Q29.3Very low32.9Very low174 Ų174153 Ų15381%0.81381%0.81SS**  trans-83158.2-179-61164.1-66.800113.1
442Q33.9Very low32.7Very low198 Ų198154.6 Ų154.693%0.92582%0.818SS**  trans-148.5145.1143.2-118.6173.2200110.8
443N27.8Very low32.3Very low142 Ų142152 Ų15276%0.75981%0.812SS**  trans-104.1156.2-175.4-64.7-50.5000111.1
444L32Very low32.1Very low172 Ų172157.6 Ų157.690%0.90182%0.818SS**  trans-150.6140.3146.8-111.5153.2000109.3
445N26.7Very low31.8Very low142 Ų142157.1 Ų157.176%0.75982%0.817SS**  trans-147.7134.8-165-167.829.1000108.5
446Y31.3Very low31.9Very low221 Ų221156.5 Ų156.587%0.86782%0.815SS**  trans-153.8140.7173.9-119.3-82.8000111.5
447S30.9Very low31.8Very low100 Ų100152.8 Ų152.870%0.69981%0.805SS**  trans-116.4151.6-178.4-62.80000111.6
448P33.2Very low31.7Very low131 Ų131150 Ų15085%0.85180%0.798SS**  trans-91.1166.6176.837.2-35.6000113
449S31.1Very low31.8Very low107 Ų107152.9 Ų152.975%0.74880%0.802SS**  trans-145.7150.8179.360.90000115.3
450S32.8Very low31.8Very low111 Ų111152.5 Ų152.578%0.77680%0.795SS**  trans59.5107.315253.70000121.3
451K28.4Very low31.6Very low203 Ų203152.7 Ų152.788%0.88379%0.788SS**  trans-39.4159.9149.8-52.8166.1173.5-179.30114.8
452Q32.5Very low31.9Very low204 Ų204149.4 Ų149.495%0.95378%0.782SS**  trans-145.9165131.6-136.8160.3-10.400110.8
453S26.2Very low32Very low96 Ų96150.1 Ų150.167%0.67178%0.777SS**  trans-134.9160-172.7-164.20000110.2
454Y32.5Very low32.2Very low221 Ų221151 Ų15187%0.86778%0.777SS**  trans-146.7131.5164.4-120.7-85.1000109.9
455D31.1Very low32.3Very low134 Ų134150.1 Ų150.172%0.71777%0.768SS**  trans-98.2160.1171.9-68.8-75.5000110.1
456D37.8Very low32.6Very low147 Ų147151.1 Ų151.179%0.78677%0.767SS**  trans157.1153.9140.3-88.2-32.6000112.9
457T34.5Very low32.4Very low102 Ų102151.1 Ų151.163%0.62677%0.767SS**  cis-173.5128.5-32.4-101.80000110.4
458I32.4Very low32.5Very low149 Ų149152.2 Ų152.276%0.76477%0.772SS**  trans66.6164.4159.4-77174.1000115
459Q34.2Very low32.1Very low176 Ų176154.7 Ų154.782%0.82277%0.772SS**  cis-141.8-137.521-153.3144.842.600116.2
460H33.5Very low32Very low164 Ų164158.6 Ų158.676%0.75978%0.779SS**  trans-113.6-177.5-170.7-82.8-106.1000111.4
461N32.4Very low31.7Very low113 Ų113158.3 Ų158.360%0.60478%0.777SS**  cis-156.7161.67.3-139.923.3000111.7
462P35.6Very low31.6Very low104 Ų104157.7 Ų157.768%0.67578%0.776SS**  trans-109.2164.6173.339.5-31.4000114.7
463Y35.1Very low31.3Very low214 Ų214156.2 Ų156.284%0.83977%0.77SS**  trans-145.5162.6169.8-94.6-77.2000114.6
464H31.6Very low31.2Very low161 Ų161162.5 Ų162.575%0.74578%0.78SS**  trans-86.5161.9-168.7-74.7-114.4000115.1
465H34.9Very low30.8Very low153 Ų153156.4 Ų156.471%0.70877%0.77SS**  -179.3143.299.9-97.9-78.7000117.1
466H33.4Very low30.5Very low162 Ų162160.3 Ų160.375%0.7578%0.781SS**  trans32.7131.8155.1-61.9-36.2000125.6
467Y27.2Very low30.1Very low221 Ų221158.2 Ų158.287%0.86777%0.773SS**  trans-83.5164.5142.8-87.2-93.2000111.2
468P31.7Very low29.8Very low123 Ų123162.1 Ų162.180%0.79978%0.784SS**  -135.5177.2112.137.3-26.8000114.7
469Q26.2Very low30Very low184 Ų184158 Ų15886%0.8676%0.763SS**  trans-93.2157.3-175.2-52.2157-59.800112.3
470Q28.1Very low30.1Very low188 Ų188153.8 Ų153.888%0.87975%0.746SS**  trans-166.9158.3133.4-112.7170.32000115.6
471S27.4Very low30.3Very low105 Ų105152.9 Ų152.973%0.73474%0.742SS**  trans50.3108.4161.257.70000120
472H24.8Very low30.4Very low190 Ų190154.4 Ų154.488%0.8875%0.746SS**  trans-75.7129.9152.8-75.6-88.4000110.3
473Q26.5Very low30.8Very low173 Ų173151.4 Ų151.481%0.80872%0.724SS**  trans-139.7127.4163.9-163.7160.6-7.600108.8S475Q473-S475 PolarHBondContact O-N 3.47Å; Q473-S475 VanDerWaalsContact O-N 3.1Å
474Y24.5Very low31.2Very low229 Ų229142.1 Ų142.190%0.89869%0.688SS**  trans-76.298.6-173.7-79.8-93.8000110.8
475S24Very low31.6Very low93 Ų93138.5 Ų138.565%0.6567%0.671SS**  trans-103.3121.7175.8-59.90000110.6Q473 V477Q473-S475 PolarHBondContact O-N 3.47Å; Q473-S475 VanDerWaalsContact O-N 3.1Å; S475-V477 PolarHBondContact O-N 2.89Å
476F25.2Very low31.9Very low216 Ų216133.8 Ų133.895%0.94765%0.653SS**  trans-69.199165.1-90.9-102.2000108.6Q478F476-Q478 PolarHBondContact O-N 3.46Å
477V28.9Very low32.4Very low103 Ų103127.4 Ų127.462%0.62463%0.625SS**  trans-76.1111.6177.3178.70000108.9S475 I479S475-V477 PolarHBondContact O-N 2.89Å; V477-I479 PolarHBondContact O-N 3.26Å
478Q27.7Very low33Very low184 Ų184117.6 Ų117.686%0.8659%0.586SS**PPolyproline II helixtrans-62.1128.7162.8-72.5-178.8-96.700108.7F476F476-Q478 PolarHBondContact O-N 3.46Å
479I37.5Very low33.4Very low61 Ų61115 Ų11531%0.31356%0.561SS.*PPolyproline II helixtrans-87.2121.3175.2-60169.2000106.9P14 L357 V477 E481 N483P14-I479 HydrophobicContact CG-CD1 3.92Å; L357-I479 HydrophobicContact CD1-CD1 3.8Å; L357-I479 HydrophobicContact CD2-CD1 4.28Å; V477-I479 PolarHBondContact O-N 3.26Å; I479-E481 PolarHBondContact O-N 3Å; I479-N483 HydrophobicContact CG2-CB 4.29Å
480N36.2Very low34Very low89 Ų89106.9 Ų106.948%0.47652%0.524SS..PPolyproline II helixtrans-56134.5172.7-67.516.3000109.9E482 N483 Y484N480-E482 PolarHBondContact O-N 3.06Å; N480-E482 VanDerWaalsContact O-N 3.15Å; N480-N483 PolarHBondContact O-N 3.12Å; N480-Y484 PolarHBondContact O-N 3.35Å
481E37.2Very low34.5Very low144 Ų14498.5 Ų98.567%0.67349%0.486SS*.Hα-helixtrans-50.8-41.9179.2-68.2-179.8117.800111.7I479 N483 Y484 Q485I479-E481 PolarHBondContact O-N 3Å; E481-N483 VanDerWaalsContact C-N 3.32Å; E481-N483 PolarHBondContact O-N 3.1Å; E481-Y484 CarbonylContact O-C 3.59Å; E481-Y484 PolarHBondContact O-N 3.15Å; E481-Q485 WeakPolarHBondContact O-CB 3.49Å; E481-Q485 VanDerWaalsContact O-CG 3.23Å; E481-Q485 WeakPolarHBondContact O-CG 2.94Å; E481-Q485 PolarHBondContact O-N 2.74Å
482E36.2Very low34.9Very low145 Ų14595 Ų9568%0.67846%0.459SS*.Hα-helixtrans-54.1-42178-59.8177.8133.700113.7N480 T486N480-E482 PolarHBondContact O-N 3.06Å; N480-E482 VanDerWaalsContact O-N 3.15Å; E482-T486 WeakPolarHBondContact O-CB 3.29Å; E482-T486 PolarHBondContact O-N 3.37Å; E482-T486 PolarHBondContact O-OG1 2.98Å
483N42.6Very low35.5Very low42 Ų4286.5 Ų86.523%0.22542%0.419CS..Hα-helixtrans-69.2-38.8178.5-74.7-45.8000111.1I479 N480 E481 L487I479-N483 HydrophobicContact CG2-CB 4.29Å; N480-N483 PolarHBondContact O-N 3.12Å; E481-N483 VanDerWaalsContact C-N 3.32Å; E481-N483 PolarHBondContact O-N 3.1Å; N483-L487 PolarHBondContact O-N 3.48Å; N483-L487 VanDerWaalsContact O-N 3.1Å
484Y44.6Very low36.1Very low18 Ų1878.6 Ų78.67%0.07138%0.383CS..Hα-helixtrans-73.4-40.7178.2-175.6-95.5000112.2I352 E356 G360 N480 E481 T486 L487 K488I352-Y484 HydrophobicContact CG2-CE1 4.18Å; I352-Y484 WeakPolarHBondContact CG2-OH 3.05Å; E356-Y484 HydrophobicContact CB-CD1 4.16Å; E356-Y484 HydrophobicContact CB-CE1 3.76Å; E356-Y484 HydrophobicContact CB-CE2 4.25Å; E356-Y484 VanDerWaalsContact CD-CD1 3.47Å; E356-Y484 HydrophobicContact CG-CD1 4.44Å; E356-Y484 HydrophobicContact CG-CE1 4.11Å; E356-Y484 WeakPolarHBondContact O-CE2 3.34Å; E356-Y484 VanDerWaalsContact O-CZ 3.24Å; E356-Y484 PolarHBondContact O-OH 2.87Å; E356-Y484 VanDerWaalsContact OE1-CE1 3.26Å; E356-Y484 WeakPolarHBondContact OE1-CE1 3.42Å; E356-Y484 WeakPolarHBondContact OE2-CD1 3.43Å; G360-Y484 WeakPolarHBondContact CA-OH 3.26Å; G360-Y484 PolarHBondContact N-OH 2.97Å; N480-Y484 PolarHBondContact O-N 3.35Å; E481-Y484 CarbonylContact O-C 3.59Å; E481-Y484 PolarHBondContact O-N 3.15Å; Y484-T486 VanDerWaalsContact C-N 3.31Å; Y484-T486 PolarHBondContact O-N 3.49Å; Y484-L487 WeakPolarHBondContact O-CB 3.25Å; Y484-L487 PolarHBondContact O-N 3.12Å; Y484-L487 VanDerWaalsContact O-N 3.12Å; Y484-K488 HydrophobicContact CE1-CB 4.47Å; Y484-K488 HydrophobicContact CE1-CD 4.09Å; Y484-K488 WeakPolarHBondContact O-CB 3.16Å; Y484-K488 PolarHBondContact O-N 3.12Å
485Q38.6Very low36.7Very low85 Ų8568 Ų6840%0.39734%0.344SS..Hα-helixtrans-62.8-37.4171.9-66.5-71.9-6.100111.1E481 L487 K488 Y489E481-Q485 WeakPolarHBondContact O-CB 3.49Å; E481-Q485 VanDerWaalsContact O-CG 3.23Å; E481-Q485 WeakPolarHBondContact O-CG 2.94Å; E481-Q485 PolarHBondContact O-N 2.74Å; Q485-L487 VanDerWaalsContact C-N 3.34Å; Q485-L487 PolarHBondContact O-N 3.43Å; Q485-K488 PolarHBondContact O-N 3.23Å; Q485-Y489 WeakPolarHBondContact O-CB 3.29Å; Q485-Y489 PolarHBondContact O-N 3.01Å
486T41.4Very low37.2Very low54 Ų5465.4 Ų65.433%0.33133%0.325SS..Hα-helixtrans-62.1-41171.5-58.80000111.5E482 Y484 N490E482-T486 WeakPolarHBondContact O-CB 3.29Å; E482-T486 PolarHBondContact O-N 3.37Å; E482-T486 PolarHBondContact O-OG1 2.98Å; Y484-T486 VanDerWaalsContact C-N 3.31Å; Y484-T486 PolarHBondContact O-N 3.49Å; T486-N490 WeakPolarHBondContact O-CB 3.3Å; T486-N490 PolarHBondContact O-N 3.09Å; T486-N490 PolarHBondContact O-OD1 3.42Å
487L43.5Very low37.7Very low28 Ų2855.5 Ų55.515%0.14728%0.282CS..Hα-helixtrans-67.9-44.8175.8-84.6155.6000113.3L13 F86 N483 Y484 Q485 N490 S491L13-L487 HydrophobicContact CD1-CD1 3.41Å; L13-L487 VanDerWaalsContact CD1-CD1 3.41Å; L13-L487 HydrophobicContact CD1-CD2 3.36Å; L13-L487 HydrophobicContact CD1-CG 3.96Å; F86-L487 HydrophobicContact CE1-CD2 3.93Å; F86-L487 HydrophobicContact CZ-CD2 3.71Å; N483-L487 PolarHBondContact O-N 3.48Å; N483-L487 VanDerWaalsContact O-N 3.1Å; Y484-L487 WeakPolarHBondContact O-CB 3.25Å; Y484-L487 PolarHBondContact O-N 3.12Å; Y484-L487 VanDerWaalsContact O-N 3.12Å; Q485-L487 VanDerWaalsContact C-N 3.34Å; Q485-L487 PolarHBondContact O-N 3.43Å; L487-N490 PolarHBondContact O-N 2.88Å; L487-S491 WeakPolarHBondContact O-CB 3.33Å; L487-S491 PolarHBondContact O-N 2.95Å
488K40.7Very low38.1Very low15 Ų1553.2 Ų53.27%0.06527%0.265CS..Hα-helixtrans-57.5-56.9174.6-170.8176.7-178-179.70109.3N349 E353 E356 Y484 Q485 N490 S491 I492N349-K488 WeakPolarHBondContact OD1-CE 3.3Å; E353-K488 IonicContact OE1-NZ 3.23Å; E353-K488 PolarHBondContact OE1-NZ 2.91Å; E356-K488 IonicContact OE1-NZ 2.95Å; Y484-K488 HydrophobicContact CE1-CB 4.47Å; Y484-K488 HydrophobicContact CE1-CD 4.09Å; Y484-K488 WeakPolarHBondContact O-CB 3.16Å; Y484-K488 PolarHBondContact O-N 3.12Å; Q485-K488 PolarHBondContact O-N 3.23Å; K488-N490 VanDerWaalsContact C-N 3.34Å; K488-N490 PolarHBondContact O-N 3.29Å; K488-S491 PolarHBondContact O-N 3.39Å; K488-I492 HydrophobicContact CG-CD1 3.97Å; K488-I492 WeakPolarHBondContact O-CB 3.31Å; K488-I492 WeakPolarHBondContact O-CD1 3.44Å; K488-I492 WeakPolarHBondContact O-CG1 3.28Å; K488-I492 PolarHBondContact O-N 3.35Å
489Y38.8Very low38.7Very low70 Ų7046.3 Ų46.328%0.27523%0.233SC..Hα-helixtrans-59.7-41.3-179.8-159.9-96.3000112.4Q485 Q493Q485-Y489 WeakPolarHBondContact O-CB 3.29Å; Q485-Y489 PolarHBondContact O-N 3.01Å; Y489-Q493 HydrophobicContact CE1-CG 4.29Å; Y489-Q493 VanDerWaalsContact CE1-NE2 3.28Å; Y489-Q493 WeakPolarHBondContact O-CB 3.24Å; Y489-Q493 PolarHBondContact O-N 3.02Å
490N40Very low38.8Very low12 Ų1245.4 Ų45.46%0.06423%0.229CC..Hα-helixtrans-82.9-24.4-176.3-64.32.7000113.5P87 T486 L487 K488 T494P87-N490 VanDerWaalsContact O-CB 3.28Å; P87-N490 WeakPolarHBondContact O-CB 3.47Å; P87-N490 PolarHBondContact O-ND2 3.47Å; T486-N490 WeakPolarHBondContact O-CB 3.3Å; T486-N490 PolarHBondContact O-N 3.09Å; T486-N490 PolarHBondContact O-OD1 3.42Å; L487-N490 PolarHBondContact O-N 2.88Å; K488-N490 VanDerWaalsContact C-N 3.34Å; K488-N490 PolarHBondContact O-N 3.29Å; N490-T494 WeakPolarHBondContact O-CB 3.38Å; N490-T494 WeakPolarHBondContact O-CG2 3.12Å; N490-T494 PolarHBondContact O-N 2.84Å; N490-T494 PolarHBondContact O-OG1 3.13Å
491S38Very low38.9Very low12 Ų1242.9 Ų42.98%0.08421%0.214CC..Hα-helixtrans-68.8-48.9165.6100.40000110.1E367 L487 K488 Q493 T494 G495E367-S491 WeakPolarHBondContact OE1-CB 3.29Å; E367-S491 VanDerWaalsContact OE2-CB 3.27Å; E367-S491 WeakPolarHBondContact OE2-CB 3.39Å; E367-S491 PolarHBondContact OE2-OG 2.93Å; L487-S491 WeakPolarHBondContact O-CB 3.33Å; L487-S491 PolarHBondContact O-N 2.95Å; K488-S491 PolarHBondContact O-N 3.39Å; S491-Q493 PolarHBondContact O-N 2.93Å; S491-T494 CarbonylContact O-C 3.57Å; S491-T494 PolarHBondContact O-N 3.46Å; S491-T494 VanDerWaalsContact O-N 3.08Å; S491-T494 PolarHBondContact O-OG1 2.95Å; S491-G495 WeakPolarHBondContact O-CA 3.24Å; S491-G495 PolarHBondContact O-N 3.26Å
492I37.2Very low39Very low32 Ų3236.6 Ų36.616%0.16419%0.186CC..Hα-helixtrans-51.4-44.7173.6-66.8161.3000110.7Y343 N349 K488 G495 C496Y343-I492 HydrophobicContact CE2-CD1 4.29Å; Y343-I492 HydrophobicContact CE2-CG1 3.96Å; Y343-I492 WeakPolarHBondContact OH-CD1 3.42Å; Y343-I492 WeakPolarHBondContact OH-CG1 3.35Å; Y343-I492 WeakPolarHBondContact OH-CG2 3.23Å; N349-I492 WeakPolarHBondContact OD1-CD1 3.43Å; K488-I492 HydrophobicContact CG-CD1 3.97Å; K488-I492 WeakPolarHBondContact O-CB 3.31Å; K488-I492 WeakPolarHBondContact O-CD1 3.44Å; K488-I492 WeakPolarHBondContact O-CG1 3.28Å; K488-I492 PolarHBondContact O-N 3.35Å; I492-G495 CarbonylContact O-C 3.47Å; I492-G495 PolarHBondContact O-N 3.35Å; I492-C496 PolarHBondContact O-N 3.04Å; I492-C496 PolarHBondContact O-SG 3.12Å
493Q36.2Very low39.2Very low12 Ų1229.3 Ų29.36%0.05615%0.153CC..Hα-helixtrans-75-33.7179.3-96.4-150.431.300114.5R91 H92 C182 Y489 S491 G495R91-Q493 PolarHBondContact NH1-O 2.93Å; R91-Q493 VanDerWaalsContact NH1-O 3.15Å; R91-Q493 PolarHBondContact NH2-O 3.49Å; H92-Q493 PolarHBondContact CE1-OE1 3.4Å; C182-Q493 PolarHBondContact O-NE2 3.12Å; Y489-Q493 HydrophobicContact CE1-CG 4.29Å; Y489-Q493 VanDerWaalsContact CE1-NE2 3.28Å; Y489-Q493 WeakPolarHBondContact O-CB 3.24Å; Y489-Q493 PolarHBondContact O-N 3.02Å; S491-Q493 PolarHBondContact O-N 2.93Å; Q493-G495 VanDerWaalsContact C-N 3.26Å
494T39.3Very low39Very low7 Ų728.4 Ų28.44%0.04315%0.148CC..Hα-helixtrans-84.6-1.5172.749.80000112.9Y82 D89 R368 N490 S491Y82-T494 PolarHBondContact OH-OG1 3.31Å; D89-T494 HydrophobicContact CB-CG2 4.44Å; D89-T494 WeakPolarHBondContact OD2-CG2 3.26Å; R368-T494 PolarHBondContact NH1-O 2.98Å; R368-T494 PolarHBondContact NH2-O 3.41Å; N490-T494 WeakPolarHBondContact O-CB 3.38Å; N490-T494 WeakPolarHBondContact O-CG2 3.12Å; N490-T494 PolarHBondContact O-N 2.84Å; N490-T494 PolarHBondContact O-OG1 3.13Å; S491-T494 CarbonylContact O-C 3.57Å; S491-T494 PolarHBondContact O-N 3.46Å; S491-T494 VanDerWaalsContact O-N 3.08Å; S491-T494 PolarHBondContact O-OG1 2.95Å
495G36.8Very low38.5Very low7 Ų729.2 Ų29.27%0.07215%0.154CC..THydrogen-bonded Turntrans-107.519.417000000112.9R368 Y371 S491 I492 Q493R368-G495 VanDerWaalsContact NH2-CA 3.33Å; Y371-G495 PolarHBondContact OH-O 3.05Å; S491-G495 WeakPolarHBondContact O-CA 3.24Å; S491-G495 PolarHBondContact O-N 3.26Å; I492-G495 CarbonylContact O-C 3.47Å; I492-G495 PolarHBondContact O-N 3.35Å; Q493-G495 VanDerWaalsContact C-N 3.26Å
496C34Very low38.5Very low38 Ų3824.6 Ų24.626%0.25713%0.133SC..  trans-124.742.3164.4-61.70000109.8I492I492-C496 PolarHBondContact O-N 3.04Å; I492-C496 PolarHBondContact O-SG 3.12Å
497I36.6Very low38.3Very low8 Ų821.9 Ų21.94%0.04112%0.115CC..  trans-152.10179.8-35.2175.4000112.6Y70 R91 T101 S105 Y371 Y375Y70-I497 PolarHBondContact OH-O 3.29Å; Y70-I497 VanDerWaalsContact OH-O 3.09Å; R91-I497 VanDerWaalsContact CZ-CD1 3.49Å; T101-I497 HydrophobicContact CG2-CD1 4.16Å; T101-I497 HydrophobicContact CG2-CG2 4.13Å; S105-I497 VanDerWaalsContact OG-CG2 3.31Å; S105-I497 WeakPolarHBondContact OG-CG2 3.19Å; Y371-I497 WeakPolarHBondContact CE1-OXT 3.49Å; Y375-I497 PolarHBondContact OH-O 3.1Å; Y375-I497 PolarHBondContact OH-OXT 3.22Å

Retrieved 497 of 497 residues in 203.3 ms (Link to these results)

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